#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9w s ASN 386 N 0.00 7.44 -0.06 1.61 0.01 -1.13 -4.80 114.94 118.01 1f9w s ASN 386 Ca 0.00 1.83 0.02 0.00 -0.71 0.00 0.00 52.86 54.01 1f9w s ASN 386 Cb 0.00 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 39.06 1f9w s ASN 386 CO 0.00 0.05 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.89 1f9w s ILE 387 N -1.41 3.31 0.03 0.60 1.01 -1.26 -2.30 121.20 121.18 1f9w s ILE 387 Ca 0.45 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.49 1f9w s ILE 387 Cb -0.22 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 1f9w s ILE 387 CO 0.27 0.59 -0.07 -0.13 0.00 0.00 0.00 174.94 175.60 1f9w s ARG 388 N -0.71 0.47 -0.05 2.79 3.00 -0.94 -5.01 118.95 118.49 1f9w s ARG 388 Ca 0.11 -0.66 0.01 0.00 0.00 0.00 0.00 55.73 55.19 1f9w s ARG 388 Cb -0.11 -0.23 0.02 0.00 0.00 0.00 0.00 34.95 34.63 1f9w s ARG 388 CO 0.01 0.04 -0.05 0.08 0.00 0.00 0.00 175.30 175.38 1f9w s VAL 389 N -1.24 0.62 0.02 3.52 1.01 -1.26 -0.88 120.40 122.19 1f9w s VAL 389 Ca -0.10 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 61.80 1f9w s VAL 389 Cb -0.09 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 1f9w s VAL 389 CO 0.00 0.25 -0.22 -0.31 0.00 0.00 0.00 175.10 174.82 1f9w s TYR 390 N 0.97 1.91 0.59 5.22 2.02 0.63 0.32 117.35 129.02 1f9w s TYR 390 Ca -0.10 -0.37 -0.03 0.00 -0.37 0.00 0.00 57.07 56.20 1f9w s TYR 390 Cb -0.14 -1.18 0.03 0.00 -0.40 0.00 0.00 41.96 40.27 1f9w s TYR 390 CO -0.00 0.04 0.86 0.00 -1.57 0.00 0.00 175.55 174.89 1f9w s ARG 392 N -4.93 0.61 0.53 0.00 6.06 0.07 -2.65 118.95 118.63 1f9w s ARG 392 Ca 0.56 0.30 -0.13 0.00 -2.50 0.00 0.00 55.73 53.96 1f9w s ARG 392 Cb -0.10 0.20 -0.06 0.00 0.06 0.00 0.00 34.95 35.04 1f9w s ARG 392 CO 0.42 -1.04 0.96 0.42 -2.50 0.00 0.00 175.30 173.56 1f9w s ILE 393 N 2.56 4.65 0.21 4.11 1.09 0.27 -1.13 121.20 132.95 1f9w s ILE 393 Ca 0.12 0.97 0.05 0.00 -1.10 0.00 0.00 60.65 60.69 1f9w s ILE 393 Cb -0.08 -3.78 -0.05 0.00 -1.06 0.00 0.00 42.46 37.49 1f9w s ILE 393 CO -0.21 -0.83 -0.06 0.00 -0.10 0.00 0.00 174.94 173.74 1f9w s ARG 394 N -4.46 1.28 0.41 2.79 3.03 -1.13 -3.27 118.95 117.61 1f9w s ARG 394 Ca 0.56 -1.61 -0.24 0.00 2.03 0.00 0.00 55.73 56.47 1f9w s ARG 394 Cb -0.10 -0.77 -0.09 0.00 -1.03 0.00 0.00 34.95 32.96 1f9w s ARG 394 CO 0.40 0.02 1.08 -1.25 -1.13 0.00 0.00 175.30 174.41 1f9w s PRO 395 N -3.78 4.07 1.15 3.89 0.04 -1.26 -4.09 135.00 135.02 1f9w s PRO 395 Ca 0.24 1.58 -0.16 0.00 0.04 0.00 0.00 61.00 62.70 1f9w s PRO 395 Cb 0.03 -2.52 0.25 0.00 0.04 0.00 0.00 34.50 32.31 1f9w s PRO 395 CO 0.06 -0.24 0.57 0.00 0.04 0.00 0.00 177.00 177.44 1f9w n ALA 396 N -0.16 -3.48 -2.32 8.56 0.00 -1.26 -4.96 120.51 116.90 1f9w n ALA 396 Ca 0.05 -1.01 -0.20 0.00 0.00 0.00 0.00 53.44 52.29 1f9w n ALA 396 Cb 0.49 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.77 1f9w n ALA 396 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1f9w s LEU 397 N 0.00 1.76 0.18 0.00 1.43 -1.26 -5.08 118.68 115.70 1f9w s LEU 397 Ca 0.44 -1.77 0.21 0.00 -1.03 0.00 0.00 54.13 51.98 1f9w s LEU 397 Cb -0.08 0.62 -0.02 0.00 0.03 0.00 0.00 46.19 46.74 1f9w s LEU 397 CO 0.37 -1.09 1.02 0.07 0.23 0.00 0.00 176.35 176.95 1f9w h LYS 398 N 2.10 0.00 -0.06 1.70 5.09 -2.01 -3.37 116.57 120.02 1f9w h LYS 398 Ca -0.24 0.00 -0.06 0.00 0.09 0.00 0.00 60.65 60.44 1f9w h LYS 398 Cb 1.23 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.56 1f9w h LYS 398 CO 0.35 0.08 -0.19 -0.91 -2.09 0.00 0.00 179.45 176.69 1f9w h ASN 399 N 0.00 0.27 0.00 7.07 4.21 -2.04 -3.48 115.58 121.61 1f9w h ASN 399 Ca -0.04 -0.62 0.00 0.00 1.21 0.00 0.00 56.30 56.85 1f9w h ASN 399 Cb 1.15 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.27 1f9w h ASN 399 CO 0.01 0.85 0.00 0.18 -1.29 0.00 0.00 177.43 177.18 1f9w n LEU 400 N -4.56 0.00 -0.14 1.61 4.77 -1.26 -5.30 117.00 112.12 1f9w n LEU 400 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1f9w n LEU 400 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1f9w n LEU 400 CO 0.39 0.00 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.79 1f9w n GLU 401 N 0.00 -0.37 0.00 3.23 -0.58 -1.26 -4.41 120.64 117.25 1f9w n GLU 401 Ca 0.00 0.28 0.00 0.00 -0.42 0.00 0.00 57.16 57.02 1f9w n GLU 401 Cb 0.00 -0.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.53 1f9w n GLU 401 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1f9w n ASP 404 N -1.32 0.00 0.00 1.62 4.64 -1.26 -4.76 116.55 115.47 1f9w n ASP 404 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1f9w n ASP 404 Cb 0.02 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.10 1f9w n ASP 404 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1f9w n THR 405 N -0.47 0.00 -3.57 5.18 -2.24 -1.26 -2.63 114.28 109.29 1f9w n THR 405 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1f9w n THR 405 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1f9w n THR 405 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1f9w s SER 406 N -2.70 -0.78 0.00 3.42 0.01 -1.26 -4.41 113.70 107.98 1f9w s SER 406 Ca 0.00 1.13 0.12 0.00 1.31 0.00 0.00 55.95 58.51 1f9w s SER 406 Cb 0.00 1.68 -0.09 0.00 0.21 0.00 0.00 66.02 67.82 1f9w s SER 406 CO 0.00 -0.17 0.56 0.18 0.41 0.00 0.00 173.24 174.23 1f9w n LEU 407 N 4.68 0.81 -4.14 2.44 4.32 -1.26 -4.82 117.00 119.04 1f9w n LEU 407 Ca -0.14 -0.59 -0.36 0.00 -0.02 0.00 0.00 56.01 54.90 1f9w n LEU 407 Cb 0.54 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.28 1f9w n LEU 407 CO -0.02 0.18 1.83 -0.38 -1.22 0.00 0.00 177.39 177.78 1f9w n ILE 408 N -0.93 2.04 -2.37 -0.08 -0.00 -1.26 -3.62 119.36 113.14 1f9w n ILE 408 Ca 0.03 -1.97 -0.42 0.00 -0.00 0.00 0.00 62.75 60.38 1f9w n ILE 408 Cb 0.21 -2.26 -0.02 0.00 -0.00 0.00 0.00 39.64 37.56 1f9w n ILE 408 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.55 176.76 1f9w s ASN 409 N 5.60 6.24 -0.55 4.38 2.47 0.41 -4.91 114.94 128.57 1f9w s ASN 409 Ca 0.62 0.58 -0.23 0.00 0.42 0.00 0.00 52.86 54.25 1f9w s ASN 409 Cb 0.07 -2.54 0.05 0.00 -1.45 0.00 0.00 41.25 37.37 1f9w s ASN 409 CO 0.12 -1.56 0.88 -0.69 -3.72 0.00 0.00 177.10 172.13 1f9w s VAL 410 N 5.74 4.48 0.72 -5.21 1.01 -1.26 0.01 120.40 125.89 1f9w s VAL 410 Ca 0.57 0.06 -0.14 0.00 0.00 0.00 0.00 61.98 62.47 1f9w s VAL 410 Cb -0.12 -4.50 0.03 0.00 0.00 0.00 0.00 36.38 31.79 1f9w s VAL 410 CO 0.29 -1.08 1.16 0.20 0.00 0.00 0.00 175.10 175.67 1f9w s ASN 411 N 2.89 4.47 0.27 3.32 0.01 -1.17 -4.93 114.94 119.80 1f9w s ASN 411 Ca 0.26 2.17 -0.30 0.00 -0.71 0.00 0.00 52.86 54.29 1f9w s ASN 411 Cb -0.14 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 38.85 1f9w s ASN 411 CO 0.17 -2.07 1.37 -1.61 -1.51 0.00 0.00 177.10 173.45 1f9w s GLU 412 N -4.10 4.32 -0.17 -0.60 0.41 -1.26 -4.68 118.70 112.62 1f9w s GLU 412 Ca 0.70 2.22 -0.34 0.00 -0.41 0.00 0.00 54.97 57.14 1f9w s GLU 412 Cb -0.24 -3.11 -0.11 0.00 -1.78 0.00 0.00 34.13 28.88 1f9w s GLU 412 CO 0.45 -0.30 1.98 0.34 -0.49 0.00 0.00 175.26 177.24 1f9w n PHE 413 N 1.82 2.12 -2.88 1.61 -0.00 -1.26 -4.74 117.46 114.13 1f9w n PHE 413 Ca 0.04 0.08 -0.44 0.00 -0.00 0.00 0.00 57.45 57.13 1f9w n PHE 413 Cb 0.41 -2.63 0.00 0.00 -0.00 0.00 0.00 39.48 37.27 1f9w n PHE 413 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1f9w n ASP 414 N 7.82 5.54 -0.02 -2.13 -0.08 -1.23 -4.89 116.55 121.54 1f9w n ASP 414 Ca 0.28 -3.13 0.00 0.00 -1.51 0.00 0.00 54.79 50.43 1f9w n ASP 414 Cb 0.29 -1.43 0.00 0.00 2.34 0.00 0.00 41.12 42.31 1f9w n ASP 414 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1f9w n ASP 415 N 3.49 0.00 0.00 1.67 3.85 -1.26 -1.29 116.55 123.01 1f9w n ASP 415 Ca 0.32 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.40 1f9w n ASP 415 Cb 0.38 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.15 1f9w n ASP 415 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1f9w n ASN 416 N -0.33 0.00 0.00 -1.12 5.03 -1.26 -3.95 115.26 113.63 1f9w n ASN 416 Ca 0.00 0.11 0.00 0.00 0.87 0.00 0.00 54.58 55.56 1f9w n ASN 416 Cb 0.00 -0.30 0.00 0.00 -1.02 0.00 0.00 39.78 38.46 1f9w n ASN 416 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1f9w n SER 417 N -1.85 0.00 0.00 6.41 3.41 -1.04 -4.75 113.62 115.80 1f9w n SER 417 Ca 0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1f9w n SER 417 Cb 0.00 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 1f9w n SER 417 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f9w n GLY 418 N -1.39 1.97 0.00 5.00 0.00 -0.41 -4.96 105.19 105.40 1f9w n GLY 418 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1f9w n GLY 418 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1f9w n VAL 419 N -1.95 0.00 0.00 1.61 0.24 -1.23 -4.73 118.33 112.27 1f9w n VAL 419 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1f9w n VAL 419 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1f9w n VAL 419 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1f9w n GLN 420 N 0.00 0.00 -0.41 7.34 7.27 -1.23 -3.58 117.38 126.78 1f9w n GLN 420 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 56.95 1f9w n GLN 420 Cb 0.00 0.00 0.10 0.00 2.41 0.00 0.00 30.24 32.75 1f9w n GLN 420 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1f9w n SER 421 N 0.00 -1.48 0.00 1.69 7.64 -1.26 -3.16 113.62 117.05 1f9w n SER 421 Ca 0.00 -0.75 0.00 0.00 1.01 0.00 0.00 58.87 59.13 1f9w n SER 421 Cb 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1f9w n SER 421 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1f9w n MET 422 N -2.85 0.00 -4.72 1.43 3.85 0.16 -3.05 117.12 111.94 1f9w n MET 422 Ca 0.06 0.00 -0.24 0.00 -1.00 0.00 0.00 57.70 56.52 1f9w n MET 422 Cb 0.23 0.00 -0.16 0.00 -1.05 0.00 0.00 33.22 32.25 1f9w n MET 422 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1f9w s GLU 423 N -1.23 1.51 0.16 3.17 2.02 0.10 -1.67 118.70 122.76 1f9w s GLU 423 Ca 0.00 -0.53 0.06 0.00 0.02 0.00 0.00 54.97 54.52 1f9w s GLU 423 Cb 0.00 -1.35 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 1f9w s GLU 423 CO 0.00 0.23 0.03 0.08 0.02 0.00 0.00 175.26 175.62 1f9w s VAL 424 N 0.01 3.93 -0.01 2.63 1.01 -0.03 -0.45 120.40 127.48 1f9w s VAL 424 Ca -0.02 -1.28 -0.07 0.00 0.00 0.00 0.00 61.98 60.61 1f9w s VAL 424 Cb -0.10 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1f9w s VAL 424 CO 0.01 -0.07 0.14 -0.89 0.00 0.00 0.00 175.10 174.29 1f9w s THR 425 N -1.67 0.06 -0.16 3.92 2.01 -1.24 0.68 115.64 119.24 1f9w s THR 425 Ca 0.28 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.77 1f9w s THR 425 Cb -0.10 -0.38 0.02 0.00 0.01 0.00 0.00 72.50 72.05 1f9w s THR 425 CO 0.20 -0.29 -0.20 -0.69 -0.69 0.00 0.00 174.62 172.95 1f9w s VAL 433 N -1.02 1.99 -0.06 3.82 1.01 -1.26 -5.11 120.40 119.77 1f9w s VAL 433 Ca -0.11 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 60.92 1f9w s VAL 433 Cb -0.06 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1f9w s VAL 433 CO 0.01 0.53 0.12 -1.00 0.00 0.00 0.00 175.10 174.77 1f9w s HIS 434 N 1.14 3.47 -0.01 5.22 3.76 0.21 -5.11 115.29 123.98 1f9w s HIS 434 Ca 0.01 0.38 0.02 0.00 -0.15 0.00 0.00 55.06 55.31 1f9w s HIS 434 Cb -0.14 -1.85 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 1f9w s HIS 434 CO -0.09 0.65 -0.02 -2.00 -0.85 0.00 0.00 174.74 172.42 1f9w s GLU 435 N -1.41 2.71 0.02 1.40 2.12 -1.26 -0.85 118.70 121.44 1f9w s GLU 435 Ca 0.20 -0.64 -0.15 0.00 0.36 0.00 0.00 54.97 54.74 1f9w s GLU 435 Cb -0.12 -2.62 0.02 0.00 0.26 0.00 0.00 34.13 31.68 1f9w s GLU 435 CO 0.10 0.62 0.32 -0.06 -0.54 0.00 0.00 175.26 175.70 1f9w s PHE 436 N -1.04 -0.15 -0.49 5.30 0.08 -0.67 -5.00 117.98 116.01 1f9w s PHE 436 Ca 0.18 0.11 0.06 0.00 0.12 0.00 0.00 56.93 57.40 1f9w s PHE 436 Cb -0.11 0.11 0.20 0.00 -0.57 0.00 0.00 43.02 42.64 1f9w s PHE 436 CO 0.09 -0.47 0.67 0.36 -0.10 0.00 0.00 175.22 175.77 1f9w n LYS 437 N 0.83 0.52 0.00 0.44 2.85 -1.26 -0.67 118.16 120.87 1f9w n LYS 437 Ca -0.20 -2.25 0.00 0.00 -1.05 0.00 0.00 58.31 54.81 1f9w n LYS 437 Cb 0.58 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 33.47 1f9w n LYS 437 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1f9w n PHE 438 N 2.66 -1.81 0.30 5.58 3.72 -1.19 -4.54 117.46 122.18 1f9w n PHE 438 Ca 0.19 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.65 1f9w n PHE 438 Cb 0.55 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.31 1f9w n PHE 438 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1f9w n ASP 439 N -2.11 2.95 0.00 4.37 8.00 0.97 -3.49 116.55 127.25 1f9w n ASP 439 Ca 0.00 -2.24 0.00 0.00 0.71 0.00 0.00 54.79 53.26 1f9w n ASP 439 Cb 0.00 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 1f9w n ASP 439 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1f9w n LYS 440 N 0.59 0.00 -4.07 -1.24 4.81 -1.26 -4.89 118.16 112.10 1f9w n LYS 440 Ca 0.15 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.31 1f9w n LYS 440 Cb 0.56 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.55 1f9w n LYS 440 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1f9w s ILE 441 N -0.13 4.46 -0.22 3.15 1.01 -1.26 -2.92 121.20 125.29 1f9w s ILE 441 Ca 0.00 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 59.72 1f9w s ILE 441 Cb 0.00 -3.21 0.06 0.00 0.01 0.00 0.00 42.46 39.33 1f9w s ILE 441 CO 0.00 0.02 -0.03 -0.36 0.00 0.00 0.00 174.94 174.57 1f9w s PHE 442 N -1.54 2.03 0.60 3.97 0.08 -1.08 -4.94 117.98 117.10 1f9w s PHE 442 Ca 0.30 -1.52 -0.07 0.00 0.12 0.00 0.00 56.93 55.76 1f9w s PHE 442 Cb -0.11 -1.44 0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1f9w s PHE 442 CO 0.22 -0.73 0.92 0.34 -0.10 0.00 0.00 175.22 175.87 1f9w s ASP 443 N 1.52 5.58 0.61 1.36 -1.08 -1.26 0.97 116.67 124.36 1f9w s ASP 443 Ca -0.04 0.77 0.27 0.00 -0.52 0.00 0.00 52.55 53.02 1f9w s ASP 443 Cb -0.18 -1.74 1.14 0.00 -1.46 0.00 0.00 42.92 40.68 1f9w s ASP 443 CO -0.07 -1.09 1.55 0.06 0.52 0.00 0.00 175.17 176.15 1f9w h GLN 444 N -0.23 0.00 -0.52 4.34 3.07 -1.78 0.16 115.11 120.15 1f9w h GLN 444 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.27 1f9w h GLN 444 Cb 1.25 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.79 1f9w h GLN 444 CO 0.61 0.00 0.25 1.96 0.09 0.00 0.00 178.83 181.74 1f9w h GLN 445 N 0.00 0.74 -6.88 0.06 4.20 -1.91 -3.41 115.11 107.91 1f9w h GLN 445 Ca 0.34 -0.11 -0.53 0.00 0.06 0.00 0.00 58.65 58.42 1f9w h GLN 445 Cb 2.10 -0.14 0.07 0.00 0.30 0.00 0.00 27.48 29.81 1f9w h GLN 445 CO -0.00 0.61 0.67 -0.51 -0.67 0.00 0.00 178.83 178.93 1f9w s ASP 446 N -5.89 6.69 0.59 1.46 1.01 0.04 -5.03 116.67 115.54 1f9w s ASP 446 Ca -0.13 2.75 0.09 0.00 0.71 0.00 0.00 52.55 55.97 1f9w s ASP 446 Cb 0.12 -2.65 0.09 0.00 1.01 0.00 0.00 42.92 41.49 1f9w s ASP 446 CO 0.77 -0.61 0.75 0.42 0.21 0.00 0.00 175.17 176.71 1f9w s THR 447 N -1.02 1.92 0.22 -1.27 -4.23 -1.26 -4.87 115.64 105.13 1f9w s THR 447 Ca 0.51 -1.09 -0.09 0.00 -1.18 0.00 0.00 61.69 59.84 1f9w s THR 447 Cb -0.41 -2.01 0.19 0.00 1.34 0.00 0.00 72.50 71.61 1f9w s THR 447 CO 0.54 0.00 1.89 0.78 -0.54 0.00 0.00 174.62 177.29 1f9w h ASN 448 N 0.21 0.95 -0.78 3.99 4.21 -1.96 0.45 115.58 122.65 1f9w h ASN 448 Ca -0.30 -0.03 0.03 0.00 1.21 0.00 0.00 56.30 57.22 1f9w h ASN 448 Cb 1.29 -0.24 -0.05 0.00 -1.12 0.00 0.00 38.32 38.21 1f9w h ASN 448 CO 0.43 0.69 0.50 0.58 -1.29 0.00 0.00 177.43 178.34 1f9w h VAL 449 N 1.12 1.11 0.13 2.81 2.07 -1.95 0.65 116.25 122.19 1f9w h VAL 449 Ca 0.30 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1f9w h VAL 449 Cb -0.13 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.71 1f9w h VAL 449 CO -0.07 0.18 -0.06 0.44 0.02 0.00 0.00 177.57 178.08 1f9w h ASP 450 N 0.96 -0.14 -0.42 0.57 3.32 -1.69 -0.07 116.42 118.95 1f9w h ASP 450 Ca 0.32 -0.13 0.05 0.00 0.02 0.00 0.00 57.03 57.29 1f9w h ASP 450 Cb 0.03 0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1f9w h ASP 450 CO -0.12 0.04 0.16 0.58 -1.72 0.00 0.00 179.24 178.18 1f9w h VAL 451 N -0.32 0.89 0.00 -1.35 2.07 -0.39 -2.32 116.25 114.83 1f9w h VAL 451 Ca -0.02 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 1f9w h VAL 451 Cb 0.26 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1f9w h VAL 451 CO 0.03 0.06 -0.37 0.15 0.02 0.00 0.00 177.57 177.46 1f9w h PHE 452 N 0.34 0.00 0.00 1.57 3.57 0.41 -2.83 116.94 119.99 1f9w h PHE 452 Ca 0.19 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1f9w h PHE 452 Cb 0.17 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1f9w h PHE 452 CO -0.14 0.37 -0.07 0.87 -2.23 0.00 0.00 178.31 177.11 1f9w h LYS 453 N 0.00 0.00 0.00 1.11 1.57 -0.42 1.66 116.57 120.49 1f9w h LYS 453 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1f9w h LYS 453 Cb 0.81 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1f9w h LYS 453 CO 0.05 0.07 -0.10 0.93 -0.57 0.00 0.00 179.45 179.82 1f9w h GLU 454 N 0.00 0.00 0.62 3.15 4.39 -1.47 -3.39 114.58 117.88 1f9w h GLU 454 Ca -0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1f9w h GLU 454 Cb 0.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1f9w h GLU 454 CO 0.01 0.41 -0.33 0.28 -1.16 0.00 0.00 179.01 178.22 1f9w h VAL 455 N -1.00 0.33 -0.31 3.13 2.07 -1.24 -3.13 116.25 116.09 1f9w h VAL 455 Ca -0.02 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 1f9w h VAL 455 Cb 0.46 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 1f9w h VAL 455 CO -0.01 0.00 0.19 0.61 0.02 0.00 0.00 177.57 178.38 1f9w n GLY 456 N -1.48 -0.20 0.28 2.17 0.00 0.56 -0.21 105.19 106.31 1f9w n GLY 456 Ca -0.13 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 1f9w n GLY 456 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1f9w h GLN 457 N 0.00 -0.35 -0.21 1.61 5.75 -1.76 -2.81 115.11 117.34 1f9w h GLN 457 Ca 0.22 0.02 -0.15 0.00 -0.15 0.00 0.00 58.65 58.59 1f9w h GLN 457 Cb 0.66 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.28 1f9w h GLN 457 CO -0.15 -0.24 -0.49 1.37 -2.65 0.00 0.00 178.83 176.68 1f9w h LEU 458 N -0.37 0.61 -2.57 -2.39 -0.00 -0.82 -3.17 115.31 106.60 1f9w h LEU 458 Ca 0.01 -0.30 0.00 0.00 -0.00 0.00 0.00 57.88 57.59 1f9w h LEU 458 Cb 0.41 -0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 40.90 1f9w h LEU 458 CO -0.24 1.00 0.02 -0.37 -0.00 0.00 0.00 178.44 178.85 1f9w h VAL 459 N 0.45 0.39 0.00 0.15 -1.51 -1.47 0.12 116.25 114.38 1f9w h VAL 459 Ca 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.49 1f9w h VAL 459 Cb 1.01 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 1f9w h VAL 459 CO 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.43 1f9w n GLN 460 N -3.65 0.02 -0.00 5.19 10.64 -1.07 -3.24 117.38 125.26 1f9w n GLN 460 Ca -0.03 0.03 0.03 0.00 -1.83 0.00 0.00 57.00 55.20 1f9w n GLN 460 Cb 0.10 -1.50 0.39 0.00 -0.86 0.00 0.00 30.24 28.37 1f9w n GLN 460 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.06 176.00 1f9w h SER 461 N 0.00 0.48 -0.82 2.61 0.02 -0.91 -2.14 113.55 112.79 1f9w h SER 461 Ca 0.00 -0.03 0.15 0.00 -0.84 0.00 0.00 61.79 61.07 1f9w h SER 461 Cb 0.46 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.82 1f9w h SER 461 CO 0.00 0.39 0.54 0.28 -1.14 0.00 0.00 176.83 176.90 1f9w h SER 462 N 0.55 0.48 0.56 3.07 0.02 -1.67 2.01 113.55 118.57 1f9w h SER 462 Ca 0.14 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1f9w h SER 462 Cb 0.02 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1f9w h SER 462 CO -0.02 0.24 0.00 -0.07 -1.14 0.00 0.00 176.83 175.84 1f9w h LEU 463 N 0.50 0.00 -3.98 5.07 3.38 -1.62 0.25 115.31 118.91 1f9w h LEU 463 Ca 0.41 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.84 1f9w h LEU 463 Cb 0.84 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.29 1f9w h LEU 463 CO -0.15 0.00 0.68 0.47 0.09 0.00 0.00 178.44 179.52 1f9w n ASP 464 N -2.53 4.20 0.00 -0.43 8.00 0.68 -4.89 116.55 121.58 1f9w n ASP 464 Ca 0.00 -3.61 0.00 0.00 0.71 0.00 0.00 54.79 51.89 1f9w n ASP 464 Cb 0.19 -0.85 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 1f9w n ASP 464 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f9w n GLY 465 N -1.10 0.17 3.83 0.44 0.00 0.87 -4.96 105.19 104.43 1f9w n GLY 465 Ca 0.60 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.32 1f9w n GLY 465 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f9w s TYR 466 N -1.48 2.99 0.06 1.61 1.51 -0.99 -4.26 117.35 116.78 1f9w s TYR 466 Ca 0.00 1.10 0.06 0.00 -1.01 0.00 0.00 57.07 57.22 1f9w s TYR 466 Cb 0.00 -3.12 -0.04 0.00 -0.11 0.00 0.00 41.96 38.69 1f9w s TYR 466 CO 0.00 -1.59 -0.11 -0.80 -1.11 0.00 0.00 175.55 171.93 1f9w s ASN 467 N -4.07 4.28 0.01 2.29 0.01 -1.25 -2.94 114.94 113.28 1f9w s ASN 467 Ca 0.60 -0.33 0.01 0.00 -0.71 0.00 0.00 52.86 52.43 1f9w s ASN 467 Cb -0.13 -0.84 -0.01 0.00 0.41 0.00 0.00 41.25 40.68 1f9w s ASN 467 CO 0.53 0.23 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.61 1f9w s VAL 468 N -1.07 0.35 -0.06 1.60 1.01 0.29 0.31 120.40 122.83 1f9w s VAL 468 Ca 0.18 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1f9w s VAL 468 Cb -0.11 -0.36 0.01 0.00 0.00 0.00 0.00 36.38 35.92 1f9w s VAL 468 CO 0.10 -0.14 -0.12 0.00 0.00 0.00 0.00 175.10 174.94 1f9w s ILE 470 N 0.57 1.36 -0.05 0.00 -1.09 0.19 0.15 121.20 122.33 1f9w s ILE 470 Ca -0.12 -0.58 0.06 0.00 -2.23 0.00 0.00 60.65 57.78 1f9w s ILE 470 Cb -0.14 -1.24 -0.01 0.00 -1.58 0.00 0.00 42.46 39.48 1f9w s ILE 470 CO 0.03 0.41 -0.25 -0.36 -1.23 0.00 0.00 174.94 173.54 1f9w s PHE 471 N 0.85 2.44 -0.49 3.97 0.08 0.30 0.30 117.98 125.44 1f9w s PHE 471 Ca -0.10 -0.68 -0.05 0.00 0.12 0.00 0.00 56.93 56.21 1f9w s PHE 471 Cb -0.15 -1.59 0.13 0.00 -0.57 0.00 0.00 43.02 40.83 1f9w s PHE 471 CO 0.01 -0.19 0.32 0.00 -0.10 0.00 0.00 175.22 175.26 1f9w s ALA 472 N -0.22 3.35 0.26 5.36 0.00 -0.03 0.16 121.76 130.65 1f9w s ALA 472 Ca -0.02 -2.71 0.08 0.00 0.00 0.00 0.00 51.96 49.31 1f9w s ALA 472 Cb -0.13 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 1f9w s ALA 472 CO 0.03 -1.91 0.11 -0.47 0.00 0.00 0.00 175.76 173.52 1f9w s TYR 473 N 0.95 2.94 0.00 0.00 5.04 0.20 -1.83 117.35 124.65 1f9w s TYR 473 Ca 0.09 -0.16 0.00 0.00 -2.44 0.00 0.00 57.07 54.56 1f9w s TYR 473 Cb -0.23 -1.32 0.00 0.00 0.35 0.00 0.00 41.96 40.76 1f9w s TYR 473 CO -0.03 0.56 0.00 0.41 -1.34 0.00 0.00 175.55 175.15 1f9w n GLY 474 N -1.07 4.00 3.41 8.97 0.00 -1.26 -0.45 105.19 118.80 1f9w n GLY 474 Ca -0.07 -1.60 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 1f9w n GLY 474 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1f9w n GLN 475 N -1.57 0.27 -1.98 1.61 7.27 -1.26 -3.21 117.38 118.51 1f9w n GLN 475 Ca 0.00 0.12 -0.37 0.00 0.07 0.00 0.00 57.00 56.82 1f9w n GLN 475 Cb 0.00 -1.67 0.02 0.00 2.41 0.00 0.00 30.24 31.00 1f9w n GLN 475 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1f9w s THR 476 N -1.91 2.51 0.00 1.69 2.01 -1.26 -2.38 115.64 116.30 1f9w s THR 476 Ca 0.63 0.37 0.00 0.00 0.31 0.00 0.00 61.69 63.00 1f9w s THR 476 Cb -0.36 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1f9w s THR 476 CO 0.60 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 175.12 1f9w n GLY 477 N 0.60 1.65 0.00 4.40 0.00 -1.26 -4.86 105.19 105.71 1f9w n GLY 477 Ca 0.10 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.28 1f9w n GLY 477 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f9w n SER 478 N 0.00 0.00 0.00 1.61 3.41 -1.00 -4.93 113.62 112.71 1f9w n SER 478 Ca 0.00 -0.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.78 1f9w n SER 478 Cb 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1f9w n SER 478 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f9w n GLY 479 N 1.05 0.70 0.30 5.00 0.00 -1.26 -4.11 105.19 106.85 1f9w n GLY 479 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.30 1f9w n GLY 479 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9w h LYS 480 N 2.55 0.07 -0.01 1.61 1.57 -1.90 0.22 116.57 120.68 1f9w h LYS 480 Ca 0.00 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1f9w h LYS 480 Cb 0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1f9w h LYS 480 CO 0.00 0.04 -0.56 1.15 -0.57 0.00 0.00 179.45 179.52 1f9w h THR 481 N 0.07 1.40 0.20 -0.16 2.02 -1.93 -2.42 112.91 112.08 1f9w h THR 481 Ca 0.44 -1.90 -0.01 0.00 0.77 0.00 0.00 66.41 65.71 1f9w h THR 481 Cb 0.79 2.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 1f9w h THR 481 CO -0.75 0.55 -0.10 0.15 0.37 0.00 0.00 175.52 175.74 1f9w h PHE 482 N 0.02 -0.25 -0.88 3.16 3.04 -1.02 0.70 116.94 121.71 1f9w h PHE 482 Ca -0.00 -0.01 0.17 0.00 3.98 0.00 0.00 57.97 62.11 1f9w h PHE 482 Cb 0.99 0.08 -0.07 0.00 2.56 0.00 0.00 35.95 39.51 1f9w h PHE 482 CO 0.00 0.11 0.57 1.15 -2.02 0.00 0.00 178.31 178.12 1f9w h THR 483 N -0.65 0.76 0.06 4.41 2.02 -1.00 0.16 112.91 118.66 1f9w h THR 483 Ca -0.03 -0.18 -0.33 0.00 0.77 0.00 0.00 66.41 66.63 1f9w h THR 483 Cb 0.47 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1f9w h THR 483 CO 0.05 0.10 -1.86 0.80 0.37 0.00 0.00 175.52 174.97 1f9w n MET 484 N -4.54 0.67 0.00 6.66 1.56 -0.91 0.25 117.12 120.80 1f9w n MET 484 Ca 0.18 0.35 0.01 0.00 -0.27 0.00 0.00 57.70 57.97 1f9w n MET 484 Cb 0.57 -1.68 0.00 0.00 2.15 0.00 0.00 33.22 34.26 1f9w n MET 484 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1f9w n LEU 485 N -3.84 0.87 -4.61 -0.89 4.77 0.24 -0.18 117.00 113.37 1f9w n LEU 485 Ca -0.36 -0.86 -0.61 0.00 -0.03 0.00 0.00 56.01 54.16 1f9w n LEU 485 Cb 0.91 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.92 1f9w n LEU 485 CO 0.30 0.20 0.86 -3.20 -1.33 0.00 0.00 177.39 174.22 1f9w n ASN 486 N -0.21 0.82 -4.51 -1.43 5.15 0.54 -4.56 115.26 111.07 1f9w n ASN 486 Ca 0.01 1.16 -0.49 0.00 -0.60 0.00 0.00 54.58 54.66 1f9w n ASN 486 Cb 0.05 -0.97 -0.04 0.00 -0.53 0.00 0.00 39.78 38.29 1f9w n ASN 486 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1f9w n PRO 487 N 2.77 0.66 0.00 1.20 -0.02 -1.26 0.11 135.00 138.46 1f9w n PRO 487 Ca 0.24 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1f9w n PRO 487 Cb 0.06 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1f9w n PRO 487 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f9w n GLY 488 N 1.76 0.12 0.07 -1.23 0.00 -1.26 -4.35 105.19 100.30 1f9w n GLY 488 Ca 0.15 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.10 1f9w n GLY 488 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1f9w h ASP 489 N 0.00 0.00 -1.67 1.61 3.32 -1.80 -3.38 116.42 114.50 1f9w h ASP 489 Ca 0.00 -0.29 -0.47 0.00 0.02 0.00 0.00 57.03 56.29 1f9w h ASP 489 Cb 0.00 0.00 0.19 0.00 0.22 0.00 0.00 39.33 39.74 1f9w h ASP 489 CO 0.00 0.81 -1.43 0.61 -1.72 0.00 0.00 179.24 177.51 1f9w n GLY 490 N 1.66 -3.64 0.36 2.75 0.00 0.30 -4.35 105.19 102.28 1f9w n GLY 490 Ca -0.08 -0.55 0.03 0.00 0.00 0.00 0.00 46.02 45.41 1f9w n GLY 490 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1f9w h ILE 491 N -0.65 1.07 0.10 -0.61 2.04 0.28 -0.28 117.51 119.46 1f9w h ILE 491 Ca -0.36 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 1f9w h ILE 491 Cb 1.11 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1f9w h ILE 491 CO 0.23 0.21 -0.05 0.40 0.00 0.00 0.00 178.15 178.93 1f9w h ILE 492 N 1.13 1.06 -0.93 -0.67 2.04 -0.83 0.49 117.51 119.81 1f9w h ILE 492 Ca 0.43 -0.64 0.07 0.00 1.00 0.00 0.00 64.86 65.72 1f9w h ILE 492 Cb 0.19 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.68 1f9w h ILE 492 CO -0.18 0.16 0.58 -0.65 0.00 0.00 0.00 178.15 178.06 1f9w h PRO 493 N -0.44 1.00 0.00 2.37 0.11 -1.64 -1.19 132.00 132.21 1f9w h PRO 493 Ca -0.01 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.95 1f9w h PRO 493 Cb 0.36 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1f9w h PRO 493 CO 0.02 0.66 -0.40 0.77 -0.21 0.00 0.00 178.00 178.84 1f9w h SER 494 N 1.03 0.00 -0.02 -2.05 0.02 -0.98 -2.63 113.55 108.92 1f9w h SER 494 Ca 0.42 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 61.19 1f9w h SER 494 Cb 0.23 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.79 1f9w h SER 494 CO -0.19 0.40 -0.68 0.74 -1.14 0.00 0.00 176.83 175.96 1f9w h THR 495 N 0.00 1.39 -0.08 -2.27 2.02 0.25 0.43 112.91 114.65 1f9w h THR 495 Ca -0.00 -2.08 -0.05 0.00 0.77 0.00 0.00 66.41 65.05 1f9w h THR 495 Cb 0.80 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.69 1f9w h THR 495 CO 0.05 0.62 -0.18 0.40 0.37 0.00 0.00 175.52 176.78 1f9w h ILE 496 N 0.03 1.17 0.22 3.11 2.04 -1.27 0.87 117.51 123.69 1f9w h ILE 496 Ca -0.08 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1f9w h ILE 496 Cb 1.37 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.77 1f9w h ILE 496 CO 0.13 0.24 -0.11 0.28 0.00 0.00 0.00 178.15 178.70 1f9w h SER 497 N 0.12 -0.26 -0.86 1.72 0.02 -1.43 0.83 113.55 113.70 1f9w h SER 497 Ca 0.02 0.01 0.19 0.00 -0.84 0.00 0.00 61.79 61.18 1f9w h SER 497 Cb 0.40 0.07 -0.12 0.00 0.14 0.00 0.00 62.40 62.89 1f9w h SER 497 CO 0.03 0.13 0.36 -0.74 -1.14 0.00 0.00 176.83 175.46 1f9w h HIS 498 N -0.93 0.60 -0.03 3.45 -0.00 -0.85 0.59 115.15 117.98 1f9w h HIS 498 Ca -0.03 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.37 1f9w h HIS 498 Cb 0.23 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1f9w h HIS 498 CO 0.01 -0.01 -0.00 0.82 -0.00 0.00 0.00 177.93 178.75 1f9w h ILE 499 N 0.42 1.27 -0.09 6.26 2.04 -0.91 -1.52 117.51 124.97 1f9w h ILE 499 Ca 0.51 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.60 1f9w h ILE 499 Cb 0.91 1.76 -0.05 0.00 -0.74 0.00 0.00 36.82 38.70 1f9w h ILE 499 CO -0.49 0.22 -0.19 -0.26 0.00 0.00 0.00 178.15 177.42 1f9w h PHE 500 N -0.27 -0.49 -0.54 1.37 0.05 0.18 -1.77 116.94 115.47 1f9w h PHE 500 Ca 0.01 0.02 0.02 0.00 3.82 0.00 0.00 57.97 61.84 1f9w h PHE 500 Cb 0.35 0.23 -0.03 0.00 2.00 0.00 0.00 35.95 38.50 1f9w h PHE 500 CO 0.04 -0.27 0.33 -0.91 -0.18 0.00 0.00 178.31 177.32 1f9w h ASN 501 N -0.26 0.53 -0.58 2.17 2.35 0.04 -2.14 115.58 117.68 1f9w h ASN 501 Ca 0.09 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.93 1f9w h ASN 501 Cb 0.38 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 1f9w h ASN 501 CO -0.24 0.37 0.39 -0.50 -1.65 0.00 0.00 177.43 175.80 1f9w h TRP 502 N 0.65 0.45 -0.05 1.19 4.06 -0.83 -1.87 115.95 119.55 1f9w h TRP 502 Ca 0.22 0.01 -0.07 0.00 2.06 0.00 0.00 58.89 61.10 1f9w h TRP 502 Cb 0.02 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.03 1f9w h TRP 502 CO -0.06 0.22 -0.26 0.82 -3.56 0.00 0.00 178.44 175.60 1f9w h ILE 503 N 0.43 1.45 -0.96 1.49 2.04 -0.70 -1.13 117.51 120.13 1f9w h ILE 503 Ca 0.27 -1.72 0.13 0.00 1.00 0.00 0.00 64.86 64.54 1f9w h ILE 503 Cb 0.47 2.41 -0.08 0.00 -0.74 0.00 0.00 36.82 38.89 1f9w h ILE 503 CO -0.07 0.48 0.61 0.78 0.00 0.00 0.00 178.15 179.95 1f9w h ASN 504 N -0.27 0.84 0.88 1.72 2.35 -1.10 1.02 115.58 121.02 1f9w h ASN 504 Ca -0.02 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1f9w h ASN 504 Cb 0.92 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1f9w h ASN 504 CO 0.05 0.44 -0.12 2.29 -1.65 0.00 0.00 177.43 178.45 1f9w n LYS 505 N -4.60 0.00 -0.06 0.81 -0.00 -0.73 -3.53 118.16 110.06 1f9w n LYS 505 Ca 0.18 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.32 1f9w n LYS 505 Cb 0.38 -1.50 -0.13 0.00 -0.00 0.00 0.00 35.03 33.78 1f9w n LYS 505 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1f9w n LEU 506 N -1.50 2.25 -0.18 -5.58 4.77 0.25 -4.13 117.00 112.88 1f9w n LEU 506 Ca 0.07 0.09 -0.06 0.00 -0.03 0.00 0.00 56.01 56.08 1f9w n LEU 506 Cb 0.34 -0.71 -0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1f9w n LEU 506 CO 0.29 0.79 0.63 0.50 -1.33 0.00 0.00 177.39 178.27 1f9w h LYS 507 N 0.03 -0.18 0.00 3.23 3.64 0.62 1.53 116.57 125.44 1f9w h LYS 507 Ca -0.48 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1f9w h LYS 507 Cb 2.01 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.87 1f9w h LYS 507 CO 0.02 -0.12 0.22 0.25 -2.27 0.00 0.00 179.45 177.55 1f9w n THR 508 N -5.43 1.02 -1.90 1.00 -2.24 -1.24 -0.52 114.28 104.97 1f9w n THR 508 Ca 0.03 0.48 -0.28 0.00 -2.27 0.00 0.00 64.05 62.01 1f9w n THR 508 Cb 0.35 -1.48 0.03 0.00 -2.10 0.00 0.00 70.33 67.13 1f9w n THR 508 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f9w n LYS 509 N -1.25 3.33 0.00 -0.78 5.02 0.52 -4.92 118.16 120.08 1f9w n LYS 509 Ca 0.00 -3.96 0.00 0.00 -2.02 0.00 0.00 58.31 52.33 1f9w n LYS 509 Cb 0.22 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 32.96 1f9w n LYS 509 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f9w n GLY 510 N -0.72 1.45 0.00 0.72 0.00 0.32 -4.93 105.19 102.03 1f9w n GLY 510 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.51 1f9w n GLY 510 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1f9w n TRP 511 N 0.00 -1.22 0.00 1.61 7.02 -1.19 -4.20 117.44 119.45 1f9w n TRP 511 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1f9w n TRP 511 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 1f9w n TRP 511 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 1f9w n ASP 512 N -1.45 0.00 -4.29 -0.99 2.03 -1.24 -4.43 116.55 106.18 1f9w n ASP 512 Ca 0.00 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.13 1f9w n ASP 512 Cb 0.00 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.29 1f9w n ASP 512 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1f9w s TYR 513 N -0.42 1.55 -0.01 -0.67 4.12 -1.26 -2.59 117.35 118.06 1f9w s TYR 513 Ca 0.00 -0.58 0.07 0.00 0.02 0.00 0.00 57.07 56.58 1f9w s TYR 513 Cb 0.00 -0.77 -0.02 0.00 -1.52 0.00 0.00 41.96 39.65 1f9w s TYR 513 CO 0.00 0.23 -0.21 0.21 0.02 0.00 0.00 175.55 175.80 1f9w s LYS 514 N -3.14 2.19 -0.04 -0.62 2.36 0.22 -4.93 119.74 115.79 1f9w s LYS 514 Ca 0.15 -0.88 -0.02 0.00 -2.55 0.00 0.00 55.97 52.67 1f9w s LYS 514 Cb -0.03 -2.16 0.03 0.00 -1.05 0.00 0.00 37.83 34.62 1f9w s LYS 514 CO 0.04 0.57 0.09 0.08 1.55 0.00 0.00 175.35 177.68 1f9w s VAL 515 N -0.72 -0.04 0.07 4.02 1.01 -1.26 -1.32 120.40 122.15 1f9w s VAL 515 Ca 0.11 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 1f9w s VAL 515 Cb -0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 1f9w s VAL 515 CO 0.01 0.06 0.01 0.54 0.00 0.00 0.00 175.10 175.72 1f9w s ASN 516 N 0.90 0.42 0.33 3.32 2.20 -1.18 0.27 114.94 121.20 1f9w s ASN 516 Ca -0.07 -1.01 -0.04 0.00 -0.94 0.00 0.00 52.86 50.79 1f9w s ASN 516 Cb -0.10 0.23 0.00 0.00 -2.00 0.00 0.00 41.25 39.39 1f9w s ASN 516 CO -0.04 -0.64 0.47 0.00 -2.94 0.00 0.00 177.10 173.96 1f9w s GLU 518 N -3.21 0.53 -0.09 0.00 8.01 -0.28 0.23 118.70 123.89 1f9w s GLU 518 Ca 0.29 -0.07 -0.00 0.00 0.01 0.00 0.00 54.97 55.20 1f9w s GLU 518 Cb -0.00 0.24 0.02 0.00 -4.31 0.00 0.00 34.13 30.08 1f9w s GLU 518 CO 0.18 -0.13 -0.06 0.12 0.01 0.00 0.00 175.26 175.38 1f9w s PHE 519 N -0.92 1.20 0.30 1.61 5.36 -1.26 0.15 117.98 124.42 1f9w s PHE 519 Ca -0.10 -0.52 0.05 0.00 -0.96 0.00 0.00 56.93 55.41 1f9w s PHE 519 Cb -0.05 -1.05 -0.03 0.00 -0.34 0.00 0.00 43.02 41.55 1f9w s PHE 519 CO 0.03 -0.41 0.25 0.96 -1.46 0.00 0.00 175.22 174.59 1f9w s ILE 520 N 1.57 0.00 -0.05 3.12 -4.36 -0.80 -1.42 121.20 119.26 1f9w s ILE 520 Ca 0.01 -1.99 -0.07 0.00 -0.26 0.00 0.00 60.65 58.34 1f9w s ILE 520 Cb -0.13 -2.50 0.01 0.00 1.25 0.00 0.00 42.46 41.09 1f9w s ILE 520 CO -0.05 0.00 0.17 -1.83 0.24 0.00 0.00 174.94 173.47 1f9w s GLU 521 N -3.59 0.28 -0.87 0.37 -1.05 0.25 -0.50 118.70 113.59 1f9w s GLU 521 Ca 0.40 0.08 -0.10 0.00 -0.15 0.00 0.00 54.97 55.20 1f9w s GLU 521 Cb 0.03 0.13 0.22 0.00 -0.44 0.00 0.00 34.13 34.07 1f9w s GLU 521 CO 0.24 -0.05 0.80 0.42 0.95 0.00 0.00 175.26 177.62 1f9w s ILE 522 N -0.29 5.31 -0.24 1.83 1.01 0.36 0.21 121.20 129.39 1f9w s ILE 522 Ca -0.04 -2.89 -0.06 0.00 0.00 0.00 0.00 60.65 57.66 1f9w s ILE 522 Cb -0.03 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.15 1f9w s ILE 522 CO 0.01 -1.05 0.02 -0.47 0.00 0.00 0.00 174.94 173.45 1f9w s TYR 523 N -0.34 3.04 -1.13 3.97 5.04 -1.17 -1.93 117.35 124.83 1f9w s TYR 523 Ca 0.22 -0.68 -0.04 0.00 -2.44 0.00 0.00 57.07 54.12 1f9w s TYR 523 Cb -0.11 -2.18 -0.03 0.00 0.35 0.00 0.00 41.96 39.98 1f9w s TYR 523 CO -0.08 -0.46 0.93 0.09 -1.34 0.00 0.00 175.55 174.69 1f9w n ASN 524 N 4.87 -4.38 -0.49 4.32 3.02 -1.26 -2.13 115.26 119.21 1f9w n ASN 524 Ca -0.17 -0.70 -0.02 0.00 -0.03 0.00 0.00 54.58 53.66 1f9w n ASN 524 Cb 0.51 -4.99 -0.01 0.00 -0.61 0.00 0.00 39.78 34.67 1f9w n ASN 524 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1f9w n GLU 525 N -3.71 -1.63 -4.01 3.52 -0.58 -1.26 -4.86 120.64 108.11 1f9w n GLU 525 Ca -0.17 0.21 -0.33 0.00 -0.42 0.00 0.00 57.16 56.44 1f9w n GLU 525 Cb 0.64 -3.67 -0.14 0.00 -0.57 0.00 0.00 31.44 27.70 1f9w n GLU 525 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1f9w s ASN 526 N -0.90 4.63 0.18 1.62 -0.87 -0.91 -4.83 114.94 113.86 1f9w s ASN 526 Ca 0.00 -1.39 -0.32 0.00 -1.57 0.00 0.00 52.86 49.58 1f9w s ASN 526 Cb 0.00 -1.61 -0.12 0.00 -0.02 0.00 0.00 41.25 39.50 1f9w s ASN 526 CO 0.00 -0.23 1.75 -0.38 -2.57 0.00 0.00 177.10 175.67 1f9w n ILE 527 N 4.49 0.10 -4.80 0.60 5.41 -1.26 -3.07 119.36 120.84 1f9w n ILE 527 Ca -0.13 -0.02 -0.31 0.00 1.00 0.00 0.00 62.75 63.29 1f9w n ILE 527 Cb 0.42 -2.01 -0.13 0.00 -0.71 0.00 0.00 39.64 37.21 1f9w n ILE 527 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1f9w s VAL 528 N 1.58 2.67 -0.88 1.39 1.01 0.13 -4.80 120.40 121.50 1f9w s VAL 528 Ca 0.77 -1.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 1f9w s VAL 528 Cb -0.51 -2.08 0.15 0.00 0.00 0.00 0.00 36.38 33.94 1f9w s VAL 528 CO 0.34 0.41 1.00 -0.62 0.00 0.00 0.00 175.10 176.23 1f9w s ASP 529 N -1.22 6.63 0.16 3.32 -1.08 -1.26 -0.59 116.67 122.63 1f9w s ASP 529 Ca 0.13 -2.15 0.12 0.00 -0.52 0.00 0.00 52.55 50.13 1f9w s ASP 529 Cb -0.10 -2.34 0.62 0.00 -1.46 0.00 0.00 42.92 39.63 1f9w s ASP 529 CO 0.03 -0.95 1.37 0.18 0.52 0.00 0.00 175.17 176.32 1f9w n LEU 530 N 5.89 0.29 -0.77 -1.34 4.77 -0.51 -2.00 117.00 123.33 1f9w n LEU 530 Ca 0.19 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.92 1f9w n LEU 530 Cb 0.48 -0.65 0.27 0.00 -2.33 0.00 0.00 43.42 41.19 1f9w n LEU 530 CO 0.47 -0.68 0.73 0.18 -1.33 0.00 0.00 177.39 176.75 1f9w n LEU 531 N -1.88 2.41 0.00 2.23 4.77 -1.09 -4.97 117.00 118.47 1f9w n LEU 531 Ca -0.00 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 1f9w n LEU 531 Cb 0.04 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1f9w n LEU 531 CO 0.06 0.41 0.00 -2.11 -1.33 0.00 0.00 177.39 174.42 1f9w n ARG 532 N 0.88 0.00 0.00 3.23 1.85 -0.84 -4.99 116.66 116.79 1f9w n ARG 532 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.01 1f9w n ARG 532 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 1f9w n ARG 532 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1f9w n LEU 545 N 0.00 0.00 -4.70 2.89 0.00 -1.26 -4.99 117.00 108.93 1f9w n LEU 545 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.64 1f9w n LEU 545 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 43.42 43.34 1f9w n LEU 545 CO 0.00 0.00 -0.01 -0.54 0.00 0.00 0.00 177.39 176.84 1f9w s LYS 546 N -1.39 4.21 -0.39 1.96 1.02 -1.26 -5.03 119.74 118.85 1f9w s LYS 546 Ca 0.00 0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.06 1f9w s LYS 546 Cb 0.00 -3.47 0.13 0.00 -0.52 0.00 0.00 37.83 33.97 1f9w s LYS 546 CO 0.00 0.14 0.22 -1.01 -0.92 0.00 0.00 175.35 173.78 1f9w s HIS 547 N 0.77 1.40 -0.09 3.18 3.76 -1.26 -4.02 115.29 119.03 1f9w s HIS 547 Ca 0.16 -2.01 -0.00 0.00 -0.15 0.00 0.00 55.06 53.05 1f9w s HIS 547 Cb -0.13 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.08 1f9w s HIS 547 CO 0.05 -0.81 -0.07 -1.21 -0.85 0.00 0.00 174.74 171.85 1f9w s GLU 548 N 0.77 2.96 -0.14 1.40 2.02 -1.26 -4.71 118.70 119.74 1f9w s GLU 548 Ca 0.17 -0.55 -0.29 0.00 0.02 0.00 0.00 54.97 54.32 1f9w s GLU 548 Cb -0.23 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.30 1f9w s GLU 548 CO -0.02 0.56 1.74 0.42 0.02 0.00 0.00 175.26 177.99 1f9w s ILE 549 N -0.52 3.49 -0.33 -1.63 1.01 -1.26 -2.44 121.20 119.53 1f9w s ILE 549 Ca 0.08 0.57 -0.01 0.00 0.00 0.00 0.00 60.65 61.29 1f9w s ILE 549 Cb -0.12 -3.46 0.07 0.00 0.01 0.00 0.00 42.46 38.96 1f9w s ILE 549 CO 0.02 -0.16 0.04 -0.13 0.00 0.00 0.00 174.94 174.72 1f9w s ARG 550 N 4.66 2.21 0.58 2.79 1.81 -0.63 -4.98 118.95 125.39 1f9w s ARG 550 Ca 0.78 -1.47 -0.11 0.00 -1.72 0.00 0.00 55.73 53.21 1f9w s ARG 550 Cb -0.30 -3.25 -0.05 0.00 -0.45 0.00 0.00 34.95 30.90 1f9w s ARG 550 CO 0.32 -0.76 0.98 -1.01 -0.68 0.00 0.00 175.30 174.15 1f9w s HIS 551 N 1.17 3.59 -0.45 -0.53 3.76 -1.26 -0.97 115.29 120.61 1f9w s HIS 551 Ca -0.01 1.24 0.02 0.00 -0.15 0.00 0.00 55.06 56.17 1f9w s HIS 551 Cb -0.20 -2.66 0.14 0.00 1.11 0.00 0.00 32.58 30.96 1f9w s HIS 551 CO -0.03 -0.56 0.25 0.34 -0.85 0.00 0.00 174.74 173.89 1f9w s ASP 552 N -3.97 3.58 0.60 1.40 3.68 -1.11 -4.94 116.67 115.91 1f9w s ASP 552 Ca 0.54 -2.68 0.29 0.00 2.13 0.00 0.00 52.55 52.83 1f9w s ASP 552 Cb -0.11 -1.01 1.19 0.00 -1.45 0.00 0.00 42.92 41.54 1f9w s ASP 552 CO 0.49 -0.26 1.56 1.56 0.13 0.00 0.00 175.17 178.65 1f9w h GLN 553 N 6.64 0.00 0.00 4.34 7.50 -1.94 0.60 115.11 132.25 1f9w h GLN 553 Ca 0.01 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.16 1f9w h GLN 553 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.45 1f9w h GLN 553 CO 0.48 0.00 0.00 0.39 -1.50 0.00 0.00 178.83 178.20 1f9w n GLU 554 N -3.45 0.00 0.24 1.46 1.02 -1.26 -4.21 120.64 114.44 1f9w n GLU 554 Ca 0.18 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.45 1f9w n GLU 554 Cb 1.19 -0.35 0.71 0.00 -0.02 0.00 0.00 31.44 32.98 1f9w n GLU 554 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1f9w h THR 555 N 0.00 0.00 -0.24 2.62 1.35 -1.99 -3.44 112.91 111.20 1f9w h THR 555 Ca 0.00 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.75 1f9w h THR 555 Cb 0.00 0.58 -0.04 0.00 -1.73 0.00 0.00 68.15 66.96 1f9w h THR 555 CO 0.00 0.00 -0.10 0.29 -0.25 0.00 0.00 175.52 175.46 1f9w n LYS 556 N -2.52 -0.67 0.00 4.72 4.01 0.21 -5.01 118.16 118.90 1f9w n LYS 556 Ca -0.02 0.56 0.00 0.00 -0.51 0.00 0.00 58.31 58.35 1f9w n LYS 556 Cb 0.19 -4.32 0.00 0.00 -0.51 0.00 0.00 35.03 30.39 1f9w n LYS 556 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1f9w n THR 557 N -2.69 0.00 -3.25 -0.18 -2.24 -1.17 -4.79 114.28 99.96 1f9w n THR 557 Ca -0.05 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1f9w n THR 557 Cb 0.25 -1.94 -0.02 0.00 -2.10 0.00 0.00 70.33 66.51 1f9w n THR 557 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1f9w s THR 558 N -0.92 -0.53 0.49 4.28 2.01 -1.26 -2.74 115.64 116.96 1f9w s THR 558 Ca 0.00 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.08 1f9w s THR 558 Cb 0.00 -1.00 0.08 0.00 0.01 0.00 0.00 72.50 71.59 1f9w s THR 558 CO 0.00 0.00 0.64 0.41 -0.69 0.00 0.00 174.62 174.98 1f9w n THR 559 N 5.28 0.00 -3.58 -0.82 -1.04 -0.14 -4.93 114.28 109.05 1f9w n THR 559 Ca -0.07 -1.65 -0.13 0.00 -2.04 0.00 0.00 64.05 60.16 1f9w n THR 559 Cb 0.53 -0.53 -0.12 0.00 -1.82 0.00 0.00 70.33 68.38 1f9w n THR 559 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1f9w s ILE 560 N -2.06 -0.46 0.33 12.58 1.01 -1.26 -1.60 121.20 129.73 1f9w s ILE 560 Ca 0.48 0.14 -0.28 0.00 0.00 0.00 0.00 60.65 60.99 1f9w s ILE 560 Cb -0.04 -0.58 -0.13 0.00 0.01 0.00 0.00 42.46 41.73 1f9w s ILE 560 CO 0.31 0.01 1.24 0.35 0.00 0.00 0.00 174.94 176.85 1f9w n THR 561 N 5.35 1.95 -2.05 2.92 -2.24 -1.02 -2.66 114.28 116.54 1f9w n THR 561 Ca -0.06 -0.49 -0.14 0.00 -2.27 0.00 0.00 64.05 61.09 1f9w n THR 561 Cb 0.50 -1.45 -0.03 0.00 -2.10 0.00 0.00 70.33 67.25 1f9w n THR 561 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1f9w n ASN 562 N 0.92 -4.06 -4.67 3.42 3.02 -1.26 -4.01 115.26 108.63 1f9w n ASN 562 Ca 0.06 0.23 -0.36 0.00 -0.03 0.00 0.00 54.58 54.47 1f9w n ASN 562 Cb 0.35 -3.54 -0.09 0.00 -0.61 0.00 0.00 39.78 35.88 1f9w n ASN 562 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1f9w s VAL 563 N -2.50 5.37 0.14 2.41 1.01 -1.09 -4.98 120.40 120.76 1f9w s VAL 563 Ca 0.00 0.18 -0.33 0.00 0.00 0.00 0.00 61.98 61.83 1f9w s VAL 563 Cb 0.00 -3.49 -0.13 0.00 0.00 0.00 0.00 36.38 32.76 1f9w s VAL 563 CO 0.00 0.36 1.69 0.41 0.00 0.00 0.00 175.10 177.56 1f9w n THR 564 N 4.15 0.11 -3.95 3.92 -1.04 -1.26 -4.97 114.28 111.24 1f9w n THR 564 Ca -0.15 -0.02 -0.31 0.00 -2.04 0.00 0.00 64.05 61.53 1f9w n THR 564 Cb 0.52 -1.78 -0.15 0.00 -1.82 0.00 0.00 70.33 67.09 1f9w n THR 564 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1f9w s SER 565 N 1.57 4.20 -0.04 8.00 0.15 -1.26 -4.37 113.70 121.94 1f9w s SER 565 Ca 0.80 -1.52 -0.23 0.00 0.70 0.00 0.00 55.95 55.70 1f9w s SER 565 Cb -0.60 -1.31 -0.04 0.00 -1.71 0.00 0.00 66.02 62.36 1f9w s SER 565 CO 0.37 -0.29 0.69 0.00 1.20 0.00 0.00 173.24 175.21 1f9w s LYS 567 N 0.52 3.88 -1.27 0.00 2.20 -1.26 0.03 119.74 123.83 1f9w s LYS 567 Ca 0.36 1.20 -0.18 0.00 -0.36 0.00 0.00 55.97 56.99 1f9w s LYS 567 Cb -0.18 -3.89 0.07 0.00 -1.51 0.00 0.00 37.83 32.31 1f9w s LYS 567 CO 0.18 -1.17 1.70 -0.51 -0.36 0.00 0.00 175.35 175.19 1f9w s LEU 568 N 4.49 3.83 -0.17 5.43 1.43 0.14 -4.64 118.68 129.19 1f9w s LEU 568 Ca 0.57 -2.36 -0.18 0.00 -1.03 0.00 0.00 54.13 51.13 1f9w s LEU 568 Cb -0.16 -2.57 -0.22 0.00 0.03 0.00 0.00 46.19 43.26 1f9w s LEU 568 CO 0.24 -1.20 0.31 -0.33 0.23 0.00 0.00 176.35 175.61 1f9w h GLU 569 N 7.79 0.09 -5.89 1.70 5.08 -1.91 -3.42 114.58 118.03 1f9w h GLU 569 Ca 0.42 -0.15 -0.61 0.00 -1.00 0.00 0.00 59.36 58.02 1f9w h GLU 569 Cb 0.88 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 30.06 1f9w h GLU 569 CO 1.45 1.07 -0.67 -1.54 -1.00 0.00 0.00 179.01 178.32 1f9w s SER 570 N -6.89 3.69 0.10 1.42 1.04 -1.26 -5.02 113.70 106.78 1f9w s SER 570 Ca -0.26 -1.21 0.28 0.00 0.48 0.00 0.00 55.95 55.23 1f9w s SER 570 Cb 0.05 -0.34 1.04 0.00 0.10 0.00 0.00 66.02 66.87 1f9w s SER 570 CO 0.66 -0.23 1.86 -0.62 0.98 0.00 0.00 173.24 175.88 1f9w n GLU 571 N -0.80 0.12 -0.10 4.02 -0.58 -1.26 -2.84 120.64 119.21 1f9w n GLU 571 Ca -0.05 0.10 -0.11 0.00 -0.42 0.00 0.00 57.16 56.68 1f9w n GLU 571 Cb 0.64 -1.64 -0.03 0.00 -0.57 0.00 0.00 31.44 29.83 1f9w n GLU 571 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1f9w h GLU 572 N 0.00 0.55 0.87 3.49 4.39 -1.98 -0.65 114.58 121.25 1f9w h GLU 572 Ca 0.00 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 1f9w h GLU 572 Cb 0.61 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.23 1f9w h GLU 572 CO 0.00 0.71 -0.42 1.98 -1.16 0.00 0.00 179.01 180.12 1f9w h MET 573 N 0.33 -1.13 -1.06 2.33 4.05 -1.92 -0.67 114.93 116.86 1f9w h MET 573 Ca 0.08 0.08 0.32 0.00 -0.28 0.00 0.00 59.70 59.90 1f9w h MET 573 Cb 0.48 0.26 -0.13 0.00 -0.80 0.00 0.00 31.60 31.40 1f9w h MET 573 CO 0.02 -0.75 0.63 0.28 0.23 0.00 0.00 176.91 177.32 1f9w h VAL 574 N -1.17 0.35 0.11 -5.77 2.07 -1.52 0.50 116.25 110.82 1f9w h VAL 574 Ca -0.12 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1f9w h VAL 574 Cb 0.90 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1f9w h VAL 574 CO 0.19 0.06 -0.05 -0.08 0.02 0.00 0.00 177.57 177.71 1f9w h GLU 575 N 0.35 -0.14 0.66 1.57 4.22 -0.34 0.14 114.58 121.03 1f9w h GLU 575 Ca 0.71 0.01 -0.03 0.00 0.08 0.00 0.00 59.36 60.12 1f9w h GLU 575 Cb 1.70 0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.99 1f9w h GLU 575 CO -0.50 0.01 -0.32 0.82 -2.18 0.00 0.00 179.01 176.84 1f9w h ILE 576 N -0.26 0.27 -0.02 2.32 5.03 0.13 0.31 117.51 125.29 1f9w h ILE 576 Ca -0.02 -0.19 0.02 0.00 -0.12 0.00 0.00 64.86 64.56 1f9w h ILE 576 Cb 0.22 0.33 -0.05 0.00 -3.03 0.00 0.00 36.82 34.28 1f9w h ILE 576 CO 0.02 0.02 -0.48 0.40 -0.68 0.00 0.00 178.15 177.43 1f9w h ILE 577 N -1.03 0.00 -0.12 -0.67 2.04 -0.60 0.42 117.51 117.56 1f9w h ILE 577 Ca -0.09 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.81 1f9w h ILE 577 Cb 0.72 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.73 1f9w h ILE 577 CO 0.15 0.00 -0.40 -0.07 0.00 0.00 0.00 178.15 177.83 1f9w h LEU 578 N -0.59 -1.24 -0.32 1.44 -0.00 -0.71 0.75 115.31 114.65 1f9w h LEU 578 Ca 0.01 0.17 0.04 0.00 -0.00 0.00 0.00 57.88 58.10 1f9w h LEU 578 Cb 0.64 0.50 -0.08 0.00 -0.00 0.00 0.00 40.66 41.73 1f9w h LEU 578 CO -0.33 -0.42 -0.55 0.50 -0.00 0.00 0.00 178.44 177.64 1f9w h LYS 579 N -0.48 -0.44 -0.79 1.13 3.64 0.06 0.50 116.57 120.19 1f9w h LYS 579 Ca 0.08 0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.63 1f9w h LYS 579 Cb 0.61 0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.44 1f9w h LYS 579 CO -0.38 -0.30 0.37 -0.22 -2.27 0.00 0.00 179.45 176.65 1f9w h LYS 580 N -0.46 0.52 -0.80 1.90 3.64 0.76 -1.58 116.57 120.55 1f9w h LYS 580 Ca 0.06 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1f9w h LYS 580 Cb 0.63 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.27 1f9w h LYS 580 CO -0.54 0.35 0.48 0.00 -2.27 0.00 0.00 179.45 177.46 1f9w h ALA 581 N 1.54 1.10 -0.18 5.00 0.00 0.26 -2.27 119.26 124.71 1f9w h ALA 581 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.14 1f9w h ALA 581 Cb 0.61 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1f9w h ALA 581 CO -0.37 0.19 -0.69 -0.97 0.00 0.00 0.00 179.25 177.41 1f9w h ASN 582 N 0.87 0.85 -0.13 0.00 -1.24 -0.24 -1.79 115.58 113.90 1f9w h ASN 582 Ca 0.36 -0.52 0.00 0.00 0.71 0.00 0.00 56.30 56.85 1f9w h ASN 582 Cb 0.20 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 1f9w h ASN 582 CO -0.19 1.30 0.08 0.11 -1.29 0.00 0.00 177.43 177.45 1f9w h LYS 583 N 0.52 0.18 -0.05 6.67 1.57 -1.15 -2.27 116.57 122.05 1f9w h LYS 583 Ca -0.03 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 1f9w h LYS 583 Cb 1.30 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.58 1f9w h LYS 583 CO 0.14 0.12 -0.53 -0.07 -0.57 0.00 0.00 179.45 178.54 1f9w h LEU 584 N 0.18 0.55 -3.63 2.94 3.38 -1.15 -3.36 115.31 114.22 1f9w h LEU 584 Ca 0.05 -0.70 -0.11 0.00 0.09 0.00 0.00 57.88 57.21 1f9w h LEU 584 Cb -0.01 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1f9w h LEU 584 CO -0.01 1.17 0.13 0.54 0.09 0.00 0.00 178.44 180.36 1f9w n ARG 585 N -4.25 4.17 -3.19 1.13 5.12 -0.70 -4.68 116.66 114.26 1f9w n ARG 585 Ca -0.09 -3.12 -0.14 0.00 -1.93 0.00 0.00 57.85 52.57 1f9w n ARG 585 Cb 0.63 -2.21 -0.03 0.00 -1.16 0.00 0.00 32.46 29.68 1f9w n ARG 585 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1f9w n SER 586 N 0.14 1.88 -0.42 0.55 7.64 -0.88 -4.81 113.62 117.72 1f9w n SER 586 Ca 0.34 -2.03 0.00 0.00 1.01 0.00 0.00 58.87 58.19 1f9w n SER 586 Cb 1.27 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 64.80 1f9w n SER 586 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1f9w n THR 587 N -0.51 0.00 0.00 0.44 -1.04 -1.26 -5.01 114.28 106.90 1f9w n THR 587 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1f9w n THR 587 Cb 0.29 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1f9w n THR 587 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 1f9w n HIS 595 N 0.00 0.00 0.31 -1.42 -0.00 -1.26 -5.21 115.22 107.64 1f9w n HIS 595 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 57.72 57.90 1f9w n HIS 595 Cb 0.00 0.00 0.97 0.00 -0.00 0.00 0.00 29.99 30.96 1f9w n HIS 595 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1f9w h SER 596 N 0.00 0.00 0.44 0.26 4.64 -1.94 0.19 113.55 117.15 1f9w h SER 596 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 1f9w h SER 596 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1f9w h SER 596 CO 0.00 0.00 -0.99 -1.28 -0.87 0.00 0.00 176.83 173.69 1f9w h SER 597 N 0.00 0.46 -0.54 4.97 0.87 -1.94 -3.29 113.55 114.07 1f9w h SER 597 Ca 0.00 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1f9w h SER 597 Cb 0.27 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1f9w h SER 597 CO 0.00 1.21 0.00 0.54 -0.53 0.00 0.00 176.83 178.05 1f9w n ARG 598 N -3.69 4.25 -4.32 2.24 5.12 0.66 0.23 116.66 121.14 1f9w n ARG 598 Ca -0.06 -2.79 -0.20 0.00 -1.93 0.00 0.00 57.85 52.87 1f9w n ARG 598 Cb 0.87 -2.10 -0.08 0.00 -1.16 0.00 0.00 32.46 29.99 1f9w n ARG 598 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1f9w s SER 599 N -0.75 1.75 -0.29 0.55 1.04 -1.10 -4.61 113.70 110.30 1f9w s SER 599 Ca 0.49 -1.71 0.01 0.00 0.48 0.00 0.00 55.95 55.22 1f9w s SER 599 Cb 0.36 0.53 0.06 0.00 0.10 0.00 0.00 66.02 67.07 1f9w s SER 599 CO 0.17 -1.02 -0.03 -1.00 0.98 0.00 0.00 173.24 172.34 1f9w s HIS 600 N -3.47 3.33 0.19 5.02 3.76 -0.81 -1.25 115.29 122.06 1f9w s HIS 600 Ca 0.37 -2.20 -0.12 0.00 -0.15 0.00 0.00 55.06 52.96 1f9w s HIS 600 Cb 0.03 -2.16 -0.07 0.00 1.11 0.00 0.00 32.58 31.49 1f9w s HIS 600 CO 0.24 -0.86 0.56 -1.54 -0.85 0.00 0.00 174.74 172.29 1f9w s SER 601 N 1.19 6.73 -0.03 1.40 1.04 -0.54 0.14 113.70 123.62 1f9w s SER 601 Ca -0.05 1.02 -0.01 0.00 0.48 0.00 0.00 55.95 57.39 1f9w s SER 601 Cb -0.20 -2.26 0.03 0.00 0.10 0.00 0.00 66.02 63.69 1f9w s SER 601 CO -0.04 0.01 0.05 -0.63 0.98 0.00 0.00 173.24 173.61 1f9w s ILE 602 N -1.65 -0.09 -0.22 -1.02 1.09 0.35 -1.62 121.20 118.04 1f9w s ILE 602 Ca 0.43 0.32 -0.07 0.00 -1.10 0.00 0.00 60.65 60.23 1f9w s ILE 602 Cb -0.13 -0.12 -0.03 0.00 -1.06 0.00 0.00 42.46 41.11 1f9w s ILE 602 CO 0.20 0.13 0.07 0.12 -0.10 0.00 0.00 174.94 175.36 1f9w s PHE 603 N 1.61 3.14 -0.17 3.97 2.19 -0.60 -1.90 117.98 126.23 1f9w s PHE 603 Ca -0.02 -0.20 0.01 0.00 0.33 0.00 0.00 56.93 57.05 1f9w s PHE 603 Cb -0.12 -2.17 0.01 0.00 -1.31 0.00 0.00 43.02 39.43 1f9w s PHE 603 CO -0.03 -0.14 -0.19 0.42 1.83 0.00 0.00 175.22 177.11 1f9w s ILE 604 N 1.09 2.21 -0.15 3.12 1.01 0.12 -0.58 121.20 128.03 1f9w s ILE 604 Ca 0.04 -0.90 -0.02 0.00 0.00 0.00 0.00 60.65 59.76 1f9w s ILE 604 Cb -0.14 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 1f9w s ILE 604 CO 0.03 0.53 -0.07 -0.63 0.00 0.00 0.00 174.94 174.80 1f9w s ILE 605 N 1.12 3.54 -0.39 2.92 1.09 -0.42 -1.12 121.20 127.95 1f9w s ILE 605 Ca 0.01 -0.48 -0.06 0.00 -1.10 0.00 0.00 60.65 59.01 1f9w s ILE 605 Cb -0.14 -2.53 0.08 0.00 -1.06 0.00 0.00 42.46 38.80 1f9w s ILE 605 CO -0.08 0.50 0.18 -1.00 -0.10 0.00 0.00 174.94 174.45 1f9w s HIS 606 N 0.39 3.38 -0.57 3.97 3.76 0.13 -2.05 115.29 124.29 1f9w s HIS 606 Ca -0.07 -1.79 -0.24 0.00 -0.15 0.00 0.00 55.06 52.82 1f9w s HIS 606 Cb -0.15 -2.79 0.05 0.00 1.11 0.00 0.00 32.58 30.79 1f9w s HIS 606 CO 0.04 -0.86 0.93 -0.51 -0.85 0.00 0.00 174.74 173.50 1f9w s LEU 607 N 1.32 4.18 -0.31 0.89 1.43 0.62 -3.09 118.68 123.73 1f9w s LEU 607 Ca 0.02 -0.49 0.04 0.00 -1.03 0.00 0.00 54.13 52.67 1f9w s LEU 607 Cb -0.22 -2.73 0.09 0.00 0.03 0.00 0.00 46.19 43.35 1f9w s LEU 607 CO 0.00 -1.26 -0.00 -0.55 0.23 0.00 0.00 176.35 174.77 1f9w s SER 608 N 2.99 4.63 -0.12 2.29 0.15 -0.44 -0.67 113.70 122.53 1f9w s SER 608 Ca 0.28 -1.89 -0.00 0.00 0.70 0.00 0.00 55.95 55.04 1f9w s SER 608 Cb -0.14 -1.58 0.03 0.00 -1.71 0.00 0.00 66.02 62.63 1f9w s SER 608 CO 0.17 -0.32 -0.07 -0.83 1.20 0.00 0.00 173.24 173.39 1f9w s GLY 609 N 0.99 0.84 0.00 9.45 0.00 0.12 0.73 107.32 119.46 1f9w s GLY 609 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.18 1f9w s GLY 609 CO -0.07 0.83 0.00 -1.14 0.00 0.00 0.00 173.10 172.72 1f9w n SER 610 N 4.94 0.00 0.00 1.64 3.41 -1.07 -1.58 113.62 120.96 1f9w n SER 610 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 1f9w n SER 610 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1f9w n SER 610 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1f9w n ASN 611 N 0.00 0.00 -0.32 4.04 5.15 -1.26 -3.65 115.26 119.21 1f9w n ASN 611 Ca 0.00 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.02 1f9w n ASN 611 Cb 0.00 0.00 0.10 0.00 -0.53 0.00 0.00 39.78 39.35 1f9w n ASN 611 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1f9w n ALA 612 N 0.00 0.13 -0.17 5.20 0.00 -1.26 0.20 120.51 124.60 1f9w n ALA 612 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 53.44 54.38 1f9w n ALA 612 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1f9w n ALA 612 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1f9w n LYS 613 N -5.39 0.00 -0.20 0.00 4.01 -1.26 -3.00 118.16 112.33 1f9w n LYS 613 Ca 0.13 0.88 0.10 0.00 -0.51 0.00 0.00 58.31 58.91 1f9w n LYS 613 Cb 0.41 -1.41 0.20 0.00 -0.51 0.00 0.00 35.03 33.72 1f9w n LYS 613 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1f9w n THR 614 N -2.59 0.63 -0.79 -0.18 -1.04 -1.06 -4.96 114.28 104.29 1f9w n THR 614 Ca 0.00 -0.82 -0.04 0.00 -2.04 0.00 0.00 64.05 61.15 1f9w n THR 614 Cb 0.00 0.83 -0.02 0.00 -1.82 0.00 0.00 70.33 69.33 1f9w n THR 614 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1f9w n GLY 615 N 1.23 0.37 3.57 3.41 0.00 0.52 -4.80 105.19 109.49 1f9w n GLY 615 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 1f9w n GLY 615 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9w s ALA 616 N -1.01 1.14 0.16 4.61 0.00 -1.25 -4.73 121.76 120.68 1f9w s ALA 616 Ca 0.00 -1.46 -0.32 0.00 0.00 0.00 0.00 51.96 50.18 1f9w s ALA 616 Cb 0.00 -4.63 -0.11 0.00 0.00 0.00 0.00 23.12 18.38 1f9w s ALA 616 CO 0.00 -5.73 1.78 0.72 0.00 0.00 0.00 175.76 172.53 1f9w n HIS 617 N 16.74 2.67 -4.28 0.00 8.25 -1.26 -4.53 115.22 132.82 1f9w n HIS 617 Ca 0.43 -0.05 -0.23 0.00 -0.26 0.00 0.00 57.72 57.61 1f9w n HIS 617 Cb 0.46 -2.70 -0.17 0.00 1.12 0.00 0.00 29.99 28.70 1f9w n HIS 617 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1f9w s SER 618 N 1.97 1.58 0.01 0.41 0.15 -0.61 -5.00 113.70 112.20 1f9w s SER 618 Ca 0.79 -0.23 0.04 0.00 0.70 0.00 0.00 55.95 57.25 1f9w s SER 618 Cb -0.50 -0.69 -0.01 0.00 -1.71 0.00 0.00 66.02 63.11 1f9w s SER 618 CO 0.35 -0.03 -0.14 -0.47 1.20 0.00 0.00 173.24 174.15 1f9w s TYR 619 N 1.00 1.20 -0.00 3.44 5.04 -1.25 0.14 117.35 126.92 1f9w s TYR 619 Ca -0.09 -0.27 -0.28 0.00 -2.44 0.00 0.00 57.07 53.99 1f9w s TYR 619 Cb -0.15 -0.75 0.07 0.00 0.35 0.00 0.00 41.96 41.48 1f9w s TYR 619 CO -0.00 -0.00 0.64 0.20 -1.34 0.00 0.00 175.55 175.05 1f9w s GLY 620 N -0.59 -0.56 0.11 8.97 0.00 0.15 -4.18 107.32 111.23 1f9w s GLY 620 Ca 0.04 1.08 0.07 0.00 0.00 0.00 0.00 44.72 45.91 1f9w s GLY 620 CO 0.00 0.73 -0.18 -1.59 0.00 0.00 0.00 173.10 172.06 1f9w s THR 621 N -1.78 1.56 -0.05 0.90 2.01 -1.15 -0.28 115.64 116.84 1f9w s THR 621 Ca -0.08 -1.62 0.02 0.00 0.31 0.00 0.00 61.69 60.32 1f9w s THR 621 Cb -0.00 -1.53 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1f9w s THR 621 CO 0.05 -0.21 -0.12 -0.76 -0.69 0.00 0.00 174.62 172.89 1f9w s LEU 622 N -2.15 1.68 -0.22 4.42 1.02 -0.87 0.10 118.68 122.66 1f9w s LEU 622 Ca 0.07 -0.27 0.01 0.00 0.02 0.00 0.00 54.13 53.97 1f9w s LEU 622 Cb -0.08 -0.76 0.05 0.00 0.02 0.00 0.00 46.19 45.42 1f9w s LEU 622 CO 0.04 0.05 -0.09 0.20 0.02 0.00 0.00 176.35 176.57 1f9w s ASN 623 N 0.51 3.71 -0.45 2.29 -0.87 0.39 -1.30 114.94 119.22 1f9w s ASN 623 Ca -0.11 -1.06 -0.14 0.00 -1.57 0.00 0.00 52.86 49.99 1f9w s ASN 623 Cb -0.14 -1.27 0.07 0.00 -0.02 0.00 0.00 41.25 39.89 1f9w s ASN 623 CO 0.03 -0.18 0.34 -0.76 -2.57 0.00 0.00 177.10 173.96 1f9w s LEU 624 N 1.35 5.41 -0.14 0.60 1.43 0.26 -0.63 118.68 126.95 1f9w s LEU 624 Ca -0.04 -1.30 -0.04 0.00 -1.03 0.00 0.00 54.13 51.71 1f9w s LEU 624 Cb -0.18 -2.13 -0.03 0.00 0.03 0.00 0.00 46.19 43.88 1f9w s LEU 624 CO -0.07 -0.59 0.01 -0.69 0.23 0.00 0.00 176.35 175.25 1f9w s VAL 625 N 1.59 4.36 -0.52 -1.59 1.01 0.15 -1.56 120.40 123.84 1f9w s VAL 625 Ca 0.04 -0.20 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 1f9w s VAL 625 Cb -0.23 -2.91 0.14 0.00 0.00 0.00 0.00 36.38 33.38 1f9w s VAL 625 CO 0.06 0.52 0.35 -0.62 0.00 0.00 0.00 175.10 175.41 1f9w s ASP 626 N -0.08 5.44 0.82 3.32 -1.08 -0.64 -0.85 116.67 123.61 1f9w s ASP 626 Ca 0.04 -2.31 -0.10 0.00 -0.52 0.00 0.00 52.55 49.66 1f9w s ASP 626 Cb -0.13 -1.90 0.09 0.00 -1.46 0.00 0.00 42.92 39.52 1f9w s ASP 626 CO 0.02 -0.52 1.11 -0.76 0.52 0.00 0.00 175.17 175.53 1f9w s LEU 627 N 0.74 2.95 0.71 -1.34 1.43 -0.76 -1.47 118.68 120.94 1f9w s LEU 627 Ca 0.11 1.92 -0.11 0.00 -1.03 0.00 0.00 54.13 55.02 1f9w s LEU 627 Cb -0.22 -4.52 0.02 0.00 0.03 0.00 0.00 46.19 41.50 1f9w s LEU 627 CO -0.03 -2.38 1.09 0.00 0.23 0.00 0.00 176.35 175.26 1f9w s ALA 628 N -2.83 2.90 -0.57 4.21 0.00 -0.38 -4.84 121.76 120.25 1f9w s ALA 628 Ca 0.63 -0.38 -0.31 0.00 0.00 0.00 0.00 51.96 51.90 1f9w s ALA 628 Cb -0.19 -3.00 -0.13 0.00 0.00 0.00 0.00 23.12 19.80 1f9w s ALA 628 CO 0.57 -1.15 2.40 0.41 0.00 0.00 0.00 175.76 177.99 1f9w n GLY 629 N -3.00 0.11 0.00 0.00 0.00 0.62 -4.72 105.19 98.21 1f9w n GLY 629 Ca 0.07 0.91 0.05 0.00 0.00 0.00 0.00 46.02 47.06 1f9w n GLY 629 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1f9w n SER 630 N 11.87 0.00 -4.33 1.61 2.88 -1.20 -4.83 113.62 119.63 1f9w n SER 630 Ca 0.47 0.37 -0.38 0.00 -1.33 0.00 0.00 58.87 58.00 1f9w n SER 630 Cb 0.27 -0.42 0.03 0.00 -0.75 0.00 0.00 64.21 63.34 1f9w n SER 630 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1f9w n ALA 631 N -1.42 -2.43 -3.53 -1.46 0.00 -1.26 -4.74 120.51 105.66 1f9w n ALA 631 Ca 0.04 -0.13 -0.41 0.00 0.00 0.00 0.00 53.44 52.93 1f9w n ALA 631 Cb 0.12 -1.59 -0.07 0.00 0.00 0.00 0.00 19.45 17.91 1f9w n ALA 631 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1f9w s ARG 632 N -1.73 2.92 0.00 0.00 0.52 -1.26 -4.99 118.95 114.41 1f9w s ARG 632 Ca 0.60 -2.30 0.00 0.00 -0.52 0.00 0.00 55.73 53.51 1f9w s ARG 632 Cb -0.43 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.01 1f9w s ARG 632 CO 0.63 -1.22 0.00 -0.11 0.02 0.00 0.00 175.30 174.61 1f9w n LEU 643 N 4.04 0.00 -0.33 2.53 0.00 -1.26 -5.14 117.00 116.85 1f9w n LEU 643 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 56.01 56.13 1f9w n LEU 643 Cb 0.42 0.00 0.10 0.00 0.00 0.00 0.00 43.42 43.94 1f9w n LEU 643 CO 0.36 0.00 0.43 -1.14 0.00 0.00 0.00 177.39 177.04 1f9w n ARG 644 N 0.00 0.87 0.20 1.96 3.00 -1.26 -4.65 116.66 116.79 1f9w n ARG 644 Ca 0.00 -2.17 0.11 0.00 -0.00 0.00 0.00 57.85 55.79 1f9w n ARG 644 Cb 0.00 -1.14 0.59 0.00 0.00 0.00 0.00 32.46 31.91 1f9w n ARG 644 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 1f9w h GLU 645 N 0.16 0.00 0.03 -0.14 4.11 -1.98 0.50 114.58 117.25 1f9w h GLU 645 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1f9w h GLU 645 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1f9w h GLU 645 CO 0.01 0.00 -0.01 1.15 0.07 0.00 0.00 179.01 180.22 1f9w h THR 646 N 0.00 1.06 0.00 -1.06 2.02 -1.96 0.72 112.91 113.69 1f9w h THR 646 Ca 0.00 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 1f9w h THR 646 Cb 0.29 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1f9w h THR 646 CO 0.00 0.07 -0.18 -0.61 0.37 0.00 0.00 175.52 175.16 1f9w h GLN 647 N -0.15 0.00 0.37 6.66 4.15 -1.28 -2.28 115.11 122.57 1f9w h GLN 647 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1f9w h GLN 647 Cb 0.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 1f9w h GLN 647 CO 0.01 0.18 -0.18 -0.97 -1.93 0.00 0.00 178.83 175.94 1f9w h ASN 648 N 0.00 -0.42 -0.56 -0.69 -1.24 -1.25 -1.14 115.58 110.29 1f9w h ASN 648 Ca -0.00 -0.15 0.09 0.00 0.71 0.00 0.00 56.30 56.95 1f9w h ASN 648 Cb 0.33 0.11 -0.07 0.00 0.73 0.00 0.00 38.32 39.42 1f9w h ASN 648 CO 0.02 -0.02 0.19 0.40 -1.29 0.00 0.00 177.43 176.74 1f9w h ILE 649 N -0.88 0.78 0.00 2.57 2.04 0.57 0.34 117.51 122.92 1f9w h ILE 649 Ca -0.05 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 1f9w h ILE 649 Cb 0.54 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1f9w h ILE 649 CO 0.08 0.07 -0.18 0.78 0.00 0.00 0.00 178.15 178.90 1f9w h ASN 650 N 0.37 0.00 0.48 1.72 2.35 -1.44 0.36 115.58 119.42 1f9w h ASN 650 Ca 0.28 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.01 1f9w h ASN 650 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1f9w h ASN 650 CO -0.30 0.18 -0.23 0.50 -1.65 0.00 0.00 177.43 175.93 1f9w h LYS 651 N 0.00 -0.62 0.55 0.81 3.64 0.80 -1.72 116.57 120.03 1f9w h LYS 651 Ca -0.00 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1f9w h LYS 651 Cb 0.42 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1f9w h LYS 651 CO 0.02 -0.41 -0.47 1.03 -2.27 0.00 0.00 179.45 177.36 1f9w h SER 652 N -1.15 -1.25 -0.43 4.20 0.87 -0.32 0.25 113.55 115.73 1f9w h SER 652 Ca -0.07 0.09 0.09 0.00 -1.23 0.00 0.00 61.79 60.68 1f9w h SER 652 Cb 0.49 0.40 -0.09 0.00 -0.44 0.00 0.00 62.40 62.76 1f9w h SER 652 CO 0.11 -0.65 -0.24 -0.07 -0.53 0.00 0.00 176.83 175.45 1f9w h LEU 653 N -1.00 -0.81 -0.82 2.23 3.38 -1.06 0.32 115.31 117.55 1f9w h LEU 653 Ca -0.07 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1f9w h LEU 653 Cb 0.85 0.42 -0.04 0.00 0.09 0.00 0.00 40.66 41.98 1f9w h LEU 653 CO -0.02 -0.26 0.52 -1.28 0.09 0.00 0.00 178.44 177.49 1f9w h SER 654 N -0.16 0.96 0.29 -0.43 0.87 -1.13 0.36 113.55 114.32 1f9w h SER 654 Ca 0.20 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1f9w h SER 654 Cb 0.47 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1f9w h SER 654 CO -0.52 0.72 -0.26 0.00 -0.53 0.00 0.00 176.83 176.24 1f9w h LEU 656 N -0.57 -0.05 -0.08 0.00 5.85 -0.05 0.31 115.31 120.72 1f9w h LEU 656 Ca -0.02 0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1f9w h LEU 656 Cb 0.51 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1f9w h LEU 656 CO -0.03 -0.04 -0.32 1.23 -0.34 0.00 0.00 178.44 178.93 1f9w h GLY 657 N 0.23 -1.29 0.14 3.75 0.00 -0.04 0.45 103.07 106.31 1f9w h GLY 657 Ca 0.37 0.68 0.18 0.00 0.00 0.00 0.00 47.33 48.56 1f9w h GLY 657 CO -0.49 -0.36 0.58 -0.55 0.00 0.00 0.00 176.54 175.72 1f9w h ASP 658 N -0.35 0.73 -0.30 0.19 3.32 0.41 0.73 116.42 121.15 1f9w h ASP 658 Ca 0.02 0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 1f9w h ASP 658 Cb 0.40 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1f9w h ASP 658 CO -0.26 0.26 -0.21 0.58 -1.72 0.00 0.00 179.24 177.90 1f9w h VAL 659 N 0.74 1.30 0.30 -1.35 2.07 0.63 0.01 116.25 119.95 1f9w h VAL 659 Ca 0.56 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1f9w h VAL 659 Cb 0.85 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1f9w h VAL 659 CO -0.38 0.43 -0.15 0.40 0.02 0.00 0.00 177.57 177.89 1f9w h ILE 660 N 0.42 0.00 -0.31 4.57 1.08 0.82 -1.91 117.51 122.19 1f9w h ILE 660 Ca 0.06 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.54 1f9w h ILE 660 Cb 0.76 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.47 1f9w h ILE 660 CO 0.06 0.00 -0.18 1.57 -0.69 0.00 0.00 178.15 178.91 1f9w n HIS 661 N -3.13 -0.13 -0.34 1.37 -0.00 0.16 0.92 115.22 114.06 1f9w n HIS 661 Ca -0.05 0.38 0.27 0.00 -0.00 0.00 0.00 57.72 58.32 1f9w n HIS 661 Cb 0.16 -0.45 0.57 0.00 -0.00 0.00 0.00 29.99 30.28 1f9w n HIS 661 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1f9w h ALA 662 N -0.27 2.46 0.02 1.57 0.00 -1.01 0.16 119.26 122.19 1f9w h ALA 662 Ca 0.05 0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.75 1f9w h ALA 662 Cb 0.13 0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1f9w h ALA 662 CO -0.29 -0.89 -1.05 -0.07 0.00 0.00 0.00 179.25 176.95 1f9w h LEU 663 N 0.28 0.89 -1.64 0.00 3.38 0.14 -3.11 115.31 115.25 1f9w h LEU 663 Ca 0.63 -0.76 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1f9w h LEU 663 Cb 1.81 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 1f9w h LEU 663 CO -0.27 1.53 0.02 0.61 0.09 0.00 0.00 178.44 180.43 1f9w n GLY 664 N 1.14 1.87 3.81 0.83 0.00 0.50 -4.80 105.19 108.54 1f9w n GLY 664 Ca -0.12 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 1f9w n GLY 664 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1f9w s GLN 665 N -0.65 3.14 0.00 1.61 1.11 -0.92 -4.61 119.66 119.34 1f9w s GLN 665 Ca 0.03 -0.45 0.00 0.00 0.01 0.00 0.00 55.36 54.95 1f9w s GLN 665 Cb 0.03 -2.91 0.00 0.00 -1.01 0.00 0.00 33.01 29.12 1f9w s GLN 665 CO 0.01 0.65 0.24 -2.30 0.01 0.00 0.00 175.29 173.91 1f9w n PRO 666 N 1.15 0.00 -2.34 2.91 -0.02 -1.26 -3.43 135.00 132.00 1f9w n PRO 666 Ca -0.13 0.10 -0.36 0.00 -2.02 0.00 0.00 63.50 61.10 1f9w n PRO 666 Cb 0.53 -0.74 -0.03 0.00 -0.02 0.00 0.00 33.50 33.23 1f9w n PRO 666 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1f9w s ASP 667 N -2.42 5.97 0.00 2.55 -1.08 -1.26 -4.16 116.67 116.27 1f9w s ASP 667 Ca 0.00 -1.69 0.00 0.00 -0.52 0.00 0.00 52.55 50.34 1f9w s ASP 667 Cb 0.00 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 1f9w s ASP 667 CO 0.00 -2.05 0.00 -1.54 0.52 0.00 0.00 175.17 172.10 1f9w n SER 668 N 11.14 4.20 0.25 -0.34 3.41 -1.22 -3.86 113.62 127.19 1f9w n SER 668 Ca 0.43 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 59.18 1f9w n SER 668 Cb 0.47 0.60 0.82 0.00 -0.26 0.00 0.00 64.21 65.85 1f9w n SER 668 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f9w h THR 669 N 0.00 0.63 -0.01 6.66 1.03 -1.84 0.14 112.91 119.51 1f9w h THR 669 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 1f9w h THR 669 Cb 0.47 0.95 0.00 0.00 -1.07 0.00 0.00 68.15 68.50 1f9w h THR 669 CO 0.00 0.00 -0.06 0.29 -0.01 0.00 0.00 175.52 175.74 1f9w n LYS 670 N -4.02 1.06 -3.46 0.00 4.76 -1.26 -4.98 118.16 110.26 1f9w n LYS 670 Ca -0.01 -1.15 -0.36 0.00 -2.87 0.00 0.00 58.31 53.92 1f9w n LYS 670 Cb 0.17 -1.23 -0.06 0.00 -1.84 0.00 0.00 35.03 32.07 1f9w n LYS 670 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1f9w s ARG 671 N -1.20 3.91 -0.60 1.97 6.06 0.48 -5.04 118.95 124.53 1f9w s ARG 671 Ca 0.14 0.38 -0.24 0.00 -2.50 0.00 0.00 55.73 53.52 1f9w s ARG 671 Cb 0.11 -3.06 0.05 0.00 0.06 0.00 0.00 34.95 32.11 1f9w s ARG 671 CO 0.20 0.58 0.96 -1.01 -2.50 0.00 0.00 175.30 173.52 1f9w s HIS 672 N -1.31 2.73 -0.13 5.12 3.76 -1.26 -4.87 115.29 119.33 1f9w s HIS 672 Ca 0.32 -0.22 -0.20 0.00 -0.15 0.00 0.00 55.06 54.80 1f9w s HIS 672 Cb -0.15 -4.16 -0.03 0.00 1.11 0.00 0.00 32.58 29.34 1f9w s HIS 672 CO 0.17 -1.49 0.59 0.42 -0.85 0.00 0.00 174.74 173.58 1f9w s ILE 673 N 4.05 5.10 -1.44 0.60 1.01 -1.26 -4.99 121.20 124.26 1f9w s ILE 673 Ca 0.27 1.16 -0.11 0.00 0.00 0.00 0.00 60.65 61.97 1f9w s ILE 673 Cb -0.14 -3.92 0.05 0.00 0.01 0.00 0.00 42.46 38.46 1f9w s ILE 673 CO 0.16 0.23 2.33 -0.81 0.00 0.00 0.00 174.94 176.85 1f9w n PRO 674 N 4.16 3.43 -0.24 2.79 -0.04 -1.26 -4.76 135.00 139.08 1f9w n PRO 674 Ca -0.04 -2.83 -0.03 0.00 -0.04 0.00 0.00 63.50 60.56 1f9w n PRO 674 Cb 0.51 -3.02 0.07 0.00 -0.04 0.00 0.00 33.50 31.03 1f9w n PRO 674 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1f9w h PHE 675 N 5.55 0.78 0.00 0.54 0.04 -1.94 -2.62 116.94 119.30 1f9w h PHE 675 Ca 0.61 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.41 1f9w h PHE 675 Cb 0.52 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.41 1f9w h PHE 675 CO 1.52 0.44 0.00 2.89 -0.60 0.00 0.00 178.31 182.57 1f9w n ARG 676 N -4.69 0.66 0.00 1.51 1.85 -1.26 -0.59 116.66 114.13 1f9w n ARG 676 Ca 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.94 1f9w n ARG 676 Cb 0.09 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.00 1f9w n ARG 676 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1f9w n ASN 677 N -1.13 0.78 -3.65 2.89 4.13 -0.99 -4.65 115.26 112.64 1f9w n ASN 677 Ca 0.17 -1.50 -0.01 0.00 1.68 0.00 0.00 54.58 54.92 1f9w n ASN 677 Cb 0.15 -0.37 -0.07 0.00 -1.54 0.00 0.00 39.78 37.95 1f9w n ASN 677 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1f9w s SER 678 N -0.23 -0.10 0.51 6.41 0.15 -1.25 -4.94 113.70 114.25 1f9w s SER 678 Ca 0.00 0.18 0.16 0.00 0.70 0.00 0.00 55.95 56.99 1f9w s SER 678 Cb 0.00 0.54 1.23 0.00 -1.71 0.00 0.00 66.02 66.08 1f9w s SER 678 CO 0.00 -0.03 2.12 0.50 1.20 0.00 0.00 173.24 177.03 1f9w h LYS 679 N 4.07 0.00 0.12 5.44 1.63 -1.87 -1.67 116.57 124.28 1f9w h LYS 679 Ca -0.27 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.53 1f9w h LYS 679 Cb 1.18 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1f9w h LYS 679 CO 0.20 0.04 -0.06 1.25 -3.45 0.00 0.00 179.45 177.43 1f9w h LEU 680 N 0.00 -0.13 -0.45 5.20 5.85 -1.95 -1.17 115.31 122.66 1f9w h LEU 680 Ca -0.00 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1f9w h LEU 680 Cb 0.07 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.05 1f9w h LEU 680 CO 0.00 -0.03 -0.02 0.71 -0.34 0.00 0.00 178.44 178.77 1f9w h THR 681 N -0.29 0.63 -0.78 1.05 1.35 -1.79 0.28 112.91 113.37 1f9w h THR 681 Ca -0.02 -0.03 0.10 0.00 -0.55 0.00 0.00 66.41 65.91 1f9w h THR 681 Cb 0.12 0.54 -0.07 0.00 -1.73 0.00 0.00 68.15 67.00 1f9w h THR 681 CO 0.03 0.02 0.42 0.22 -0.25 0.00 0.00 175.52 175.95 1f9w h TYR 682 N 0.09 0.75 -0.55 4.73 3.20 0.15 0.35 116.97 125.68 1f9w h TYR 682 Ca 0.22 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.19 1f9w h TYR 682 Cb 0.33 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.32 1f9w h TYR 682 CO -0.31 0.27 0.23 1.25 -1.64 0.00 0.00 178.16 177.96 1f9w h LEU 683 N 0.69 0.26 -3.08 2.82 6.46 0.81 -2.71 115.31 120.57 1f9w h LEU 683 Ca 0.39 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 58.20 1f9w h LEU 683 Cb 0.40 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.35 1f9w h LEU 683 CO -0.27 0.17 0.00 0.18 -0.62 0.00 0.00 178.44 177.90 1f9w n LEU 684 N -4.96 4.57 -0.21 2.25 4.77 -0.41 -4.62 117.00 118.38 1f9w n LEU 684 Ca 0.07 -2.38 0.28 0.00 -0.03 0.00 0.00 56.01 53.95 1f9w n LEU 684 Cb 0.21 -0.55 0.70 0.00 -2.33 0.00 0.00 43.42 41.45 1f9w n LEU 684 CO 0.25 0.84 1.26 0.06 -1.33 0.00 0.00 177.39 178.47 1f9w h GLN 685 N 3.99 0.05 0.00 3.23 3.07 0.00 -0.30 115.11 125.16 1f9w h GLN 685 Ca 0.00 -0.00 -0.24 0.00 0.09 0.00 0.00 58.65 58.50 1f9w h GLN 685 Cb 1.36 -0.01 -0.04 0.00 0.08 0.00 0.00 27.48 28.87 1f9w h GLN 685 CO 0.19 0.03 -1.24 1.88 0.09 0.00 0.00 178.83 179.78 1f9w h TYR 686 N 0.05 0.02 -0.76 0.06 0.05 -1.83 -3.06 116.97 111.50 1f9w h TYR 686 Ca 0.45 -0.01 -0.37 0.00 0.05 0.00 0.00 58.73 58.85 1f9w h TYR 686 Cb 1.72 -0.00 -0.22 0.00 1.01 0.00 0.00 36.73 39.24 1f9w h TYR 686 CO -0.00 1.01 0.48 0.43 -1.05 0.00 0.00 178.16 179.03 1f9w n SER 687 N -3.26 3.69 0.00 3.88 7.64 -0.20 -3.43 113.62 121.96 1f9w n SER 687 Ca -0.06 -3.22 0.00 0.00 1.01 0.00 0.00 58.87 56.60 1f9w n SER 687 Cb 0.98 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 1f9w n SER 687 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1f9w n LEU 688 N -0.69 0.05 -4.36 -3.43 4.77 -0.75 -4.33 117.00 108.27 1f9w n LEU 688 Ca 0.45 -0.07 -0.18 0.00 -0.03 0.00 0.00 56.01 56.17 1f9w n LEU 688 Cb 1.39 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 42.38 1f9w n LEU 688 CO 0.46 0.01 -0.24 0.42 -1.33 0.00 0.00 177.39 176.71 1f9w s THR 689 N -0.05 0.62 0.00 -5.08 -4.23 -1.16 -4.87 115.64 100.87 1f9w s THR 689 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1f9w s THR 689 Cb 0.00 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1f9w s THR 689 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1f9w n GLY 690 N -0.56 4.22 3.24 3.99 0.00 -1.26 -3.13 105.19 111.69 1f9w n GLY 690 Ca -0.01 0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1f9w n GLY 690 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f9w n ASP 691 N 8.22 5.54 -4.38 1.61 3.85 -1.26 -3.88 116.55 126.26 1f9w n ASP 691 Ca 0.00 -3.10 -0.20 0.00 -0.71 0.00 0.00 54.79 50.78 1f9w n ASP 691 Cb 0.00 -1.43 -0.10 0.00 -1.35 0.00 0.00 41.12 38.24 1f9w n ASP 691 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 1f9w s SER 692 N 1.10 2.76 -0.15 -1.12 0.01 -1.18 -3.74 113.70 111.38 1f9w s SER 692 Ca 0.36 -1.04 0.01 0.00 1.31 0.00 0.00 55.95 56.59 1f9w s SER 692 Cb -0.02 -0.17 0.02 0.00 0.21 0.00 0.00 66.02 66.06 1f9w s SER 692 CO -0.01 -0.16 -0.17 -0.54 0.41 0.00 0.00 173.24 172.78 1f9w s LYS 693 N -3.63 2.57 -0.02 12.44 3.01 0.15 -2.60 119.74 131.66 1f9w s LYS 693 Ca 0.25 -0.67 0.08 0.00 -1.01 0.00 0.00 55.97 54.61 1f9w s LYS 693 Cb -0.01 -2.23 -0.02 0.00 -1.01 0.00 0.00 37.83 34.56 1f9w s LYS 693 CO 0.09 -0.16 -0.25 0.99 0.51 0.00 0.00 175.35 176.53 1f9w s THR 694 N 1.23 1.98 -0.05 2.17 2.01 -0.97 0.18 115.64 122.19 1f9w s THR 694 Ca 0.01 -1.09 -0.00 0.00 0.31 0.00 0.00 61.69 60.92 1f9w s THR 694 Cb -0.14 -1.65 0.03 0.00 0.01 0.00 0.00 72.50 70.75 1f9w s THR 694 CO -0.08 0.55 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.62 1f9w s LEU 695 N -0.62 0.96 -0.16 4.42 1.43 0.38 -2.22 118.68 122.87 1f9w s LEU 695 Ca 0.10 -0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1f9w s LEU 695 Cb -0.10 -0.40 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 1f9w s LEU 695 CO -0.01 -0.13 -0.02 -0.32 0.23 0.00 0.00 176.35 176.10 1f9w s MET 696 N 1.41 3.69 -0.23 1.70 -2.45 -0.06 0.11 119.30 123.47 1f9w s MET 696 Ca -0.04 -0.51 -0.02 0.00 -1.25 0.00 0.00 55.69 53.88 1f9w s MET 696 Cb -0.13 -2.96 0.01 0.00 1.25 0.00 0.00 34.83 33.00 1f9w s MET 696 CO -0.03 0.21 -0.08 -0.06 1.05 0.00 0.00 175.02 176.11 1f9w s PHE 697 N 0.46 2.98 -0.54 4.11 0.08 0.43 -0.27 117.98 125.24 1f9w s PHE 697 Ca -0.03 -1.38 -0.14 0.00 0.12 0.00 0.00 56.93 55.50 1f9w s PHE 697 Cb -0.14 -2.05 0.13 0.00 -0.57 0.00 0.00 43.02 40.39 1f9w s PHE 697 CO 0.03 -0.69 0.48 0.08 -0.10 0.00 0.00 175.22 175.02 1f9w s VAL 698 N 1.37 5.00 -0.19 -0.44 1.01 0.44 0.63 120.40 128.22 1f9w s VAL 698 Ca 0.03 -1.64 -0.28 0.00 0.00 0.00 0.00 61.98 60.09 1f9w s VAL 698 Cb -0.15 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1f9w s VAL 698 CO -0.06 -0.86 0.97 0.20 0.00 0.00 0.00 175.10 175.36 1f9w s ASN 699 N 3.28 7.09 0.18 3.32 -0.87 0.41 -0.75 114.94 127.58 1f9w s ASN 699 Ca 0.05 1.35 0.05 0.00 -1.57 0.00 0.00 52.86 52.74 1f9w s ASN 699 Cb -0.28 -2.52 -0.05 0.00 -0.02 0.00 0.00 41.25 38.39 1f9w s ASN 699 CO 0.01 -0.54 -0.10 0.27 -2.57 0.00 0.00 177.10 174.17 1f9w s ILE 700 N 2.65 1.33 0.18 0.60 -4.36 -0.28 -4.27 121.20 117.04 1f9w s ILE 700 Ca 0.43 -2.10 0.05 0.00 -0.26 0.00 0.00 60.65 58.77 1f9w s ILE 700 Cb -0.16 -1.98 -0.04 0.00 1.25 0.00 0.00 42.46 41.53 1f9w s ILE 700 CO 0.11 -0.64 0.20 -0.55 0.24 0.00 0.00 174.94 174.29 1f9w s SER 701 N -3.23 5.79 0.16 4.36 0.15 -1.26 -2.83 113.70 116.84 1f9w s SER 701 Ca 0.20 -0.05 0.23 0.00 0.70 0.00 0.00 55.95 57.02 1f9w s SER 701 Cb 0.02 -1.59 -0.01 0.00 -1.71 0.00 0.00 66.02 62.74 1f9w s SER 701 CO 0.04 0.04 1.00 -0.81 1.20 0.00 0.00 173.24 174.71 1f9w n PRO 702 N -0.57 0.56 -1.65 5.44 -0.04 -1.26 -4.91 135.00 132.57 1f9w n PRO 702 Ca -0.08 0.08 -0.45 0.00 -0.04 0.00 0.00 63.50 63.01 1f9w n PRO 702 Cb 0.55 -1.77 -0.04 0.00 -0.04 0.00 0.00 33.50 32.20 1f9w n PRO 702 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1f9w n SER 703 N -2.53 3.68 0.17 3.54 2.88 -1.26 -4.62 113.62 115.48 1f9w n SER 703 Ca -0.00 0.82 0.08 0.00 -1.33 0.00 0.00 58.87 58.45 1f9w n SER 703 Cb 0.53 -1.45 0.44 0.00 -0.75 0.00 0.00 64.21 62.98 1f9w n SER 703 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1f9w h SER 704 N 10.67 0.00 0.00 -3.46 4.64 -1.71 0.21 113.55 123.90 1f9w h SER 704 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1f9w h SER 704 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1f9w h SER 704 CO 0.95 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.37 1f9w n SER 705 N -2.15 0.52 -0.28 4.97 3.41 -1.26 -2.79 113.62 116.04 1f9w n SER 705 Ca -0.01 -1.93 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 1f9w n SER 705 Cb 0.25 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1f9w n SER 705 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1f9w n HIS 706 N -0.22 0.00 0.29 7.33 -0.00 0.06 -4.88 115.22 117.80 1f9w n HIS 706 Ca 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 57.72 57.88 1f9w n HIS 706 Cb 0.13 0.06 0.86 0.00 -0.00 0.00 0.00 29.99 31.05 1f9w n HIS 706 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1f9w h ILE 707 N 4.81 0.39 0.20 1.59 1.08 -1.61 0.16 117.51 124.13 1f9w h ILE 707 Ca 0.00 -0.32 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 1f9w h ILE 707 Cb 1.14 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 36.11 1f9w h ILE 707 CO 0.00 0.06 -0.10 0.78 -0.69 0.00 0.00 178.15 178.20 1f9w h ASN 708 N 0.00 -0.23 0.95 1.72 -0.26 -1.90 -1.63 115.58 114.23 1f9w h ASN 708 Ca -0.00 -0.30 0.00 0.00 -0.56 0.00 0.00 56.30 55.44 1f9w h ASN 708 Cb 0.22 0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 1f9w h ASN 708 CO 0.01 0.27 0.00 1.21 -1.06 0.00 0.00 177.43 177.86 1f9w n GLU 709 N -4.98 0.12 -0.07 0.81 0.00 -1.11 -3.24 120.64 112.17 1f9w n GLU 709 Ca -0.08 0.22 -0.14 0.00 0.00 0.00 0.00 57.16 57.17 1f9w n GLU 709 Cb 0.26 -1.68 -0.13 0.00 0.00 0.00 0.00 31.44 29.89 1f9w n GLU 709 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 1f9w h THR 710 N 0.00 1.75 -1.04 6.31 2.02 -0.62 -3.01 112.91 118.33 1f9w h THR 710 Ca 0.00 -2.32 0.27 0.00 0.77 0.00 0.00 66.41 65.12 1f9w h THR 710 Cb 0.47 3.32 -0.11 0.00 -1.74 0.00 0.00 68.15 70.10 1f9w h THR 710 CO 0.00 0.59 0.65 -0.07 0.37 0.00 0.00 175.52 177.06 1f9w h LEU 711 N -1.00 0.53 -0.14 2.58 3.38 -1.27 0.17 115.31 119.55 1f9w h LEU 711 Ca -0.00 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1f9w h LEU 711 Cb 0.99 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1f9w h LEU 711 CO -0.00 0.08 0.08 0.78 0.09 0.00 0.00 178.44 179.46 1f9w h ASN 712 N 0.45 0.18 0.26 -0.43 2.35 -1.59 0.28 115.58 117.08 1f9w h ASN 712 Ca 0.62 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 56.27 1f9w h ASN 712 Cb 1.44 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.77 1f9w h ASN 712 CO -0.37 0.23 -0.13 0.28 -1.65 0.00 0.00 177.43 175.79 1f9w h SER 713 N 0.13 -0.30 -0.08 5.81 0.02 -0.57 0.38 113.55 118.94 1f9w h SER 713 Ca 0.05 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1f9w h SER 713 Cb 0.09 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 1f9w h SER 713 CO -0.01 -0.14 0.06 -0.07 -1.14 0.00 0.00 176.83 175.53 1f9w h LEU 714 N -0.44 0.00 -0.28 5.07 3.38 -1.16 0.11 115.31 121.99 1f9w h LEU 714 Ca -0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.77 1f9w h LEU 714 Cb 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1f9w h LEU 714 CO 0.06 0.00 -0.76 0.03 0.09 0.00 0.00 178.44 177.86 1f9w h ARG 715 N 0.00 0.00 0.73 1.13 3.08 0.22 -0.13 114.38 119.41 1f9w h ARG 715 Ca 0.04 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1f9w h ARG 715 Cb 0.16 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.22 1f9w h ARG 715 CO -0.00 0.76 -0.35 0.35 -1.07 0.00 0.00 179.97 179.66 1f9w h PHE 716 N 0.00 -0.91 0.76 3.04 3.04 0.23 -2.85 116.94 120.25 1f9w h PHE 716 Ca -0.01 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.89 1f9w h PHE 716 Cb 1.45 0.30 -0.01 0.00 2.56 0.00 0.00 35.95 40.26 1f9w h PHE 716 CO 0.00 -0.57 -0.50 0.00 -2.02 0.00 0.00 178.31 175.22 1f9w h ALA 717 N -1.38 -1.26 -0.81 2.41 0.00 -1.45 0.13 119.26 116.90 1f9w h ALA 717 Ca -0.10 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 54.70 1f9w h ALA 717 Cb 0.75 0.64 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 1f9w h ALA 717 CO 0.16 -1.23 -0.28 -1.13 0.00 0.00 0.00 179.25 176.77 1f9w n SER 718 N -5.62 -0.46 -0.00 0.00 3.41 -0.06 0.68 113.62 111.56 1f9w n SER 718 Ca -0.15 1.40 -0.12 0.00 -0.26 0.00 0.00 58.87 59.74 1f9w n SER 718 Cb 0.50 -0.35 -0.10 0.00 -0.26 0.00 0.00 64.21 64.01 1f9w n SER 718 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1f9w h LYS 719 N 0.00 -0.07 -1.01 4.33 2.10 -1.37 -3.21 116.57 117.34 1f9w h LYS 719 Ca 0.31 0.00 0.23 0.00 -2.00 0.00 0.00 60.65 59.20 1f9w h LYS 719 Cb 0.51 0.02 -0.10 0.00 -0.90 0.00 0.00 32.23 31.75 1f9w h LYS 719 CO -0.81 0.50 0.63 0.28 -2.00 0.00 0.00 179.45 178.05 1f9w h VAL 720 N -0.72 0.60 -2.80 0.07 2.07 0.11 -3.29 116.25 112.28 1f9w h VAL 720 Ca -0.01 -0.19 -0.61 0.00 0.82 0.00 0.00 66.70 66.71 1f9w h VAL 720 Cb 0.60 -0.01 -0.13 0.00 -1.52 0.00 0.00 31.29 30.23 1f9w h VAL 720 CO 0.01 0.10 0.61 0.21 0.02 0.00 0.00 177.57 178.52 1f9w s ASN 721 N -5.33 6.22 0.00 0.57 3.04 0.21 -3.72 114.94 115.94 1f9w s ASN 721 Ca -0.10 -0.72 0.00 0.00 0.04 0.00 0.00 52.86 52.08 1f9w s ASN 721 Cb 0.25 -2.44 0.00 0.00 -1.54 0.00 0.00 41.25 37.52 1f9w s ASN 721 CO 0.80 -1.42 0.01 -0.24 -3.04 0.00 0.00 177.10 173.20