# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom E:423 ASP 3.41 0.34 3.62 0.35 3.20 0.15 3.06 0.03 3.35 0.05 E:424 LEU 3.64 0.45 4.02 0.21 3.26 0.25 nan nan 3.26 0.25 E:425 THR 4.34 0.45 4.66 0.18 3.90 0.31 3.54 0.00 4.08 0.21 E:426 LYS 3.57 0.43 3.99 0.22 3.24 0.23 2.95 0.00 3.32 0.20 E:427 LEU 3.77 0.52 4.21 0.32 3.33 0.24 nan nan 3.33 0.24 E:428 LEU 4.72 1.08 5.56 0.70 3.89 0.68 nan nan 3.89 0.68 E:429 ILE 4.60 0.72 5.27 0.30 3.93 0.22 nan nan 3.93 0.22 E:430 ALA 3.70 0.40 3.86 0.26 3.05 0.00 nan nan 3.05 0.00 E:431 GLU 4.11 0.85 4.88 0.50 3.50 0.50 3.12 0.22 3.75 0.48 E:432 VAL 7.46 0.72 6.93 0.32 8.16 0.46 nan nan 8.16 0.46 E:433 LYS 4.20 0.77 4.79 0.69 3.73 0.45 3.01 0.00 3.91 0.29 E:434 SER 3.65 0.45 3.81 0.47 3.31 0.03 3.35 0.00 3.28 0.00 E:435 ARG 4.16 0.73 4.37 0.35 4.04 0.86 3.40 0.21 4.52 0.84 E:436 PRO 3.74 0.57 4.10 0.51 3.26 0.07 nan nan 3.26 0.07 E:437 GLY 4.20 0.57 4.20 0.57 nan nan nan nan nan nan E:438 ASN 6.30 0.96 5.48 0.27 7.13 0.62 7.55 0.28 6.71 0.59 E:439 SER 3.91 0.54 4.22 0.39 3.30 0.09 3.21 0.00 3.38 0.00 E:440 GLN 4.44 1.13 5.58 0.45 3.53 0.53 3.02 0.04 3.86 0.43 E:441 CYS 6.26 0.72 5.95 0.64 6.89 0.37 7.26 0.00 6.52 0.00 E:442 CYS 6.52 0.69 6.09 0.42 7.37 0.04 7.32 0.00 7.41 0.00 E:443 ASP 8.12 1.56 6.71 0.28 9.54 0.89 9.85 1.07 9.23 0.49 E:444 CYS 5.34 0.90 4.97 0.90 6.07 0.11 5.96 0.00 6.18 0.00 E:445 GLY 3.96 0.45 3.96 0.45 nan nan nan nan nan nan E:446 ALA 4.23 0.29 4.32 0.26 3.89 0.00 nan nan 3.89 0.00 E:447 ALA 3.58 0.36 3.73 0.24 3.00 0.00 nan nan 3.00 0.00 E:448 ASP 3.77 0.52 4.15 0.39 3.38 0.30 3.14 0.17 3.63 0.17 E:449 PRO 5.39 0.65 4.90 0.24 6.03 0.42 nan nan 6.03 0.42 E:450 THR 4.73 1.10 5.50 0.78 3.70 0.37 3.37 0.00 3.86 0.35 E:451 TRP 6.52 1.38 7.76 0.99 6.03 1.18 4.16 0.00 6.24 1.06 E:452 LEU 10.05 0.50 9.94 0.44 10.16 0.53 nan nan 10.16 0.53 E:453 SER 10.16 0.63 9.93 0.61 10.63 0.32 10.32 0.00 10.95 0.00 E:454 THR 6.86 0.91 7.61 0.25 5.87 0.34 5.40 0.00 6.11 0.05 E:455 ASN 7.83 0.83 8.29 0.92 7.37 0.33 7.59 0.04 7.14 0.34 E:456 LEU 10.77 0.68 10.54 0.37 11.01 0.83 nan nan 11.01 0.83 E:457 GLY 9.97 0.56 9.97 0.56 nan nan nan nan nan nan E:458 VAL 11.03 0.56 11.40 0.30 10.54 0.43 nan nan 10.54 0.43 E:459 LEU 9.22 0.80 9.41 0.68 9.02 0.87 nan nan 9.02 0.87 E:460 THR 7.95 1.36 7.07 1.07 9.12 0.61 8.84 0.00 9.27 0.70 E:461 CYS 4.68 0.70 4.99 0.61 4.05 0.39 4.45 0.00 3.66 0.00 E:462 ILE 4.26 0.87 4.85 0.80 3.67 0.42 nan nan 3.67 0.42 E:463 GLN 4.75 1.25 5.92 0.91 3.80 0.37 3.57 0.18 3.96 0.38 E:464 CYS 8.24 0.99 8.39 1.18 7.94 0.06 7.88 0.00 8.00 0.00 E:465 SER 8.89 0.87 9.22 0.85 8.23 0.45 8.69 0.00 7.78 0.00 E:466 GLY 8.78 0.43 8.78 0.43 nan nan nan nan nan nan E:467 VAL 8.41 0.66 8.39 0.82 8.43 0.36 nan nan 8.43 0.36 E:468 HIS 10.74 1.58 8.92 0.76 11.95 0.32 12.12 0.02 11.87 0.37 E:469 ARG 8.57 1.12 7.60 0.97 9.12 0.78 8.79 0.84 9.36 0.62 E:470 GLU 4.70 0.78 4.97 0.92 4.48 0.55 4.34 0.66 4.58 0.44 E:471 LEU 5.28 0.79 4.76 0.34 5.81 0.76 nan nan 5.81 0.76 E:472 GLY 6.37 0.46 6.37 0.46 nan nan nan nan nan nan E:473 VAL 5.43 0.59 5.37 0.68 5.51 0.42 nan nan 5.51 0.42 E:474 ARG 3.75 0.45 4.19 0.27 3.50 0.33 3.27 0.31 3.68 0.22 E:475 PHE 5.25 1.33 6.58 0.78 4.48 0.92 nan nan 4.48 0.92 E:476 SER 8.67 1.14 7.91 0.35 10.19 0.40 10.59 0.00 9.79 0.00 E:477 ARG 5.56 1.48 7.35 0.25 4.54 0.72 3.99 0.49 4.96 0.58 E:478 MET 9.41 1.04 8.47 0.41 10.36 0.43 10.92 0.00 10.18 0.33 E:479 GLN 6.97 1.48 8.51 0.30 5.74 0.68 5.34 0.37 6.00 0.72 E:480 SER 6.85 0.94 7.35 0.64 5.84 0.56 5.28 0.00 6.40 0.00 E:481 LEU 5.77 1.11 5.07 1.09 6.48 0.54 nan nan 6.48 0.54 E:482 THR 3.83 0.47 4.13 0.37 3.43 0.21 3.34 0.00 3.47 0.25 E:483 LEU 4.87 0.84 5.53 0.30 4.20 0.66 nan nan 4.20 0.66 E:484 ASP 6.62 1.07 5.74 0.75 7.49 0.46 7.75 0.42 7.23 0.33 E:485 LEU 3.89 0.61 4.41 0.33 3.38 0.33 nan nan 3.38 0.33 E:486 LEU 4.94 0.94 4.07 0.34 5.82 0.33 nan nan 5.82 0.33 E:487 GLY 4.03 0.55 4.03 0.55 nan nan nan nan nan nan E:488 PRO 3.71 0.41 4.03 0.18 3.28 0.17 nan nan 3.28 0.17 E:489 SER 3.80 0.56 4.06 0.52 3.28 0.08 3.36 0.00 3.20 0.00 E:490 GLU 4.71 1.27 5.90 0.82 3.77 0.59 3.29 0.12 4.09 0.56 E:491 LEU 6.37 0.76 5.84 0.49 6.91 0.57 nan nan 6.91 0.57 E:492 LEU 4.72 0.70 5.28 0.28 4.17 0.52 nan nan 4.17 0.52 E:493 LEU 8.05 0.90 7.23 0.32 8.88 0.38 nan nan 8.88 0.38 E:494 ALA 7.64 0.70 7.37 0.51 8.71 0.00 nan nan 8.71 0.00 E:495 LEU 4.48 0.70 4.90 0.73 4.07 0.33 nan nan 4.07 0.33 E:496 ASN 3.99 0.54 4.19 0.54 3.80 0.47 3.38 0.12 4.21 0.31 E:497 MET 5.51 0.85 4.77 0.29 6.24 0.53 6.51 0.00 6.15 0.58 E:498 GLY 6.53 0.21 6.53 0.21 nan nan nan nan nan nan E:499 ASN 6.29 0.79 5.97 0.76 6.62 0.69 7.10 0.50 6.14 0.49 E:500 THR 3.90 0.58 4.31 0.36 3.36 0.33 3.32 0.00 3.38 0.40 E:501 SER 4.41 0.79 4.84 0.56 3.55 0.39 3.16 0.00 3.94 0.00 E:502 PHE 8.70 1.83 6.73 0.37 9.83 1.29 nan nan 9.83 1.29 E:503 ASN 4.83 0.56 4.87 0.51 4.79 0.60 5.08 0.65 4.49 0.34 E:504 GLU 3.74 0.43 4.09 0.26 3.46 0.32 3.13 0.20 3.68 0.16 E:505 VAL 6.28 0.47 6.15 0.35 6.45 0.55 nan nan 6.45 0.55 E:506 MET 8.30 0.92 7.46 0.41 9.14 0.34 9.31 0.00 9.08 0.38 E:507 GLU 4.78 0.68 4.94 0.71 4.66 0.63 4.48 0.89 4.78 0.33 E:508 ALA 3.79 0.50 3.81 0.56 3.72 0.00 nan nan 3.72 0.00 E:509 GLN 3.64 0.36 3.65 0.34 3.63 0.37 3.60 0.49 3.65 0.27 E:510 LEU 4.21 0.44 4.02 0.37 4.40 0.43 nan nan 4.40 0.43 E:511 PRO 3.67 0.36 3.93 0.24 3.32 0.09 nan nan 3.32 0.09 E:512 SER 3.44 0.33 3.60 0.29 3.12 0.10 3.03 0.00 3.22 0.00 E:513 HIS 3.51 0.34 3.85 0.16 3.28 0.21 3.36 0.22 3.24 0.20 E:514 GLY 3.30 0.18 3.30 0.18 nan nan nan nan nan nan E:515 GLY 3.87 0.34 3.87 0.34 nan nan nan nan nan nan E:516 PRO 3.64 0.33 3.86 0.24 3.36 0.21 nan nan 3.36 0.21 E:517 LYS 4.10 0.58 4.30 0.62 3.93 0.49 3.07 0.00 4.15 0.26 E:518 PRO 4.59 0.75 4.08 0.33 5.28 0.57 nan nan 5.28 0.57 E:519 SER 4.09 0.80 4.54 0.58 3.19 0.01 3.20 0.00 3.18 0.00 E:520 ALA 3.85 0.35 4.01 0.17 3.21 0.00 nan nan 3.21 0.00 E:521 GLU 3.50 0.36 3.76 0.36 3.29 0.19 3.23 0.21 3.33 0.16 E:522 SER 3.72 0.23 3.77 0.22 3.62 0.22 3.40 0.00 3.84 0.00 E:523 ASP 3.69 0.67 4.13 0.69 3.25 0.17 3.13 0.13 3.36 0.12 E:524 MET 4.25 0.59 4.36 0.43 4.13 0.70 4.64 0.00 3.96 0.74 E:525 GLY 3.83 0.32 3.83 0.32 nan nan nan nan nan nan E:526 THR 4.06 0.59 4.51 0.28 3.47 0.34 3.28 0.00 3.57 0.38 E:527 ARG 6.19 0.78 6.79 0.52 5.85 0.69 5.45 0.48 6.15 0.67 E:528 ARG 4.62 1.17 5.91 0.46 3.89 0.72 3.38 0.20 4.26 0.74 E:529 ASP 3.75 0.56 4.18 0.49 3.33 0.17 3.16 0.05 3.50 0.05 E:530 TYR 5.95 0.94 5.28 0.67 6.29 0.87 6.45 0.00 6.26 0.92 E:531 ILE 8.57 1.30 7.34 0.39 9.80 0.46 nan nan 9.80 0.46 E:532 MET 4.35 0.84 5.00 0.65 3.70 0.40 3.65 0.00 3.72 0.47 E:533 ALA 5.11 0.69 5.28 0.68 4.44 0.00 nan nan 4.44 0.00 E:534 LYS 8.46 0.90 7.87 0.65 8.94 0.77 7.60 0.00 9.28 0.43 E:535 TYR 9.33 1.92 7.05 1.05 10.47 1.04 11.06 0.00 10.38 1.08 E:536 VAL 4.24 0.85 4.55 0.93 3.83 0.46 nan nan 3.83 0.46 E:537 GLU 3.59 0.40 3.89 0.37 3.35 0.22 3.22 0.12 3.43 0.23 E:538 HIS 4.55 0.54 4.76 0.33 4.40 0.61 4.17 0.61 4.52 0.57 E:539 ARG 3.64 0.47 4.09 0.39 3.39 0.29 3.24 0.35 3.50 0.18 E:540 PHE 4.94 0.78 5.41 0.52 4.68 0.78 nan nan 4.68 0.78 E:541 ALA 6.10 0.68 5.85 0.51 7.12 0.00 nan nan 7.12 0.00 E:542 ARG 4.05 0.77 4.91 0.52 3.56 0.33 3.42 0.18 3.68 0.37 E:543 ARG 3.47 0.33 3.65 0.37 3.36 0.25 3.14 0.11 3.53 0.19 E:544 CYS 3.70 0.28 3.63 0.18 3.82 0.37 4.20 0.00 3.45 0.00 E:545 THR 3.61 0.40 3.83 0.29 3.30 0.32 2.95 0.00 3.48 0.25 E:547 GLU 4.33 0.68 4.85 0.50 3.92 0.49 3.72 0.51 4.05 0.43 E:548 PRO 4.05 0.79 4.65 0.48 3.25 0.19 nan nan 3.25 0.19 E:549 GLN 3.79 0.57 4.38 0.25 3.31 0.17 3.16 0.12 3.40 0.12 E:550 ARG 3.96 0.56 4.55 0.33 3.63 0.34 3.47 0.42 3.74 0.18 E:551 LEU 7.36 1.05 6.39 0.29 8.33 0.49 nan nan 8.33 0.49 E:552 TRP 4.57 0.77 5.13 0.64 4.34 0.70 3.35 0.00 4.45 0.65 E:553 THR 3.79 0.49 4.18 0.19 3.26 0.20 3.27 0.00 3.26 0.24 E:554 ALA 5.32 0.65 5.43 0.68 4.88 0.00 nan nan 4.88 0.00 E:555 ILE 7.26 0.98 6.46 0.36 8.06 0.71 nan nan 8.06 0.71 E:556 CYS 3.90 0.62 4.20 0.54 3.29 0.11 3.40 0.00 3.18 0.00 E:557 ASN 3.76 0.48 4.01 0.40 3.50 0.42 3.14 0.04 3.87 0.28 E:558 ARG 4.00 0.64 4.35 0.55 3.80 0.60 3.29 0.33 4.19 0.46 E:559 ASP 4.01 0.66 4.49 0.53 3.52 0.34 3.29 0.28 3.76 0.21 E:560 LEU 4.71 0.79 4.73 0.75 4.70 0.82 nan nan 4.70 0.82 E:561 LEU 4.12 0.66 4.59 0.53 3.65 0.38 nan nan 3.65 0.38 E:562 SER 5.02 1.02 5.60 0.69 3.87 0.42 3.44 0.00 4.29 0.00 E:563 VAL 8.56 0.94 8.24 0.90 9.00 0.80 nan nan 9.00 0.80 E:564 LEU 8.51 0.55 8.50 0.21 8.51 0.75 nan nan 8.51 0.75 E:565 GLU 5.80 1.66 7.49 0.37 4.44 0.86 3.60 0.04 5.00 0.67 E:566 ALA 7.68 0.80 7.48 0.78 8.45 0.00 nan nan 8.45 0.00 E:567 PHE 5.76 0.92 5.67 1.17 5.81 0.73 nan nan 5.81 0.73 E:568 ALA 5.78 0.97 5.43 0.73 7.22 0.00 nan nan 7.22 0.00 E:569 ASN 4.69 0.81 4.30 0.78 5.07 0.65 5.20 0.89 4.94 0.09 E:570 GLY 3.44 0.35 3.44 0.35 nan nan nan nan nan nan E:571 GLN 4.59 0.59 4.31 0.18 4.81 0.70 4.27 0.67 5.16 0.45 E:572 ASP 4.07 0.81 4.72 0.67 3.43 0.11 3.37 0.13 3.49 0.00 E:573 PHE 6.72 0.81 6.11 0.47 7.08 0.75 nan nan 7.08 0.75 E:574 GLY 4.20 0.80 4.20 0.80 nan nan nan nan nan nan E:575 GLN 3.91 0.71 4.45 0.63 3.47 0.41 3.07 0.05 3.73 0.32 E:576 PRO 3.88 0.62 4.18 0.52 3.48 0.48 nan nan 3.48 0.48 E:577 LEU 5.23 0.61 5.20 0.48 5.26 0.71 nan nan 5.26 0.71 E:578 PRO 3.84 0.51 4.23 0.26 3.31 0.21 nan nan 3.31 0.21 E:579 GLY 4.07 0.53 4.07 0.53 nan nan nan nan nan nan E:580 PRO 3.53 0.24 3.66 0.14 3.34 0.22 nan nan 3.34 0.22 E:581 ASP 3.39 0.31 3.62 0.24 3.15 0.16 3.01 0.05 3.29 0.10 E:582 ALA 3.49 0.23 3.57 0.18 3.15 0.00 nan nan 3.15 0.00 E:583 GLN 3.83 0.53 4.16 0.23 3.57 0.55 3.05 0.01 3.91 0.44 E:584 ALA 3.52 0.35 3.62 0.33 3.12 0.00 nan nan 3.12 0.00 E:585 PRO 3.63 0.38 3.88 0.29 3.30 0.19 nan nan 3.30 0.19 E:586 GLU 3.67 0.37 3.84 0.31 3.53 0.35 3.25 0.07 3.71 0.35 E:587 GLU 5.24 1.08 6.16 0.62 4.51 0.77 3.90 0.52 4.92 0.63 E:588 LEU 6.34 1.27 7.39 0.98 5.29 0.24 nan nan 5.29 0.24 E:589 VAL 9.81 0.91 9.86 0.84 9.73 0.99 nan nan 9.73 0.99 E:590 LEU 10.25 0.94 11.03 0.18 9.48 0.72 nan nan 9.48 0.72 E:591 HIS 8.45 0.80 9.23 0.61 7.93 0.36 7.86 0.24 7.96 0.41 E:592 LEU 6.67 1.17 7.52 0.70 5.81 0.88 nan nan 5.81 0.88 E:593 ALA 8.91 1.28 8.33 0.59 11.25 0.00 nan nan 11.25 0.00 E:594 VAL 8.61 1.55 7.62 1.18 9.93 0.82 nan nan 9.93 0.82 E:595 LYS 4.44 1.02 4.89 1.14 4.08 0.74 3.14 0.00 4.32 0.64 E:596 VAL 3.85 0.48 3.94 0.33 3.74 0.61 nan nan 3.74 0.61 E:597 ALA 4.46 0.84 4.10 0.48 5.91 0.00 nan nan 5.91 0.00 E:598 ASN 3.99 0.65 4.45 0.46 3.53 0.44 3.57 0.59 3.49 0.20 E:599 GLN 3.63 0.48 4.13 0.19 3.23 0.18 3.04 0.10 3.36 0.08 E:600 ALA 3.77 0.39 3.94 0.17 3.06 0.00 nan nan 3.06 0.00 E:601 SER 6.22 0.68 6.15 0.80 6.37 0.27 6.63 0.00 6.10 0.00 E:602 LEU 5.82 1.01 6.70 0.50 4.95 0.49 nan nan 4.95 0.49 E:603 PRO 6.21 1.19 7.06 0.84 5.08 0.37 nan nan 5.08 0.37 E:604 LEU 7.70 1.86 9.02 1.55 6.37 1.01 nan nan 6.37 1.01 E:605 VAL 9.58 0.39 9.60 0.47 9.56 0.22 nan nan 9.56 0.22 E:606 ASP 7.73 0.57 7.87 0.56 7.17 0.00 nan nan 7.17 0.00 E:607 PHE 9.64 0.73 8.85 0.58 10.10 0.29 nan nan 10.10 0.29 E:608 ILE 9.40 1.77 8.05 1.17 10.76 1.13 nan nan 10.76 1.13 E:609 ILE 6.04 1.18 5.62 1.17 6.45 1.03 nan nan 6.45 1.03 E:610 GLN 4.88 0.35 4.84 0.32 4.92 0.37 5.02 0.45 4.85 0.28 E:611 ASN 5.63 1.28 4.50 0.51 6.76 0.66 7.11 0.73 6.41 0.32 E:612 GLY 4.12 0.17 4.12 0.17 nan nan nan nan nan nan E:613 GLY 4.25 0.61 4.25 0.61 nan nan nan nan nan nan E:614 HIS 3.85 0.48 4.33 0.33 3.53 0.23 3.30 0.01 3.64 0.21 E:615 LEU 4.89 0.70 4.83 0.73 4.95 0.66 nan nan 4.95 0.66 E:616 ASP 3.82 0.49 3.72 0.32 3.93 0.60 4.10 0.79 3.75 0.24 E:617 ALA 4.19 0.58 4.30 0.60 3.77 0.00 nan nan 3.77 0.00 E:618 LYS 3.97 0.73 4.59 0.60 3.47 0.31 3.36 0.00 3.49 0.34 E:619 ALA 3.53 0.16 3.56 0.17 3.45 0.00 nan nan 3.45 0.00 E:621 ASP 3.49 0.37 3.75 0.35 3.22 0.10 3.15 0.04 3.29 0.09 E:622 GLY 4.73 0.59 4.73 0.59 nan nan nan nan nan nan E:623 ASN 5.84 1.18 6.85 0.53 4.82 0.68 4.46 0.72 5.18 0.39 E:624 THR 7.78 0.99 8.34 0.56 7.03 0.94 8.04 0.00 6.53 0.76 E:625 ALA 10.21 0.65 10.31 0.69 9.81 0.00 nan nan 9.81 0.00 E:626 LEU 9.35 1.06 10.35 0.13 8.36 0.49 nan nan 8.36 0.49 E:627 HIS 8.14 0.59 8.63 0.58 7.81 0.30 7.66 0.07 7.89 0.35 E:628 TYR 6.39 1.47 7.92 0.36 5.62 1.20 3.89 0.00 5.87 1.07 E:629 ALA 9.19 0.69 8.95 0.55 10.17 0.00 nan nan 10.17 0.00 E:630 ALA 8.62 0.94 8.39 0.92 9.54 0.00 nan nan 9.54 0.00 E:631 LEU 4.74 1.23 5.49 1.14 3.98 0.77 nan nan 3.98 0.77 E:632 TYR 4.08 0.68 4.27 0.63 3.99 0.68 3.32 0.00 4.08 0.68 E:633 ASN 3.99 0.62 4.49 0.51 3.50 0.17 3.36 0.13 3.63 0.04 E:634 GLN 5.19 0.83 5.70 0.52 4.78 0.81 3.99 0.21 5.32 0.59 E:635 PRO 4.91 0.91 5.60 0.47 4.00 0.40 nan nan 4.00 0.40 E:636 ASP 4.52 0.85 5.29 0.20 3.75 0.47 3.32 0.09 4.18 0.25 E:637 CYS 7.35 0.58 7.34 0.69 7.38 0.27 7.11 0.00 7.66 0.00 E:638 LEU 7.10 1.04 6.39 0.89 7.80 0.61 nan nan 7.80 0.61 E:639 LYS 3.87 0.65 4.47 0.47 3.40 0.26 3.01 0.00 3.50 0.20 E:640 LEU 5.62 0.32 5.72 0.30 5.52 0.31 nan nan 5.52 0.31 E:641 LEU 7.82 1.40 6.54 0.34 9.10 0.74 nan nan 9.10 0.74 E:642 LEU 4.07 0.54 4.14 0.69 3.99 0.29 nan nan 3.99 0.29 E:643 LYS 3.78 0.31 3.72 0.23 3.82 0.35 4.44 0.00 3.67 0.18 E:644 GLY 4.62 0.22 4.62 0.22 nan nan nan nan nan nan E:645 ARG 3.79 0.49 4.05 0.36 3.65 0.49 3.66 0.64 3.63 0.34 E:646 ALA 4.30 0.85 3.93 0.46 5.79 0.00 nan nan 5.79 0.00 E:647 LEU 4.05 0.72 4.55 0.57 3.55 0.46 nan nan 3.55 0.46 E:648 VAL 3.87 0.35 3.79 0.42 3.99 0.16 nan nan 3.99 0.16 E:649 GLY 3.60 0.31 3.60 0.31 nan nan nan nan nan nan E:650 THR 4.31 0.70 4.53 0.62 4.02 0.69 4.92 0.00 3.57 0.33 E:651 VAL 3.83 0.48 4.12 0.37 3.44 0.33 nan nan 3.44 0.33 E:652 ASN 4.82 0.77 4.30 0.49 5.34 0.62 5.13 0.82 5.55 0.11 E:653 GLU 3.55 0.49 3.90 0.52 3.26 0.21 3.01 0.06 3.43 0.01 E:654 ALA 3.48 0.31 3.55 0.31 3.22 0.00 nan nan 3.22 0.00 E:655 GLY 3.65 0.33 3.65 0.33 nan nan nan nan nan nan E:656 GLU 4.64 0.90 5.40 0.59 4.03 0.58 3.55 0.01 4.34 0.56 E:657 THR 4.91 1.09 5.77 0.55 3.77 0.27 3.77 0.00 3.76 0.33 E:658 ALA 6.79 0.44 6.79 0.49 6.80 0.00 nan nan 6.80 0.00 E:659 LEU 4.77 0.84 5.54 0.09 4.00 0.46 nan nan 4.00 0.46 E:660 ASP 4.10 0.68 4.62 0.43 3.57 0.42 3.23 0.21 3.92 0.27 E:661 ILE 6.02 0.35 6.20 0.29 5.85 0.32 nan nan 5.85 0.32 E:662 ALA 6.80 0.88 6.56 0.82 7.78 0.00 nan nan 7.78 0.00 E:663 ARG 3.85 0.66 4.51 0.59 3.47 0.29 3.45 0.25 3.48 0.31 E:664 LYS 3.73 0.50 4.02 0.34 3.49 0.48 2.92 0.00 3.64 0.42 E:665 LYS 3.86 0.63 4.30 0.55 3.51 0.44 3.02 0.00 3.64 0.40 E:666 HIS 3.64 0.55 4.12 0.58 3.32 0.15 3.16 0.08 3.40 0.12 E:667 HIS 4.33 0.69 4.81 0.37 4.01 0.66 3.89 0.70 4.06 0.63 E:668 LYS 3.55 0.51 4.09 0.18 3.12 0.17 2.89 0.00 3.17 0.14 E:669 GLU 3.88 0.68 4.53 0.47 3.36 0.21 3.12 0.08 3.51 0.09 E:670 CYS 6.86 0.56 6.57 0.39 7.43 0.37 7.06 0.00 7.81 0.00 E:671 GLU 4.52 0.59 4.93 0.45 4.19 0.47 4.09 0.66 4.26 0.25 E:672 GLU 3.65 0.45 4.03 0.33 3.35 0.27 3.08 0.09 3.53 0.18 E:673 LEU 4.27 0.43 4.59 0.25 3.96 0.33 nan nan 3.96 0.33 E:674 LEU 6.32 1.03 5.45 0.53 7.19 0.57 nan nan 7.19 0.57 E:675 GLU 3.70 0.59 4.17 0.52 3.33 0.29 3.00 0.05 3.54 0.16 E:676 GLN 3.68 0.43 4.08 0.16 3.37 0.30 3.05 0.12 3.58 0.16 E:677 ALA 4.02 0.42 3.94 0.43 4.36 0.00 nan nan 4.36 0.00 E:678 GLN 3.55 0.44 3.79 0.51 3.35 0.24 3.36 0.36 3.34 0.11 E:679 ALA 3.25 0.37 3.37 0.32 2.80 0.00 nan nan 2.80 0.00 E:11 ASN 3.39 0.37 3.49 0.34 2.96 0.00 nan nan 2.96 0.00 E:12 LYS 3.89 0.61 4.03 0.61 3.31 0.00 nan nan 3.31 0.00 E:13 GLU 3.68 0.40 3.86 0.19 2.95 0.00 nan nan 2.95 0.00 E:14 MET 5.48 0.73 4.85 0.42 6.11 0.30 6.26 0.00 6.06 0.33 E:15 ARG 4.32 0.93 5.23 0.82 3.80 0.49 3.88 0.69 3.74 0.23 E:16 ILE 8.91 1.20 8.06 0.70 9.77 0.96 nan nan 9.77 0.96 E:17 LEU 10.12 1.19 10.96 1.14 9.27 0.31 nan nan 9.27 0.31 E:18 MET 12.63 0.40 12.47 0.40 12.79 0.33 12.38 0.00 12.92 0.27 E:19 LEU 11.99 1.10 12.98 0.38 11.00 0.56 nan nan 11.00 0.56 E:20 GLY 11.50 0.53 11.50 0.53 nan nan nan nan nan nan E:21 LEU 9.00 1.56 10.42 0.65 7.58 0.66 nan nan 7.58 0.66 E:22 ASP 8.92 0.94 9.66 0.27 8.17 0.77 7.62 0.04 8.73 0.74 E:23 ALA 9.83 0.38 9.88 0.41 9.64 0.00 nan nan 9.64 0.00 E:24 ALA 10.89 0.60 10.67 0.46 11.76 0.00 nan nan 11.76 0.00 E:25 GLY 9.25 0.22 9.25 0.22 nan nan nan nan nan nan E:26 LYS 10.25 0.93 9.35 0.31 10.96 0.59 10.47 0.00 11.08 0.60 E:27 THR 6.25 1.02 6.97 0.54 5.31 0.69 5.92 0.00 5.00 0.65 E:28 THR 7.30 0.44 7.54 0.39 6.99 0.28 6.89 0.00 7.03 0.34 E:29 ILE 9.76 0.66 9.17 0.32 10.35 0.30 nan nan 10.35 0.30 E:30 LEU 8.07 0.71 8.43 0.63 7.72 0.59 nan nan 7.72 0.59 E:31 TYR 4.69 1.23 6.35 0.35 3.86 0.34 3.40 0.00 3.92 0.31 E:32 LYS 5.54 1.25 6.40 0.71 4.84 1.16 3.41 0.00 5.20 1.02 E:33 LEU 6.35 1.21 5.51 0.99 7.18 0.72 nan nan 7.18 0.72 E:34 LYS 4.20 0.81 4.45 0.80 4.00 0.77 2.97 0.00 4.26 0.64 E:35 LEU 3.86 0.58 3.98 0.56 3.74 0.57 nan nan 3.74 0.57 E:36 GLY 3.67 0.36 3.67 0.36 nan nan nan nan nan nan E:37 GLN 3.85 0.72 4.42 0.64 3.40 0.38 3.02 0.03 3.65 0.29 E:38 SER 3.80 0.35 3.90 0.38 3.61 0.11 3.71 0.00 3.50 0.00 E:39 VAL 4.01 0.52 4.39 0.27 3.50 0.26 nan nan 3.50 0.26 E:40 THR 3.78 0.39 3.95 0.35 3.55 0.33 3.21 0.00 3.73 0.26 E:41 THR 4.98 0.47 4.96 0.51 5.01 0.41 5.57 0.00 4.73 0.13 E:42 ILE 4.20 0.60 4.68 0.27 3.73 0.46 nan nan 3.73 0.46 E:43 PRO 5.89 0.99 5.22 0.77 6.78 0.31 nan nan 6.78 0.31 E:44 THR 4.61 0.67 4.71 0.51 4.48 0.83 5.56 0.00 3.94 0.39 E:45 VAL 3.61 0.34 3.85 0.24 3.29 0.12 nan nan 3.29 0.12 E:46 GLY 3.93 0.61 3.93 0.61 nan nan nan nan nan nan E:47 PHE 4.14 0.66 4.32 0.54 4.04 0.71 nan nan 4.04 0.71 E:48 ASN 4.54 0.83 5.16 0.49 3.92 0.61 3.43 0.24 4.41 0.45 E:49 VAL 3.87 0.32 4.01 0.34 3.67 0.13 nan nan 3.67 0.13 E:50 GLU 4.56 0.80 5.07 0.28 4.15 0.85 3.32 0.16 4.71 0.65 E:51 THR 4.16 0.49 4.49 0.34 3.71 0.22 3.42 0.00 3.86 0.07 E:52 VAL 5.50 0.43 5.44 0.37 5.58 0.49 nan nan 5.58 0.49 E:53 THR 3.60 0.44 3.82 0.45 3.30 0.18 3.30 0.00 3.30 0.22 E:54 TYR 4.37 0.64 4.61 0.50 4.26 0.67 3.29 0.00 4.39 0.60 E:55 LYS 3.57 0.32 3.78 0.16 3.41 0.32 3.17 0.00 3.47 0.33 E:56 ASN 3.53 0.29 3.76 0.18 3.31 0.19 3.12 0.06 3.49 0.02 E:57 VAL 4.98 0.43 5.12 0.48 4.80 0.23 nan nan 4.80 0.23 E:58 LYS 4.43 1.07 5.52 0.39 3.56 0.46 2.93 0.00 3.72 0.38 E:59 PHE 7.65 0.81 6.72 0.27 8.18 0.46 nan nan 8.18 0.46 E:60 ASN 4.82 1.11 5.88 0.28 3.77 0.41 3.46 0.25 4.08 0.29 E:61 VAL 7.86 1.26 6.87 0.44 9.18 0.63 nan nan 9.18 0.63 E:62 TRP 5.71 2.09 8.52 0.92 4.58 1.14 3.93 0.00 4.65 1.18 E:63 ASP 8.12 0.75 8.34 0.67 7.89 0.76 7.66 1.00 8.13 0.21 E:64 VAL 7.67 0.98 8.34 0.58 6.77 0.62 nan nan 6.77 0.62 E:65 GLY 7.61 0.35 7.61 0.35 nan nan nan nan nan nan E:66 GLY 9.12 0.55 9.12 0.55 nan nan nan nan nan nan E:67 GLN 7.70 0.84 7.35 0.95 7.99 0.62 8.60 0.13 7.58 0.45 E:68 ASP 4.35 0.66 4.57 0.82 4.13 0.32 4.12 0.45 4.13 0.02 E:69 LYS 3.59 0.42 3.87 0.45 3.36 0.18 3.03 0.00 3.44 0.08 E:70 ILE 4.89 0.68 5.14 0.46 4.65 0.77 nan nan 4.65 0.77 E:71 ARG 5.54 0.45 5.75 0.19 5.42 0.50 5.23 0.65 5.57 0.29 E:72 PRO 3.96 0.50 4.34 0.19 3.45 0.30 nan nan 3.45 0.30 E:73 LEU 4.25 0.76 4.93 0.21 3.57 0.43 nan nan 3.57 0.43 E:74 TRP 7.67 0.83 6.49 0.23 8.15 0.40 8.21 0.00 8.14 0.42 E:75 ARG 3.79 0.68 4.44 0.66 3.42 0.32 3.14 0.18 3.62 0.22 E:76 HIS 3.52 0.45 3.95 0.38 3.24 0.19 3.04 0.01 3.34 0.15 E:77 TYR 4.66 0.73 5.21 0.37 4.38 0.71 3.30 0.00 4.53 0.62 E:78 TYR 5.74 0.59 5.58 0.31 5.82 0.68 5.75 0.00 5.83 0.73 E:79 THR 3.75 0.60 4.13 0.51 3.24 0.21 3.19 0.00 3.26 0.25 E:80 GLY 3.44 0.21 3.44 0.21 nan nan nan nan nan nan E:81 THR 5.30 1.15 4.40 0.45 6.49 0.55 6.22 0.00 6.63 0.63 E:82 GLN 4.34 0.75 5.08 0.20 3.75 0.45 3.40 0.30 3.98 0.38 E:83 GLY 7.69 0.98 7.69 0.98 nan nan nan nan nan nan E:84 LEU 10.66 0.90 10.14 0.88 11.17 0.57 nan nan 11.17 0.57 E:85 ILE 13.26 0.60 13.16 0.75 13.35 0.38 nan nan 13.35 0.38 E:86 PHE 12.43 1.07 13.55 0.32 11.79 0.79 nan nan 11.79 0.79 E:87 VAL 12.70 0.57 13.00 0.41 12.31 0.50 nan nan 12.31 0.50 E:88 VAL 12.23 0.65 11.93 0.68 12.64 0.27 nan nan 12.64 0.27 E:89 ASP 9.84 1.05 10.42 0.88 9.25 0.87 8.53 0.48 9.97 0.49 E:90 CYS 8.22 0.97 7.97 1.09 8.72 0.26 8.97 0.00 8.46 0.00 E:91 ALA 5.40 0.94 5.34 1.05 5.61 0.00 nan nan 5.61 0.00 E:92 ASP 6.21 0.45 6.19 0.43 6.23 0.47 5.92 0.43 6.54 0.27 E:93 ARG 4.37 0.79 5.31 0.17 3.83 0.40 3.64 0.30 3.97 0.40 E:94 ASP 4.12 0.60 4.49 0.66 3.75 0.11 3.70 0.13 3.80 0.03 E:95 ARG 5.23 0.85 5.37 0.62 5.15 0.95 5.82 0.79 4.64 0.70 E:96 ILE 6.23 0.98 5.91 0.37 6.55 1.25 nan nan 6.55 1.25 E:97 ASP 3.88 0.52 4.34 0.23 3.41 0.22 3.32 0.29 3.49 0.01 E:98 GLU 4.14 0.69 4.73 0.59 3.67 0.28 3.54 0.37 3.77 0.14 E:99 ALA 7.72 0.84 7.44 0.70 8.84 0.00 nan nan 8.84 0.00 E:100 ARG 4.91 1.37 6.38 0.65 4.06 0.86 3.49 0.21 4.49 0.91 E:101 GLN 3.96 0.66 4.46 0.56 3.55 0.40 3.12 0.11 3.84 0.24 E:102 GLU 5.69 0.85 6.16 0.48 5.31 0.88 4.72 0.76 5.70 0.73 E:103 LEU 7.96 1.12 6.92 0.39 8.99 0.46 nan nan 8.99 0.46 E:104 HIS 4.25 0.67 4.48 0.70 4.10 0.61 3.93 0.61 4.18 0.59 E:105 ARG 3.66 0.32 3.99 0.28 3.48 0.17 3.37 0.12 3.56 0.15 E:106 ILE 7.04 1.06 6.08 0.35 8.00 0.53 nan nan 8.00 0.53 E:107 ILE 6.30 0.93 5.88 0.82 6.72 0.84 nan nan 6.72 0.84 E:108 ASN 3.63 0.59 3.95 0.68 3.30 0.19 3.17 0.20 3.44 0.00 E:109 ASP 4.02 0.42 4.27 0.31 3.77 0.38 3.50 0.22 4.05 0.30 E:110 ARG 3.45 0.33 3.80 0.24 3.25 0.17 3.16 0.17 3.32 0.13 E:111 GLU 3.90 0.52 4.37 0.21 3.52 0.36 3.25 0.24 3.69 0.32 E:112 MET 5.84 1.03 4.94 0.35 6.74 0.60 6.27 0.00 6.90 0.62 E:113 ARG 3.83 0.59 4.50 0.12 3.45 0.37 3.17 0.16 3.66 0.34 E:114 ASP 3.55 0.31 3.79 0.20 3.32 0.20 3.19 0.21 3.46 0.03 E:115 ALA 4.75 0.59 4.47 0.19 5.88 0.00 nan nan 5.88 0.00 E:116 ILE 5.15 1.10 5.67 1.01 4.62 0.92 nan nan 4.62 0.92 E:117 ILE 8.05 0.94 7.91 0.73 8.18 1.10 nan nan 8.18 1.10 E:118 LEU 10.06 1.02 10.58 0.83 9.54 0.93 nan nan 9.54 0.93 E:119 ILE 9.91 0.75 9.72 0.81 10.10 0.62 nan nan 10.10 0.62 E:120 PHE 10.10 0.74 10.34 0.42 9.97 0.84 nan nan 9.97 0.84 E:121 ALA 7.69 0.74 7.81 0.79 7.22 0.00 nan nan 7.22 0.00 E:122 ASN 8.15 0.38 8.08 0.30 8.22 0.43 8.01 0.43 8.43 0.30 E:123 LYS 6.92 0.37 6.70 0.28 7.10 0.33 6.68 0.00 7.20 0.28 E:124 GLN 4.27 0.65 4.35 0.67 4.21 0.63 4.55 0.84 3.99 0.27 E:125 ASP 3.77 0.54 3.65 0.37 3.88 0.65 4.05 0.83 3.71 0.31 E:126 LEU 4.48 0.56 4.30 0.22 4.65 0.72 nan nan 4.65 0.72 E:127 PRO 3.48 0.26 3.51 0.32 3.45 0.12 nan nan 3.45 0.12 E:128 ASP 3.68 0.51 4.14 0.19 3.23 0.26 2.98 0.04 3.48 0.08 E:129 ALA 5.08 0.66 5.21 0.67 4.55 0.00 nan nan 4.55 0.00 E:130 MET 5.62 0.79 5.18 0.69 6.07 0.61 6.79 0.00 5.83 0.52 E:131 LYS 4.29 1.01 5.30 0.50 3.48 0.40 2.98 0.00 3.61 0.34 E:132 PRO 4.21 0.56 4.67 0.23 3.59 0.06 nan nan 3.59 0.06 E:133 HIS 3.67 0.43 4.16 0.20 3.35 0.12 3.32 0.13 3.36 0.11 E:134 GLU 3.93 0.58 4.50 0.30 3.48 0.26 3.32 0.17 3.58 0.26 E:135 ILE 7.57 0.99 6.68 0.45 8.47 0.41 nan nan 8.47 0.41 E:136 GLN 4.54 1.00 5.52 0.33 3.75 0.56 3.16 0.05 4.14 0.37 E:137 GLU 3.81 0.61 4.41 0.36 3.32 0.22 3.11 0.13 3.47 0.13 E:138 LYS 4.04 0.57 4.41 0.32 3.74 0.55 3.17 0.00 3.89 0.53 E:139 LEU 7.25 1.80 5.57 0.32 8.92 0.88 nan nan 8.92 0.88 E:140 GLY 3.95 0.32 3.95 0.32 nan nan nan nan nan nan E:141 LEU 5.68 1.07 4.73 0.37 6.64 0.57 nan nan 6.64 0.57 E:142 THR 3.66 0.38 3.93 0.21 3.30 0.23 3.33 0.00 3.28 0.27 E:143 ARG 3.53 0.45 3.99 0.34 3.27 0.25 3.06 0.13 3.43 0.19 E:144 ILE 4.50 0.54 4.33 0.45 4.68 0.58 nan nan 4.68 0.58 E:145 ARG 3.44 0.36 3.72 0.29 3.28 0.29 3.08 0.28 3.44 0.18 E:146 ASP 3.39 0.26 3.60 0.08 3.18 0.20 2.99 0.07 3.37 0.01 E:147 ARG 4.41 0.56 3.90 0.20 4.70 0.49 4.82 0.68 4.62 0.24 E:148 ASN 4.00 0.76 4.56 0.71 3.43 0.16 3.31 0.13 3.55 0.05 E:149 TRP 4.38 0.71 4.48 0.64 4.33 0.74 4.18 0.00 4.35 0.78 E:150 TYR 4.55 0.98 5.51 0.67 4.07 0.73 3.07 0.00 4.21 0.66 E:151 VAL 5.27 0.71 4.88 0.63 5.78 0.43 nan nan 5.78 0.43 E:152 GLN 5.34 0.93 5.93 0.43 4.87 0.94 3.95 0.11 5.48 0.74 E:153 PRO 4.03 0.56 4.47 0.25 3.45 0.23 nan nan 3.45 0.23 E:154 SER 5.50 0.91 4.88 0.10 6.74 0.39 7.13 0.00 6.34 0.00 E:155 CYS 4.97 0.76 5.44 0.43 4.02 0.04 4.05 0.00 3.98 0.00 E:156 ALA 6.72 0.52 6.54 0.40 7.47 0.00 nan nan 7.47 0.00 E:157 THR 3.87 0.63 4.22 0.63 3.39 0.08 3.51 0.00 3.33 0.01 E:158 SER 3.65 0.35 3.69 0.36 3.57 0.30 3.87 0.00 3.27 0.00 E:159 GLY 4.14 0.29 4.14 0.29 nan nan nan nan nan nan E:160 ASP 3.89 0.63 4.47 0.28 3.32 0.24 3.09 0.05 3.55 0.03 E:161 GLY 5.01 0.73 5.01 0.73 nan nan nan nan nan nan E:162 LEU 6.58 0.72 6.25 0.51 6.92 0.74 nan nan 6.92 0.74 E:163 TYR 4.04 0.64 4.90 0.18 3.62 0.21 3.42 0.00 3.64 0.21 E:164 GLU 3.93 0.58 4.49 0.25 3.48 0.33 3.33 0.34 3.58 0.29 E:165 GLY 6.77 0.47 6.77 0.47 nan nan nan nan nan nan E:166 LEU 7.55 0.93 7.06 0.58 8.04 0.96 nan nan 8.04 0.96 E:167 THR 4.36 0.73 4.89 0.46 3.65 0.30 3.72 0.00 3.61 0.36 E:168 TRP 4.93 0.92 4.99 0.46 4.90 1.05 3.57 0.00 5.05 1.00 E:169 LEU 7.93 1.44 6.62 0.48 9.23 0.72 nan nan 9.23 0.72 E:170 THR 4.35 0.81 4.64 0.86 3.97 0.52 4.49 0.00 3.71 0.45 E:171 SER 3.53 0.41 3.70 0.41 3.20 0.12 3.08 0.00 3.32 0.00 E:172 ASN 4.01 0.52 4.24 0.39 3.78 0.53 3.34 0.01 4.21 0.42 E:173 TYR 3.85 0.48 4.09 0.50 3.73 0.41 3.14 0.00 3.81 0.37 E:174 LYS 3.30 0.34 3.38 0.34 2.97 0.00 nan nan 2.97 0.00