#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbu s THR 392 N 0.00 0.03 0.03 12.58 -1.32 -0.61 -4.72 115.64 121.63 2dbu s THR 392 Ca 0.00 -0.26 0.07 0.00 -1.21 0.00 0.00 61.69 60.29 2dbu s THR 392 Cb 0.00 -0.68 -0.02 0.00 -1.51 0.00 0.00 72.50 70.29 2dbu s THR 392 CO 0.00 -0.14 -0.21 -2.28 -2.21 0.00 0.00 174.62 169.78 2dbu s HIS 393 N -0.88 1.83 0.00 9.09 5.65 -1.26 -1.69 115.29 128.04 2dbu s HIS 393 Ca -0.09 -0.37 -0.06 0.00 0.25 0.00 0.00 55.06 54.79 2dbu s HIS 393 Cb -0.04 -1.11 -0.00 0.00 -1.18 0.00 0.00 32.58 30.25 2dbu s HIS 393 CO 0.04 0.07 0.11 1.52 -0.65 0.00 0.00 174.74 175.82 2dbu s TYR 394 N -0.73 0.07 0.10 3.88 -0.85 -0.17 -4.65 117.35 115.01 2dbu s TYR 394 Ca 0.08 -0.18 0.08 0.00 -0.52 0.00 0.00 57.07 56.52 2dbu s TYR 394 Cb -0.09 -0.07 -0.03 0.00 0.38 0.00 0.00 41.96 42.15 2dbu s TYR 394 CO 0.01 -0.26 -0.20 -1.12 -1.52 0.00 0.00 175.55 172.47 2dbu s SER 395 N -1.32 2.40 -0.06 -0.18 0.01 -1.26 -1.14 113.70 112.15 2dbu s SER 395 Ca -0.14 -0.69 -0.05 0.00 1.31 0.00 0.00 55.95 56.38 2dbu s SER 395 Cb -0.08 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.05 2dbu s SER 395 CO 0.01 0.03 0.16 -0.69 0.41 0.00 0.00 173.24 173.16 2dbu s VAL 396 N -1.26 -0.01 -0.04 3.43 1.01 -0.11 -5.00 120.40 118.43 2dbu s VAL 396 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.06 2dbu s VAL 396 Cb -0.10 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.08 2dbu s VAL 396 CO 0.04 0.01 0.01 -0.69 0.00 0.00 0.00 175.10 174.47 2dbu s VAL 397 N 0.27 0.13 0.49 2.92 1.01 -1.26 -0.68 120.40 123.28 2dbu s VAL 397 Ca -0.02 0.16 0.09 0.00 0.00 0.00 0.00 61.98 62.21 2dbu s VAL 397 Cb -0.03 -0.27 0.04 0.00 0.00 0.00 0.00 36.38 36.13 2dbu s VAL 397 CO -0.01 0.16 0.66 1.51 0.00 0.00 0.00 175.10 177.42 2dbu s ASP 398 N 1.32 5.40 0.63 3.32 1.47 -0.79 -4.99 116.67 123.04 2dbu s ASP 398 Ca -0.06 -0.62 0.38 0.00 1.18 0.00 0.00 52.55 53.44 2dbu s ASP 398 Cb -0.13 -0.24 2.06 0.00 -0.34 0.00 0.00 42.92 44.27 2dbu s ASP 398 CO -0.02 -1.01 2.16 0.07 0.68 0.00 0.00 175.17 177.05 2dbu h LYS 399 N 0.45 0.00 -0.01 2.11 2.10 -1.99 -1.02 116.57 118.22 2dbu h LYS 399 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 2dbu h LYS 399 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 2dbu h LYS 399 CO 0.44 0.00 -0.36 -0.25 -2.00 0.00 0.00 179.45 177.27 2dbu n ASP 400 N -2.93 1.28 0.00 7.07 8.00 -1.26 -4.95 116.55 123.76 2dbu n ASP 400 Ca -0.03 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.44 2dbu n ASP 400 Cb 0.16 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 2dbu n ASP 400 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dbu n GLY 401 N 1.38 0.56 3.77 0.44 0.00 -0.39 -5.07 105.19 105.89 2dbu n GLY 401 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2dbu n GLY 401 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dbu s ASN 402 N -2.91 6.66 0.03 1.61 0.01 -1.26 -4.84 114.94 114.23 2dbu s ASN 402 Ca 0.00 2.23 0.03 0.00 -0.71 0.00 0.00 52.86 54.41 2dbu s ASN 402 Cb 0.00 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 39.04 2dbu s ASN 402 CO 0.00 -0.57 -0.10 0.00 -1.51 0.00 0.00 177.10 174.92 2dbu s ALA 403 N -1.48 0.81 -0.01 0.60 0.00 -1.26 -1.89 121.76 118.54 2dbu s ALA 403 Ca 0.56 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2dbu s ALA 403 Cb -0.28 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.75 2dbu s ALA 403 CO 0.35 0.12 -0.01 0.08 0.00 0.00 0.00 175.76 176.30 2dbu s VAL 404 N -0.82 0.11 -0.11 0.00 1.01 0.14 -5.01 120.40 115.72 2dbu s VAL 404 Ca -0.02 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.95 2dbu s VAL 404 Cb -0.07 -0.13 0.02 0.00 0.00 0.00 0.00 36.38 36.20 2dbu s VAL 404 CO 0.01 0.06 -0.11 0.00 0.00 0.00 0.00 175.10 175.05 2dbu s ALA 405 N 0.23 1.49 -0.09 5.51 0.00 -1.26 -0.93 121.76 126.71 2dbu s ALA 405 Ca -0.02 -0.63 0.03 0.00 0.00 0.00 0.00 51.96 51.34 2dbu s ALA 405 Cb -0.04 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2dbu s ALA 405 CO -0.01 -0.24 -0.16 0.08 0.00 0.00 0.00 175.76 175.43 2dbu s VAL 406 N 1.33 1.49 -0.15 0.00 1.01 -0.29 -4.86 120.40 118.92 2dbu s VAL 406 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2dbu s VAL 406 Cb -0.14 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 34.94 2dbu s VAL 406 CO -0.05 0.43 -0.13 -0.89 0.00 0.00 0.00 175.10 174.46 2dbu s THR 407 N 0.65 1.49 0.20 3.92 2.01 -1.26 -1.00 115.64 121.64 2dbu s THR 407 Ca -0.14 -0.61 -0.01 0.00 0.31 0.00 0.00 61.69 61.25 2dbu s THR 407 Cb -0.16 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 2dbu s THR 407 CO 0.04 0.42 0.12 -0.72 -0.69 0.00 0.00 174.62 173.79 2dbu s TYR 408 N 1.52 1.20 0.06 4.92 -0.00 -0.68 -4.99 117.35 119.38 2dbu s TYR 408 Ca 0.05 -1.33 -0.28 0.00 -0.00 0.00 0.00 57.07 55.50 2dbu s TYR 408 Cb -0.13 -0.61 0.09 0.00 -0.00 0.00 0.00 41.96 41.31 2dbu s TYR 408 CO -0.10 -0.58 1.12 -0.08 -0.00 0.00 0.00 175.55 175.91 2dbu s THR 409 N -4.08 0.00 -1.06 -3.49 -1.32 -1.26 -1.57 115.64 102.86 2dbu s THR 409 Ca 0.37 -0.42 0.10 0.00 -1.21 0.00 0.00 61.69 60.53 2dbu s THR 409 Cb 0.07 -1.95 0.03 0.00 -1.51 0.00 0.00 72.50 69.14 2dbu s THR 409 CO 0.11 0.00 0.70 0.18 -2.21 0.00 0.00 174.62 173.41 2dbu n LEU 410 N -0.47 1.45 0.00 9.08 4.77 -1.26 -4.97 117.00 125.61 2dbu n LEU 410 Ca -0.07 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2dbu n LEU 410 Cb 0.62 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 2dbu n LEU 410 CO 0.13 0.29 0.00 -3.20 -1.33 0.00 0.00 177.39 173.27 2dbu n ASN 411 N 0.05 0.00 -4.37 -1.43 5.15 -1.26 -1.03 115.26 112.37 2dbu n ASN 411 Ca 0.05 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.74 2dbu n ASN 411 Cb 0.23 0.00 0.18 0.00 -0.53 0.00 0.00 39.78 39.66 2dbu n ASN 411 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2dbu s THR 412 N 0.00 1.88 0.00 -0.44 -4.23 -1.26 -3.29 115.64 108.30 2dbu s THR 412 Ca 0.00 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 60.21 2dbu s THR 412 Cb 0.00 -2.65 -0.07 0.00 1.34 0.00 0.00 72.50 71.12 2dbu s THR 412 CO 0.00 0.00 1.78 -0.89 -0.54 0.00 0.00 174.62 174.97 2dbu s THR 413 N -3.22 3.26 0.00 3.99 2.01 -1.26 -0.83 115.64 119.60 2dbu s THR 413 Ca 0.68 0.39 0.00 0.00 0.31 0.00 0.00 61.69 63.07 2dbu s THR 413 Cb -0.12 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.13 2dbu s THR 413 CO 0.55 -0.03 0.00 0.49 -0.69 0.00 0.00 174.62 174.94 2dbu n PHE 414 N 7.04 0.00 -1.35 4.92 3.72 -1.26 -4.82 117.46 125.70 2dbu n PHE 414 Ca 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 2dbu n PHE 414 Cb 0.42 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 38.14 2dbu n PHE 414 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dbu n GLY 415 N -1.39 3.19 0.26 1.37 0.00 -0.01 -0.61 105.19 108.00 2dbu n GLY 415 Ca 0.00 -0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.00 2dbu n GLY 415 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2dbu h THR 416 N 0.00 0.25 0.00 2.61 1.35 -1.37 -3.45 112.91 112.30 2dbu h THR 416 Ca 0.00 -0.72 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 2dbu h THR 416 Cb 0.00 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2dbu h THR 416 CO 0.00 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.97 2dbu n GLY 417 N -0.01 0.70 3.64 5.82 0.00 0.22 -5.02 105.19 110.54 2dbu n GLY 417 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2dbu n GLY 417 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dbu s ILE 418 N -2.43 5.28 0.03 -0.61 1.01 -1.26 -4.96 121.20 118.26 2dbu s ILE 418 Ca 0.00 0.36 -0.17 0.00 0.00 0.00 0.00 60.65 60.83 2dbu s ILE 418 Cb 0.00 -3.59 -0.06 0.00 0.01 0.00 0.00 42.46 38.82 2dbu s ILE 418 CO 0.00 0.27 0.50 -0.69 0.00 0.00 0.00 174.94 175.02 2dbu s VAL 419 N 1.44 4.88 -0.77 2.92 1.01 -1.26 -0.08 120.40 128.54 2dbu s VAL 419 Ca 0.11 1.05 -0.26 0.00 0.00 0.00 0.00 61.98 62.88 2dbu s VAL 419 Cb -0.15 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.45 2dbu s VAL 419 CO 0.08 0.55 1.32 0.00 0.00 0.00 0.00 175.10 177.05 2dbu s ALA 420 N -0.99 2.72 0.00 5.51 0.00 -0.20 -4.91 121.76 123.89 2dbu s ALA 420 Ca 0.27 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2dbu s ALA 420 Cb -0.18 -4.30 0.00 0.00 0.00 0.00 0.00 23.12 18.64 2dbu s ALA 420 CO 0.16 -3.36 0.00 0.41 0.00 0.00 0.00 175.76 172.97 2dbu n GLY 421 N 5.60 2.68 1.56 0.00 0.00 -1.26 -1.60 105.19 112.17 2dbu n GLY 421 Ca 0.08 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 46.01 2dbu n GLY 421 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dbu n GLU 422 N 14.00 3.63 0.16 1.61 -0.58 -1.26 -4.22 120.64 133.98 2dbu n GLU 422 Ca 0.00 -2.28 0.08 0.00 -0.42 0.00 0.00 57.16 54.54 2dbu n GLU 422 Cb 0.00 -2.04 0.07 0.00 -0.57 0.00 0.00 31.44 28.90 2dbu n GLU 422 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2dbu h SER 423 N 2.66 0.00 -0.10 1.62 4.64 -1.69 -3.47 113.55 117.21 2dbu h SER 423 Ca 0.05 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 2dbu h SER 423 Cb 1.67 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.75 2dbu h SER 423 CO 0.41 0.18 -0.04 0.61 -0.87 0.00 0.00 176.83 177.13 2dbu n GLY 424 N 1.18 0.55 3.48 -0.77 0.00 -1.26 -5.01 105.19 103.36 2dbu n GLY 424 Ca 0.01 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 2dbu n GLY 424 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dbu s ILE 425 N -1.97 4.54 0.35 -0.61 1.01 -1.26 -4.95 121.20 118.30 2dbu s ILE 425 Ca 0.00 -0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.28 2dbu s ILE 425 Cb 0.00 -3.13 -0.09 0.00 0.01 0.00 0.00 42.46 39.25 2dbu s ILE 425 CO 0.00 0.33 1.15 -0.76 0.00 0.00 0.00 174.94 175.66 2dbu s LEU 426 N 1.58 4.34 -0.13 2.97 1.43 -1.26 -1.03 118.68 126.58 2dbu s LEU 426 Ca 0.06 2.34 -0.07 0.00 -1.03 0.00 0.00 54.13 55.44 2dbu s LEU 426 Cb -0.15 -3.85 -0.04 0.00 0.03 0.00 0.00 46.19 42.18 2dbu s LEU 426 CO 0.05 -0.46 0.12 -0.76 0.23 0.00 0.00 176.35 175.53 2dbu s LEU 427 N -2.06 4.25 0.88 1.79 1.43 0.89 -4.91 118.68 120.95 2dbu s LEU 427 Ca 0.52 0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 53.89 2dbu s LEU 427 Cb -0.32 -2.04 0.12 0.00 0.03 0.00 0.00 46.19 43.99 2dbu s LEU 427 CO 0.40 0.37 1.10 0.54 0.23 0.00 0.00 176.35 178.99 2dbu s ASN 428 N -0.79 3.50 -0.37 2.29 2.20 -1.26 -1.26 114.94 119.25 2dbu s ASN 428 Ca 0.13 1.73 0.10 0.00 -0.94 0.00 0.00 52.86 53.88 2dbu s ASN 428 Cb -0.12 -2.37 0.44 0.00 -2.00 0.00 0.00 41.25 37.21 2dbu s ASN 428 CO 0.03 -2.66 1.09 -0.46 -2.94 0.00 0.00 177.10 172.16 2dbu n ASN 429 N -3.92 3.81 -3.11 3.54 0.23 -0.20 -4.35 115.26 111.28 2dbu n ASN 429 Ca 0.08 -3.37 -0.14 0.00 -0.53 0.00 0.00 54.58 50.62 2dbu n ASN 429 Cb 0.54 -0.45 -0.01 0.00 -2.08 0.00 0.00 39.78 37.78 2dbu n ASN 429 CO 0.00 0.00 0.00 1.67 -0.93 0.00 0.00 177.26 178.00 2dbu n GLN 430 N -0.45 1.35 0.00 -3.83 -0.06 -1.26 -4.60 117.38 108.53 2dbu n GLN 430 Ca 0.31 -1.11 0.00 0.00 -2.00 0.00 0.00 57.00 54.20 2dbu n GLN 430 Cb 0.77 -2.29 0.00 0.00 -4.06 0.00 0.00 30.24 24.66 2dbu n GLN 430 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2dbu n ASP 432 N 4.47 0.00 0.00 1.69 -0.08 -1.26 -4.26 116.55 117.10 2dbu n ASP 432 Ca 0.29 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.70 2dbu n ASP 432 Cb 0.09 0.00 0.59 0.00 2.34 0.00 0.00 41.12 44.14 2dbu n ASP 432 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2dbu n ASP 433 N 0.00 0.00 -4.88 1.67 8.00 -1.26 -4.69 116.55 115.38 2dbu n ASP 433 Ca 0.00 0.33 -0.30 0.00 0.71 0.00 0.00 54.79 55.54 2dbu n ASP 433 Cb 0.00 -0.44 0.02 0.00 -0.02 0.00 0.00 41.12 40.67 2dbu n ASP 433 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dbu s PHE 434 N -2.88 3.53 -0.50 1.24 0.40 -1.26 -4.26 117.98 114.25 2dbu s PHE 434 Ca 0.16 1.09 -0.24 0.00 -0.60 0.00 0.00 56.93 57.35 2dbu s PHE 434 Cb 0.17 -2.69 0.04 0.00 0.51 0.00 0.00 43.02 41.05 2dbu s PHE 434 CO 0.46 -0.69 0.87 0.45 0.70 0.00 0.00 175.22 177.00 2dbu s SER 435 N -4.20 6.37 0.41 1.36 0.15 0.00 -4.89 113.70 112.91 2dbu s SER 435 Ca 0.54 -0.26 0.12 0.00 0.70 0.00 0.00 55.95 57.05 2dbu s SER 435 Cb -0.11 -2.41 0.88 0.00 -1.71 0.00 0.00 66.02 62.67 2dbu s SER 435 CO 0.51 -1.08 1.94 0.00 1.20 0.00 0.00 173.24 175.81 2dbu h ALA 436 N 9.15 1.59 -2.12 5.45 0.00 -1.87 -3.33 119.26 128.13 2dbu h ALA 436 Ca -0.25 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 2dbu h ALA 436 Cb 1.08 -0.06 -0.22 0.00 0.00 0.00 0.00 17.79 18.60 2dbu h ALA 436 CO 1.03 0.30 0.00 0.21 0.00 0.00 0.00 179.25 180.80 2dbu s LYS 437 N -4.64 0.70 -0.18 0.00 2.20 -1.26 -4.94 119.74 111.63 2dbu s LYS 437 Ca -0.04 1.06 -0.38 0.00 -0.36 0.00 0.00 55.97 56.25 2dbu s LYS 437 Cb 0.15 0.22 -0.14 0.00 -1.51 0.00 0.00 37.83 36.55 2dbu s LYS 437 CO 0.71 -0.13 1.76 -2.30 -0.36 0.00 0.00 175.35 175.04 2dbu n PRO 438 N 3.68 1.53 -0.42 4.03 -0.02 -1.26 -1.55 135.00 140.99 2dbu n PRO 438 Ca -0.18 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2dbu n PRO 438 Cb 0.57 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2dbu n PRO 438 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dbu n GLY 439 N 4.14 0.71 3.36 -1.23 0.00 -1.10 -5.03 105.19 106.05 2dbu n GLY 439 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 2dbu n GLY 439 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dbu s VAL 440 N -2.81 3.68 0.61 1.61 1.01 -0.60 -4.98 120.40 118.93 2dbu s VAL 440 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 61.98 61.43 2dbu s VAL 440 Cb 0.00 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 2dbu s VAL 440 CO 0.00 0.40 1.10 -2.16 0.00 0.00 0.00 175.10 174.45 2dbu s PRO 441 N 1.43 3.06 0.00 2.72 0.04 -1.26 -4.63 135.00 136.36 2dbu s PRO 441 Ca 0.05 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2dbu s PRO 441 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2dbu s PRO 441 CO -0.01 -1.05 0.00 0.27 0.04 0.00 0.00 177.00 176.26 2dbu n ASN 442 N -2.02 0.00 0.11 6.66 6.94 -0.31 -4.83 115.26 121.81 2dbu n ASN 442 Ca 0.10 -0.89 0.20 0.00 -0.02 0.00 0.00 54.58 53.97 2dbu n ASN 442 Cb 0.52 0.00 0.76 0.00 -2.36 0.00 0.00 39.78 38.70 2dbu n ASN 442 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2dbu h VAL 443 N -0.26 0.40 -0.35 3.53 3.04 -1.90 0.13 116.25 120.84 2dbu h VAL 443 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2dbu h VAL 443 Cb 0.00 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 29.97 2dbu h VAL 443 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.34 2dbu n TYR 444 N -3.75 0.45 -1.01 3.17 4.01 -1.26 -4.94 117.16 113.83 2dbu n TYR 444 Ca 0.06 -0.22 -0.01 0.00 -0.16 0.00 0.00 57.90 57.57 2dbu n TYR 444 Cb 0.56 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.58 2dbu n TYR 444 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dbu n GLY 445 N 1.44 0.48 3.83 2.72 0.00 0.45 -4.78 105.19 109.33 2dbu n GLY 445 Ca 0.19 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2dbu n GLY 445 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dbu s LEU 446 N -0.12 4.43 0.40 0.99 1.43 -1.26 -4.51 118.68 120.04 2dbu s LEU 446 Ca 0.00 1.14 0.08 0.00 -1.03 0.00 0.00 54.13 54.32 2dbu s LEU 446 Cb 0.00 -3.03 -0.08 0.00 0.03 0.00 0.00 46.19 43.11 2dbu s LEU 446 CO 0.00 0.20 -0.01 0.68 0.23 0.00 0.00 176.35 177.45 2dbu s VAL 447 N -1.27 2.06 0.05 -1.59 -7.23 -1.26 -1.16 120.40 109.99 2dbu s VAL 447 Ca 0.32 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.42 2dbu s VAL 447 Cb -0.17 -2.93 0.01 0.00 0.56 0.00 0.00 36.38 33.86 2dbu s VAL 447 CO 0.18 -0.04 0.16 0.61 -0.31 0.00 0.00 175.10 175.71 2dbu n GLY 448 N -0.94 1.47 0.00 2.32 0.00 -1.26 -5.02 105.19 101.76 2dbu n GLY 448 Ca -0.05 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2dbu n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbu n GLY 449 N -0.11 4.40 0.17 -0.02 0.00 -1.26 -2.70 105.19 105.67 2dbu n GLY 449 Ca -0.01 -0.58 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 2dbu n GLY 449 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dbu h ASP 450 N 0.00 0.51 -0.37 1.61 3.45 -1.98 -2.89 116.42 116.74 2dbu h ASP 450 Ca 0.00 -0.36 0.04 0.00 0.43 0.00 0.00 57.03 57.14 2dbu h ASP 450 Cb 0.00 -0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 38.58 2dbu h ASP 450 CO 0.00 1.13 0.13 0.00 -1.57 0.00 0.00 179.24 178.93 2dbu h ALA 451 N 0.85 0.44 -0.60 3.45 0.00 -2.02 -2.94 119.26 118.44 2dbu h ALA 451 Ca -0.05 0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.66 2dbu h ALA 451 Cb 1.41 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 19.08 2dbu h ALA 451 CO 0.14 -0.26 0.20 -1.71 0.00 0.00 0.00 179.25 177.62 2dbu n ASN 452 N -5.02 3.58 -4.81 0.00 4.05 -1.24 -5.00 115.26 106.81 2dbu n ASN 452 Ca 0.02 -3.49 -0.33 0.00 0.45 0.00 0.00 54.58 51.22 2dbu n ASN 452 Cb 0.14 -0.70 -0.03 0.00 1.23 0.00 0.00 39.78 40.41 2dbu n ASN 452 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2dbu s ALA 453 N -3.14 2.89 0.37 5.20 0.00 -1.09 -0.82 121.76 125.18 2dbu s ALA 453 Ca 0.50 0.47 -0.28 0.00 0.00 0.00 0.00 51.96 52.65 2dbu s ALA 453 Cb 0.42 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 20.23 2dbu s ALA 453 CO 0.07 -0.35 1.44 0.08 0.00 0.00 0.00 175.76 177.00 2dbu s VAL 454 N -2.21 2.22 0.01 0.00 1.01 -1.25 -4.84 120.40 115.34 2dbu s VAL 454 Ca 0.64 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 62.56 2dbu s VAL 454 Cb -0.14 -3.14 0.07 0.00 0.00 0.00 0.00 36.38 33.17 2dbu s VAL 454 CO 0.24 0.05 0.65 -0.83 0.00 0.00 0.00 175.10 175.22 2dbu s GLY 455 N -0.27 -0.59 0.34 4.51 0.00 -1.26 -5.11 107.32 104.95 2dbu s GLY 455 Ca 0.53 1.08 -0.29 0.00 0.00 0.00 0.00 44.72 46.04 2dbu s GLY 455 CO 0.60 0.73 1.44 2.56 0.00 0.00 0.00 173.10 178.42 2dbu s PRO 456 N -1.91 4.21 0.00 2.90 0.04 -1.26 -2.65 135.00 136.33 2dbu s PRO 456 Ca -0.08 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2dbu s PRO 456 Cb -0.00 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.51 2dbu s PRO 456 CO 0.03 -0.42 0.00 0.09 0.04 0.00 0.00 177.00 176.75 2dbu n ASN 457 N 1.00 -2.69 -4.82 6.66 3.02 -1.26 -4.98 115.26 112.19 2dbu n ASN 457 Ca 0.02 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.23 2dbu n ASN 457 Cb 0.40 -2.24 -0.06 0.00 -0.61 0.00 0.00 39.78 37.27 2dbu n ASN 457 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2dbu s LYS 458 N -1.09 4.21 -0.25 3.52 2.20 -1.08 -5.05 119.74 122.20 2dbu s LYS 458 Ca 0.00 0.89 -0.15 0.00 -0.36 0.00 0.00 55.97 56.35 2dbu s LYS 458 Cb 0.00 -2.63 -0.04 0.00 -1.51 0.00 0.00 37.83 33.65 2dbu s LYS 458 CO 0.00 0.25 0.37 1.03 -0.36 0.00 0.00 175.35 176.64 2dbu s ARG 459 N -2.47 4.06 0.40 4.03 0.52 -1.26 -4.91 118.95 119.32 2dbu s ARG 459 Ca 0.50 0.08 -0.26 0.00 -0.52 0.00 0.00 55.73 55.52 2dbu s ARG 459 Cb -0.14 -3.62 -0.09 0.00 0.52 0.00 0.00 34.95 31.62 2dbu s ARG 459 CO 0.19 -0.20 1.35 -1.25 0.02 0.00 0.00 175.30 175.41 2dbu s PRO 460 N 1.83 3.97 0.37 3.54 0.04 -1.26 -4.94 135.00 138.56 2dbu s PRO 460 Ca 0.16 2.27 -0.28 0.00 0.04 0.00 0.00 61.00 63.19 2dbu s PRO 460 Cb -0.15 -2.80 -0.11 0.00 0.04 0.00 0.00 34.50 31.48 2dbu s PRO 460 CO 0.09 -0.53 1.48 -1.17 0.04 0.00 0.00 177.00 176.91 2dbu s LEU 461 N -2.37 4.32 0.25 -3.56 2.96 -1.26 -4.98 118.68 114.05 2dbu s LEU 461 Ca 0.56 3.03 0.08 0.00 -0.22 0.00 0.00 54.13 57.59 2dbu s LEU 461 Cb -0.40 -3.67 -0.05 0.00 0.50 0.00 0.00 46.19 42.57 2dbu s LEU 461 CO 0.53 -0.86 -0.11 -0.55 -1.32 0.00 0.00 176.35 174.03 2dbu s SER 462 N -0.16 2.86 -0.35 3.68 0.15 -1.26 -4.81 113.70 113.81 2dbu s SER 462 Ca 0.53 -1.10 -0.08 0.00 0.70 0.00 0.00 55.95 55.99 2dbu s SER 462 Cb -0.46 -0.18 0.04 0.00 -1.71 0.00 0.00 66.02 63.70 2dbu s SER 462 CO 0.63 -0.22 0.14 -0.44 1.20 0.00 0.00 173.24 174.54 2dbu s SER 463 N -3.41 5.44 0.00 5.45 0.01 -1.26 -5.14 113.70 114.79 2dbu s SER 463 Ca 0.27 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.44 2dbu s SER 463 Cb 0.01 -1.92 0.00 0.00 0.21 0.00 0.00 66.02 64.32 2dbu s SER 463 CO 0.11 -0.34 0.00 -1.20 0.41 0.00 0.00 173.24 172.21 2dbu n SER 465 N 4.87 0.00 -4.76 2.44 7.64 -1.26 -4.34 113.62 118.21 2dbu n SER 465 Ca -0.12 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.34 2dbu n SER 465 Cb 0.45 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.64 2dbu n SER 465 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2dbu s PRO 466 N 0.00 4.13 0.00 1.43 0.04 -1.26 -4.55 135.00 134.80 2dbu s PRO 466 Ca 0.00 2.55 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2dbu s PRO 466 Cb 0.00 -3.01 -0.00 0.00 0.04 0.00 0.00 34.50 31.53 2dbu s PRO 466 CO 0.00 -0.57 -0.01 0.99 0.04 0.00 0.00 177.00 177.45 2dbu s THR 467 N -0.44 0.06 -0.09 1.26 2.01 0.05 -5.00 115.64 113.49 2dbu s THR 467 Ca 0.59 -0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.54 2dbu s THR 467 Cb -0.47 -0.06 0.02 0.00 0.01 0.00 0.00 72.50 72.00 2dbu s THR 467 CO 0.53 0.00 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.72 2dbu s ILE 468 N -0.06 1.18 -0.14 1.82 1.01 -1.26 -0.75 121.20 123.00 2dbu s ILE 468 Ca -0.00 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 2dbu s ILE 468 Cb -0.01 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2dbu s ILE 468 CO -0.00 0.38 0.02 -0.69 0.00 0.00 0.00 174.94 174.65 2dbu s VAL 469 N 1.12 4.46 -0.12 2.92 1.01 0.15 -4.97 120.40 124.98 2dbu s VAL 469 Ca -0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 2dbu s VAL 469 Cb -0.14 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2dbu s VAL 469 CO -0.02 0.52 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 2dbu s VAL 470 N -0.06 3.62 -0.10 2.92 1.01 -1.26 -0.16 120.40 126.37 2dbu s VAL 470 Ca 0.05 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2dbu s VAL 470 Cb -0.12 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.74 2dbu s VAL 470 CO 0.02 0.54 -0.17 -0.75 0.00 0.00 0.00 175.10 174.74 2dbu s LYS 471 N -0.08 2.31 -1.49 2.72 2.20 0.45 -4.74 119.74 121.11 2dbu s LYS 471 Ca 0.00 -0.61 -0.08 0.00 -0.36 0.00 0.00 55.97 54.92 2dbu s LYS 471 Cb -0.13 -1.88 0.06 0.00 -1.51 0.00 0.00 37.83 34.36 2dbu s LYS 471 CO 0.03 0.02 0.73 -0.25 -0.36 0.00 0.00 175.35 175.52 2dbu n ASP 472 N 3.94 -2.53 0.00 1.43 8.00 -1.26 -0.69 116.55 125.44 2dbu n ASP 472 Ca -0.20 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.40 2dbu n ASP 472 Cb 0.52 -3.46 0.00 0.00 -0.02 0.00 0.00 41.12 38.15 2dbu n ASP 472 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dbu n GLY 473 N -1.69 0.54 3.32 0.44 0.00 -1.26 -4.99 105.19 101.54 2dbu n GLY 473 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2dbu n GLY 473 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dbu s LYS 474 N -0.48 1.69 0.14 1.61 1.02 0.14 -5.08 119.74 118.77 2dbu s LYS 474 Ca 0.00 -1.06 -0.35 0.00 0.02 0.00 0.00 55.97 54.58 2dbu s LYS 474 Cb 0.00 -1.85 -0.14 0.00 -0.52 0.00 0.00 37.83 35.32 2dbu s LYS 474 CO 0.00 0.48 1.53 2.41 -0.92 0.00 0.00 175.35 178.85 2dbu n THR 475 N 1.80 0.01 0.00 2.17 -1.04 -1.26 -0.41 114.28 115.55 2dbu n THR 475 Ca -0.17 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 2dbu n THR 475 Cb 0.52 -1.38 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 2dbu n THR 475 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 2dbu n TRP 476 N 3.28 0.00 -3.76 -1.42 -0.00 0.78 -4.58 117.44 111.73 2dbu n TRP 476 Ca 0.17 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.51 2dbu n TRP 476 Cb 0.27 0.00 -0.16 0.00 -0.00 0.00 0.00 31.31 31.41 2dbu n TRP 476 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 2dbu s LEU 477 N -4.89 0.93 -0.17 5.87 2.96 -0.64 -0.13 118.68 122.61 2dbu s LEU 477 Ca 0.00 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 2dbu s LEU 477 Cb 0.00 -0.09 0.01 0.00 0.50 0.00 0.00 46.19 46.61 2dbu s LEU 477 CO 0.00 -0.15 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.02 2dbu s VAL 478 N 1.25 2.35 0.28 1.68 1.01 -0.13 0.33 120.40 127.18 2dbu s VAL 478 Ca -0.07 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 2dbu s VAL 478 Cb -0.13 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2dbu s VAL 478 CO -0.03 0.52 0.47 1.07 0.00 0.00 0.00 175.10 177.13 2dbu n THR 479 N 4.41 0.00 0.00 3.92 5.66 0.07 -1.42 114.28 126.92 2dbu n THR 479 Ca -0.20 -1.11 0.00 0.00 -3.05 0.00 0.00 64.05 59.69 2dbu n THR 479 Cb 0.51 0.81 0.00 0.00 -1.55 0.00 0.00 70.33 70.09 2dbu n THR 479 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dbu n GLY 480 N -0.43 -0.04 3.62 1.09 0.00 -1.26 -0.77 105.19 107.40 2dbu n GLY 480 Ca -0.03 -1.23 -0.03 0.00 0.00 0.00 0.00 46.02 44.73 2dbu n GLY 480 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dbu s SER 481 N 0.00 -0.08 0.71 1.61 0.15 -1.26 -3.71 113.70 111.12 2dbu s SER 481 Ca 0.00 0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.63 2dbu s SER 481 Cb 0.00 0.08 0.12 0.00 -1.71 0.00 0.00 66.02 64.51 2dbu s SER 481 CO 0.00 -0.13 0.80 -0.81 1.20 0.00 0.00 173.24 174.30 2dbu n PRO 482 N -0.01 -0.11 0.00 5.44 -0.04 -1.26 -4.63 135.00 134.39 2dbu n PRO 482 Ca 0.03 -1.97 0.00 0.00 -0.04 0.00 0.00 63.50 61.51 2dbu n PRO 482 Cb 0.57 -0.59 0.00 0.00 -0.04 0.00 0.00 33.50 33.44 2dbu n PRO 482 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dbu n GLY 483 N -0.92 0.67 7.00 0.55 0.00 -1.26 -4.31 105.19 106.91 2dbu n GLY 483 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2dbu n GLY 483 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbu n GLY 484 N 0.00 3.20 0.37 -0.02 0.00 -1.26 -0.91 105.19 106.57 2dbu n GLY 484 Ca 0.00 -0.06 0.19 0.00 0.00 0.00 0.00 46.02 46.15 2dbu n GLY 484 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dbu h SER 485 N 0.19 0.00 0.54 1.61 4.64 -1.95 -0.94 113.55 117.64 2dbu h SER 485 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dbu h SER 485 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2dbu h SER 485 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 2dbu n ARG 486 N -4.16 0.31 -0.05 4.77 3.00 -0.08 -3.77 116.66 116.68 2dbu n ARG 486 Ca 0.07 0.05 -0.08 0.00 -0.01 0.00 0.00 57.85 57.88 2dbu n ARG 486 Cb 0.53 -1.50 -0.02 0.00 0.00 0.00 0.00 32.46 31.47 2dbu n ARG 486 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2dbu h ILE 487 N 0.00 0.88 -0.39 0.55 2.04 -1.23 -1.30 117.51 118.05 2dbu h ILE 487 Ca 0.00 -0.03 0.08 0.00 1.00 0.00 0.00 64.86 65.91 2dbu h ILE 487 Cb 0.27 0.77 -0.09 0.00 -0.74 0.00 0.00 36.82 37.03 2dbu h ILE 487 CO 0.00 0.02 -0.23 0.40 0.00 0.00 0.00 178.15 178.33 2dbu h ILE 488 N 0.10 0.36 -0.08 -0.67 2.04 -1.76 -0.66 117.51 116.85 2dbu h ILE 488 Ca 0.10 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.82 2dbu h ILE 488 Cb 0.11 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 2dbu h ILE 488 CO -0.15 0.00 -0.57 0.71 0.00 0.00 0.00 178.15 178.14 2dbu h THR 489 N -0.17 1.37 -0.22 -0.27 1.35 -1.75 -1.58 112.91 111.65 2dbu h THR 489 Ca 0.19 -1.90 -0.03 0.00 -0.55 0.00 0.00 66.41 64.12 2dbu h THR 489 Cb 0.46 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 2dbu h THR 489 CO -0.49 0.56 0.02 0.74 -0.25 0.00 0.00 175.52 176.10 2dbu h THR 490 N 0.18 1.24 -0.57 6.82 2.02 -0.66 -1.17 112.91 120.77 2dbu h THR 490 Ca -0.00 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 2dbu h THR 490 Cb 1.05 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 68.78 2dbu h THR 490 CO 0.09 0.25 0.14 0.58 0.37 0.00 0.00 175.52 176.96 2dbu h VAL 491 N 0.17 1.25 -0.71 3.16 2.07 -1.11 -2.68 116.25 118.39 2dbu h VAL 491 Ca 0.07 -0.88 0.09 0.00 0.82 0.00 0.00 66.70 66.80 2dbu h VAL 491 Cb 0.36 0.73 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2dbu h VAL 491 CO 0.01 0.33 0.35 0.25 0.02 0.00 0.00 177.57 178.52 2dbu h LEU 492 N 0.82 0.44 -2.73 2.57 5.85 -1.10 -1.90 115.31 119.25 2dbu h LEU 492 Ca 0.18 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2dbu h LEU 492 Cb 0.34 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.36 2dbu h LEU 492 CO 0.00 0.25 0.00 0.00 -0.34 0.00 0.00 178.44 178.35 2dbu n GLN 493 N -4.87 0.31 0.00 1.25 6.02 -0.46 -0.98 117.38 118.64 2dbu n GLN 493 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2dbu n GLN 493 Cb 0.28 -1.35 0.00 0.00 1.02 0.00 0.00 30.24 30.19 2dbu n GLN 493 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2dbu n VAL 495 N 1.28 0.00 -0.06 5.09 0.31 -0.72 -0.39 118.33 123.84 2dbu n VAL 495 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 2dbu n VAL 495 Cb 0.15 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.04 2dbu n VAL 495 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2dbu h VAL 496 N 0.00 1.18 -0.88 2.52 2.07 -1.33 0.58 116.25 120.39 2dbu h VAL 496 Ca 0.00 -0.55 0.12 0.00 0.82 0.00 0.00 66.70 67.09 2dbu h VAL 496 Cb 0.00 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 2dbu h VAL 496 CO 0.00 0.18 0.50 0.78 0.02 0.00 0.00 177.57 179.05 2dbu h ASN 497 N 0.15 0.69 -0.03 0.57 -0.26 -0.96 0.23 115.58 115.98 2dbu h ASN 497 Ca 0.06 0.06 -0.14 0.00 -0.56 0.00 0.00 56.30 55.73 2dbu h ASN 497 Cb 0.21 -0.07 0.01 0.00 -1.06 0.00 0.00 38.32 37.41 2dbu h ASN 497 CO -0.00 0.36 -0.51 0.28 -1.06 0.00 0.00 177.43 176.49 2dbu h SER 498 N 0.79 0.51 0.00 5.81 0.02 -1.72 -1.77 113.55 117.19 2dbu h SER 498 Ca 0.45 -0.72 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 2dbu h SER 498 Cb 0.50 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.88 2dbu h SER 498 CO -0.29 1.16 -0.22 0.40 -1.14 0.00 0.00 176.83 176.73 2dbu h ILE 499 N -0.09 0.64 -0.02 3.27 2.04 -0.62 -3.23 117.51 119.50 2dbu h ILE 499 Ca -0.05 -1.54 -0.08 0.00 1.00 0.00 0.00 64.86 64.18 2dbu h ILE 499 Cb 1.20 1.27 0.01 0.00 -0.74 0.00 0.00 36.82 38.56 2dbu h ILE 499 CO 0.10 0.22 -0.31 0.44 0.00 0.00 0.00 178.15 178.60 2dbu h ASP 500 N -1.00 0.31 0.10 1.72 3.32 -0.74 -3.33 116.42 116.81 2dbu h ASP 500 Ca -0.04 -0.73 0.00 0.00 0.02 0.00 0.00 57.03 56.28 2dbu h ASP 500 Cb 0.53 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2dbu h ASP 500 CO -0.02 1.00 -0.16 -1.22 -1.72 0.00 0.00 179.24 177.11 2dbu n TYR 501 N -4.45 0.00 -3.87 4.55 4.01 -1.07 -4.97 117.16 111.36 2dbu n TYR 501 Ca -0.09 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.35 2dbu n TYR 501 Cb 0.52 -0.06 0.03 0.00 -0.31 0.00 0.00 39.34 39.53 2dbu n TYR 501 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dbu n GLY 502 N 1.29 -0.50 3.84 2.72 0.00 -0.99 -4.97 105.19 106.56 2dbu n GLY 502 Ca 0.15 0.20 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 2dbu n GLY 502 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dbu s LEU 503 N -7.29 4.27 0.92 0.99 1.43 -0.70 -5.00 118.68 113.29 2dbu s LEU 503 Ca 0.65 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.88 2dbu s LEU 503 Cb -0.32 -3.61 0.14 0.00 0.03 0.00 0.00 46.19 42.43 2dbu s LEU 503 CO 0.82 -0.01 1.09 0.54 0.23 0.00 0.00 176.35 179.02 2dbu s ASN 504 N -1.87 3.33 0.42 2.29 6.03 -1.26 -4.49 114.94 119.40 2dbu s ASN 504 Ca 0.44 1.38 0.13 0.00 -1.03 0.00 0.00 52.86 53.79 2dbu s ASN 504 Cb -0.14 -2.06 1.00 0.00 -3.03 0.00 0.00 41.25 37.02 2dbu s ASN 504 CO 0.20 -2.71 1.96 1.62 -2.03 0.00 0.00 177.10 176.14 2dbu h VAL 505 N -1.60 0.88 -0.07 3.54 3.04 -1.95 -0.71 116.25 119.38 2dbu h VAL 505 Ca -0.51 -0.15 -0.06 0.00 -1.01 0.00 0.00 66.70 64.96 2dbu h VAL 505 Cb 1.30 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.97 2dbu h VAL 505 CO 0.56 0.08 -0.21 0.00 -1.01 0.00 0.00 177.57 176.99 2dbu h ALA 506 N 1.67 0.12 -0.72 3.17 0.00 -1.91 -2.14 119.26 119.46 2dbu h ALA 506 Ca 0.31 -0.39 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2dbu h ALA 506 Cb 0.59 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2dbu h ALA 506 CO -0.09 0.08 0.44 0.93 0.00 0.00 0.00 179.25 180.62 2dbu h GLU 507 N -0.23 0.83 -0.53 0.00 5.08 -1.78 -0.85 114.58 117.10 2dbu h GLU 507 Ca -0.01 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2dbu h GLU 507 Cb 0.83 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 2dbu h GLU 507 CO 0.04 0.55 0.17 0.00 -1.00 0.00 0.00 179.01 178.77 2dbu h ALA 508 N 1.32 1.30 -0.25 3.43 0.00 -1.15 -2.39 119.26 121.52 2dbu h ALA 508 Ca 0.30 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 2dbu h ALA 508 Cb 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2dbu h ALA 508 CO -0.13 0.51 -0.36 1.15 0.00 0.00 0.00 179.25 180.42 2dbu h THR 509 N 0.77 1.31 -0.00 0.00 2.02 -0.67 -3.25 112.91 113.09 2dbu h THR 509 Ca 0.18 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 65.80 2dbu h THR 509 Cb 0.23 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2dbu h THR 509 CO -0.01 0.49 -0.06 0.59 0.37 0.00 0.00 175.52 176.91 2dbu n ASN 510 N -4.23 0.13 -4.78 4.18 3.02 -0.39 -4.78 115.26 108.40 2dbu n ASN 510 Ca -0.05 -0.05 -0.34 0.00 -0.03 0.00 0.00 54.58 54.11 2dbu n ASN 510 Cb 0.52 -0.27 -0.01 0.00 -0.61 0.00 0.00 39.78 39.41 2dbu n ASN 510 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dbu s ALA 511 N -2.71 2.75 0.71 5.41 0.00 -0.91 -5.01 121.76 122.00 2dbu s ALA 511 Ca 0.23 0.69 -0.14 0.00 0.00 0.00 0.00 51.96 52.74 2dbu s ALA 511 Cb 0.20 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 20.03 2dbu s ALA 511 CO 0.50 -0.64 1.13 -1.25 0.00 0.00 0.00 175.76 175.50 2dbu s PRO 512 N -3.39 2.48 0.10 0.00 0.04 -1.26 -5.05 135.00 127.92 2dbu s PRO 512 Ca 0.70 1.44 0.09 0.00 0.04 0.00 0.00 61.00 63.27 2dbu s PRO 512 Cb -0.20 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 2dbu s PRO 512 CO 0.26 -1.51 -0.23 1.03 0.04 0.00 0.00 177.00 176.59 2dbu s ARG 513 N -4.21 1.27 0.17 4.56 0.52 -1.26 -5.03 118.95 114.96 2dbu s ARG 513 Ca 0.68 -1.20 0.06 0.00 -0.52 0.00 0.00 55.73 54.75 2dbu s ARG 513 Cb -0.22 -1.59 -0.04 0.00 0.52 0.00 0.00 34.95 33.62 2dbu s ARG 513 CO 0.45 0.38 -0.12 -0.59 0.02 0.00 0.00 175.30 175.44 2dbu s PHE 514 N -1.08 1.44 -0.02 -0.53 -0.71 -1.26 -1.95 117.98 113.87 2dbu s PHE 514 Ca 0.09 -0.67 -0.19 0.00 -1.04 0.00 0.00 56.93 55.12 2dbu s PHE 514 Cb -0.10 -0.71 0.04 0.00 -1.21 0.00 0.00 43.02 41.04 2dbu s PHE 514 CO 0.04 0.19 0.40 -1.58 -1.34 0.00 0.00 175.22 172.94 2dbu s HIS 515 N -3.09 -0.30 -0.20 3.49 2.46 0.15 -4.86 115.29 112.94 2dbu s HIS 515 Ca 0.18 0.47 -0.05 0.00 0.47 0.00 0.00 55.06 56.13 2dbu s HIS 515 Cb 0.01 0.18 0.10 0.00 -0.13 0.00 0.00 32.58 32.73 2dbu s HIS 515 CO 0.03 -0.46 0.35 -1.58 -2.47 0.00 0.00 174.74 170.62 2dbu s HIS 516 N -1.38 -0.68 -0.34 3.88 5.04 -1.26 0.14 115.29 120.70 2dbu s HIS 516 Ca -0.12 1.08 0.07 0.00 -1.54 0.00 0.00 55.06 54.55 2dbu s HIS 516 Cb -0.04 0.09 0.54 0.00 0.04 0.00 0.00 32.58 33.21 2dbu s HIS 516 CO 0.05 -0.53 1.58 0.00 -2.34 0.00 0.00 174.74 173.50 2dbu n GLN 517 N 5.37 1.97 0.00 2.88 10.64 -1.26 -4.98 117.38 131.99 2dbu n GLN 517 Ca -0.06 -3.18 0.00 0.00 -1.83 0.00 0.00 57.00 51.93 2dbu n GLN 517 Cb 0.50 -1.92 0.00 0.00 -0.86 0.00 0.00 30.24 27.96 2dbu n GLN 517 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.06 177.10 2dbu n TRP 518 N -1.12 0.00 -3.99 2.61 -0.00 -1.26 -4.62 117.44 109.05 2dbu n TRP 518 Ca 0.40 0.00 -0.25 0.00 -0.00 0.00 0.00 57.50 57.65 2dbu n TRP 518 Cb 1.18 0.00 -0.17 0.00 -0.00 0.00 0.00 31.31 32.32 2dbu n TRP 518 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2dbu s LEU 519 N 0.00 1.16 0.93 5.87 1.02 -1.26 -2.84 118.68 123.56 2dbu s LEU 519 Ca 0.00 -0.26 -0.10 0.00 0.02 0.00 0.00 54.13 53.79 2dbu s LEU 519 Cb 0.00 -0.75 0.15 0.00 0.02 0.00 0.00 46.19 45.61 2dbu s LEU 519 CO 0.00 -0.11 1.13 -2.16 0.02 0.00 0.00 176.35 175.23 2dbu s PRO 520 N 1.56 0.91 -1.12 1.29 0.04 -1.26 -4.69 135.00 131.72 2dbu s PRO 520 Ca 0.01 1.41 -0.14 0.00 0.04 0.00 0.00 61.00 62.32 2dbu s PRO 520 Cb -0.13 -1.72 0.18 0.00 0.04 0.00 0.00 34.50 32.86 2dbu s PRO 520 CO -0.06 -2.66 1.30 0.34 0.04 0.00 0.00 177.00 175.97 2dbu s ASP 521 N -2.74 7.00 -0.05 6.66 3.68 -1.13 -4.49 116.67 125.60 2dbu s ASP 521 Ca 0.66 -2.87 -0.15 0.00 2.13 0.00 0.00 52.55 52.33 2dbu s ASP 521 Cb -0.22 -2.37 0.03 0.00 -1.45 0.00 0.00 42.92 38.91 2dbu s ASP 521 CO 0.59 -0.74 0.34 -1.83 0.13 0.00 0.00 175.17 173.65 2dbu s GLU 522 N 1.38 0.61 -0.86 4.34 -1.05 -1.26 -4.78 118.70 117.09 2dbu s GLU 522 Ca 0.38 0.03 -0.14 0.00 -0.15 0.00 0.00 54.97 55.09 2dbu s GLU 522 Cb -0.04 0.28 0.21 0.00 -0.44 0.00 0.00 34.13 34.14 2dbu s GLU 522 CO -0.03 -0.15 0.83 -1.17 0.95 0.00 0.00 175.26 175.68 2dbu s LEU 523 N -0.89 6.55 0.39 1.83 0.20 -1.08 -4.45 118.68 121.24 2dbu s LEU 523 Ca -0.10 -2.67 -0.26 0.00 0.69 0.00 0.00 54.13 51.79 2dbu s LEU 523 Cb -0.04 -2.23 -0.09 0.00 -0.43 0.00 0.00 46.19 43.40 2dbu s LEU 523 CO 0.03 -0.61 1.26 -0.60 -0.29 0.00 0.00 176.35 176.14 2dbu s ARG 524 N 0.37 4.04 0.06 1.98 3.52 0.12 -2.50 118.95 126.55 2dbu s ARG 524 Ca 0.20 2.05 -0.07 0.00 -0.13 0.00 0.00 55.73 57.79 2dbu s ARG 524 Cb -0.09 -2.77 -0.01 0.00 -1.56 0.00 0.00 34.95 30.52 2dbu s ARG 524 CO -0.09 -0.40 0.13 0.14 -0.81 0.00 0.00 175.30 174.27 2dbu s VAL 525 N -1.29 0.15 0.50 7.11 -7.23 -0.85 0.31 120.40 119.10 2dbu s VAL 525 Ca 0.56 -1.25 0.09 0.00 -1.81 0.00 0.00 61.98 59.57 2dbu s VAL 525 Cb -0.36 -1.22 0.04 0.00 0.56 0.00 0.00 36.38 35.40 2dbu s VAL 525 CO 0.46 -0.69 0.64 -1.61 -0.31 0.00 0.00 175.10 173.58 2dbu s GLU 526 N -3.44 2.51 0.68 4.82 2.02 -0.83 -1.06 118.70 123.41 2dbu s GLU 526 Ca 0.02 -1.53 -0.15 0.00 0.02 0.00 0.00 54.97 53.33 2dbu s GLU 526 Cb 0.03 -2.61 0.01 0.00 0.10 0.00 0.00 34.13 31.67 2dbu s GLU 526 CO -0.09 -0.56 1.14 0.15 0.02 0.00 0.00 175.26 175.92 2dbu s LYS 527 N -4.46 2.58 0.00 1.61 1.02 -1.26 -4.31 119.74 114.91 2dbu s LYS 527 Ca 0.55 1.51 0.00 0.00 0.02 0.00 0.00 55.97 58.05 2dbu s LYS 527 Cb -0.07 -1.91 0.00 0.00 -0.52 0.00 0.00 37.83 35.33 2dbu s LYS 527 CO 0.34 -1.45 0.00 0.41 -0.92 0.00 0.00 175.35 173.74 2dbu n GLY 528 N -0.22 1.32 3.85 -3.33 0.00 -1.26 -4.79 105.19 100.76 2dbu n GLY 528 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 2dbu n GLY 528 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dbu s PHE 529 N -0.82 3.60 0.46 1.61 0.40 -1.26 -4.92 117.98 117.05 2dbu s PHE 529 Ca 0.00 1.02 -0.24 0.00 -0.60 0.00 0.00 56.93 57.10 2dbu s PHE 529 Cb 0.00 -2.34 -0.07 0.00 0.51 0.00 0.00 43.02 41.12 2dbu s PHE 529 CO 0.00 0.43 1.33 -1.54 0.70 0.00 0.00 175.22 176.14 2dbu s SER 530 N -1.75 5.90 0.39 1.36 1.04 -1.26 -4.89 113.70 114.49 2dbu s SER 530 Ca 0.38 2.69 0.08 0.00 0.48 0.00 0.00 55.95 59.58 2dbu s SER 530 Cb -0.15 -2.64 0.84 0.00 0.10 0.00 0.00 66.02 64.18 2dbu s SER 530 CO 0.19 -1.13 1.97 -0.65 0.98 0.00 0.00 173.24 174.59 2dbu h PRO 531 N 2.17 0.62 0.72 4.02 0.11 -2.00 -2.26 132.00 135.38 2dbu h PRO 531 Ca -0.50 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.54 2dbu h PRO 531 Cb 1.27 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2dbu h PRO 531 CO 0.60 0.41 -0.45 -0.44 -0.21 0.00 0.00 178.00 177.91 2dbu h ASP 532 N 0.64 -1.15 -0.88 -2.05 3.45 -2.01 -2.36 116.42 112.05 2dbu h ASP 532 Ca 0.30 0.07 0.12 0.00 0.43 0.00 0.00 57.03 57.94 2dbu h ASP 532 Cb 0.35 0.34 -0.08 0.00 -0.56 0.00 0.00 39.33 39.37 2dbu h ASP 532 CO -0.10 -0.69 0.51 0.74 -1.57 0.00 0.00 179.24 178.13 2dbu h THR 533 N -1.10 0.86 -0.12 0.35 2.02 -1.81 -1.42 112.91 111.69 2dbu h THR 533 Ca -0.09 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 2dbu h THR 533 Cb 0.89 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2dbu h THR 533 CO 0.08 0.15 -0.19 -0.07 0.37 0.00 0.00 175.52 175.86 2dbu h LEU 534 N 0.80 0.19 -0.28 2.58 3.38 -1.29 -2.37 115.31 118.33 2dbu h LEU 534 Ca 0.45 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 2dbu h LEU 534 Cb 0.49 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2dbu h LEU 534 CO -0.29 0.40 0.05 0.11 0.09 0.00 0.00 178.44 178.80 2dbu h LYS 535 N 0.18 0.46 0.18 1.13 1.57 -0.71 -2.57 116.57 116.81 2dbu h LYS 535 Ca 0.03 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2dbu h LYS 535 Cb 0.45 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2dbu h LYS 535 CO 0.03 0.57 -0.23 -0.07 -0.57 0.00 0.00 179.45 179.18 2dbu h LEU 536 N 0.27 -0.62 -0.82 2.94 3.38 -1.25 -0.09 115.31 119.13 2dbu h LEU 536 Ca 0.08 0.06 0.17 0.00 0.09 0.00 0.00 57.88 58.29 2dbu h LEU 536 Cb 0.33 0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.20 2dbu h LEU 536 CO 0.01 -0.32 0.33 -0.07 0.09 0.00 0.00 178.44 178.47 2dbu h LEU 537 N -0.46 0.29 -0.95 1.67 3.38 -1.39 0.41 115.31 118.26 2dbu h LEU 537 Ca 0.01 0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2dbu h LEU 537 Cb 0.45 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2dbu h LEU 537 CO -0.08 0.06 -0.38 -0.33 0.09 0.00 0.00 178.44 177.80 2dbu h GLU 538 N 0.43 0.28 0.00 1.13 5.08 -1.03 -1.13 114.58 119.34 2dbu h GLU 538 Ca 0.47 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.67 2dbu h GLU 538 Cb 0.79 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2dbu h GLU 538 CO -0.46 0.63 -0.18 0.00 -1.00 0.00 0.00 179.01 178.00 2dbu h ALA 539 N 1.36 1.06 0.00 3.43 0.00 0.16 -2.26 119.26 123.00 2dbu h ALA 539 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2dbu h ALA 539 Cb 0.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2dbu h ALA 539 CO 0.06 0.23 -0.39 1.63 0.00 0.00 0.00 179.25 180.78 2dbu n LYS 540 N -3.39 0.14 0.00 0.00 5.02 0.51 -4.93 118.16 115.51 2dbu n LYS 540 Ca -0.00 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2dbu n LYS 540 Cb 0.38 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2dbu n LYS 540 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dbu n GLY 541 N 1.41 1.57 3.75 0.72 0.00 -0.85 -5.08 105.19 106.71 2dbu n GLY 541 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2dbu n GLY 541 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dbu s GLN 542 N -0.08 4.41 -1.15 1.61 -1.52 -0.50 -4.94 119.66 117.48 2dbu s GLN 542 Ca 0.00 2.08 -0.09 0.00 -1.95 0.00 0.00 55.36 55.40 2dbu s GLN 542 Cb 0.00 -3.15 0.25 0.00 -0.22 0.00 0.00 33.01 29.89 2dbu s GLN 542 CO 0.00 -0.17 1.39 1.63 -0.25 0.00 0.00 175.29 177.89 2dbu n LYS 543 N 1.80 3.77 -1.67 2.91 5.02 -1.26 -3.96 118.16 124.77 2dbu n LYS 543 Ca 0.03 -4.22 -0.43 0.00 -2.02 0.00 0.00 58.31 51.66 2dbu n LYS 543 Cb 0.43 -2.70 -0.01 0.00 -0.02 0.00 0.00 35.03 32.73 2dbu n LYS 543 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dbu n VAL 544 N 2.81 1.82 -3.50 -0.18 0.31 -1.26 -2.62 118.33 115.70 2dbu n VAL 544 Ca 0.30 -0.45 -0.18 0.00 -0.01 0.00 0.00 64.34 63.99 2dbu n VAL 544 Cb 0.38 -1.41 -0.13 0.00 -0.91 0.00 0.00 33.84 31.77 2dbu n VAL 544 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dbu s ALA 545 N -0.91 -0.31 -0.11 3.52 0.00 -1.04 -4.90 121.76 118.02 2dbu s ALA 545 Ca 0.58 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.56 2dbu s ALA 545 Cb -0.62 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 2dbu s ALA 545 CO 0.60 -1.17 1.43 -1.17 0.00 0.00 0.00 175.76 175.45 2dbu s LEU 546 N 2.34 4.25 0.00 0.00 1.98 -1.26 -2.00 118.68 123.99 2dbu s LEU 546 Ca 0.07 1.95 0.04 0.00 -2.89 0.00 0.00 54.13 53.29 2dbu s LEU 546 Cb -0.15 -3.54 -0.01 0.00 0.66 0.00 0.00 46.19 43.14 2dbu s LEU 546 CO -0.12 -0.82 0.13 0.29 -1.89 0.00 0.00 176.35 173.94 2dbu n LYS 547 N 6.72 0.59 -0.86 1.98 4.76 -0.22 -4.94 118.16 126.19 2dbu n LYS 547 Ca 0.15 -3.58 -0.30 0.00 -2.87 0.00 0.00 58.31 51.71 2dbu n LYS 547 Cb 0.44 1.81 0.18 0.00 -1.84 0.00 0.00 35.03 35.61 2dbu n LYS 547 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2dbu s GLU 548 N -3.63 0.66 0.00 1.97 -1.05 -1.26 -4.50 118.70 110.88 2dbu s GLU 548 Ca 0.18 1.10 0.00 0.00 -0.15 0.00 0.00 54.97 56.11 2dbu s GLU 548 Cb 0.01 -1.72 0.00 0.00 -0.44 0.00 0.00 34.13 31.98 2dbu s GLU 548 CO 0.13 -2.74 0.00 0.00 0.95 0.00 0.00 175.26 173.61 2dbu n ALA 549 N -4.26 0.00 -0.03 -0.84 0.00 -1.26 -4.80 120.51 109.32 2dbu n ALA 549 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2dbu n ALA 549 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2dbu n ALA 549 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dbu n GLY 551 N 0.00 0.00 2.63 0.00 0.00 -1.26 -5.14 105.19 101.42 2dbu n GLY 551 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2dbu n GLY 551 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dbu n SER 552 N -0.50 -2.40 -4.77 1.61 2.88 -1.26 -4.78 113.62 104.40 2dbu n SER 552 Ca 0.00 -2.96 -0.40 0.00 -1.33 0.00 0.00 58.87 54.18 2dbu n SER 552 Cb 0.06 1.17 -0.03 0.00 -0.75 0.00 0.00 64.21 64.66 2dbu n SER 552 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2dbu s THR 553 N 0.44 3.10 -0.29 2.46 -4.23 -1.26 -4.42 115.64 111.44 2dbu s THR 553 Ca 0.32 1.06 -0.03 0.00 -1.18 0.00 0.00 61.69 61.86 2dbu s THR 553 Cb 0.11 -3.65 0.10 0.00 1.34 0.00 0.00 72.50 70.40 2dbu s THR 553 CO -0.15 0.21 0.11 -1.10 -0.54 0.00 0.00 174.62 173.15 2dbu s GLN 554 N -1.82 0.43 0.24 3.99 -1.52 -1.24 -1.09 119.66 118.64 2dbu s GLN 554 Ca 0.50 -0.74 0.09 0.00 -1.95 0.00 0.00 55.36 53.26 2dbu s GLN 554 Cb -0.34 -1.57 -0.05 0.00 -0.22 0.00 0.00 33.01 30.82 2dbu s GLN 554 CO 0.45 -0.98 -0.15 -1.12 -0.25 0.00 0.00 175.29 173.24 2dbu s SER 555 N 1.89 2.97 0.16 5.90 0.01 -0.79 -4.16 113.70 119.69 2dbu s SER 555 Ca 0.09 -1.06 0.04 0.00 1.31 0.00 0.00 55.95 56.33 2dbu s SER 555 Cb -0.17 -0.20 -0.01 0.00 0.21 0.00 0.00 66.02 65.85 2dbu s SER 555 CO -0.30 -0.13 0.14 -0.38 0.41 0.00 0.00 173.24 172.98 2dbu n ILE 556 N -0.50 0.00 -3.57 1.44 5.41 -0.51 -1.62 119.36 120.01 2dbu n ILE 556 Ca -0.07 -1.19 -0.01 0.00 1.00 0.00 0.00 62.75 62.48 2dbu n ILE 556 Cb 0.61 0.59 -0.05 0.00 -0.71 0.00 0.00 39.64 40.08 2dbu n ILE 556 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2dbu s VAL 558 N -2.66 -0.56 0.61 1.39 1.01 0.82 -0.95 120.40 120.06 2dbu s VAL 558 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 2dbu s VAL 558 Cb 0.01 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2dbu s VAL 558 CO 0.14 0.00 1.02 -0.83 0.00 0.00 0.00 175.10 175.43 2dbu s GLY 559 N 2.37 1.67 0.35 4.51 0.00 0.00 -4.64 107.32 111.59 2dbu s GLY 559 Ca -0.06 -0.09 0.04 0.00 0.00 0.00 0.00 44.72 44.61 2dbu s GLY 559 CO -0.18 0.18 1.99 -0.56 0.00 0.00 0.00 173.10 174.53 2dbu h PRO 560 N -0.26 0.80 0.00 2.90 0.13 -1.94 -0.94 132.00 132.69 2dbu h PRO 560 Ca -0.44 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dbu h PRO 560 Cb 1.19 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2dbu h PRO 560 CO 0.62 0.53 0.00 -0.44 -0.23 0.00 0.00 178.00 178.48 2dbu h ASP 561 N 0.82 0.00 0.00 1.44 3.32 -2.03 -3.45 116.42 116.52 2dbu h ASP 561 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2dbu h ASP 561 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2dbu h ASP 561 CO -0.07 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.06 2dbu n GLY 562 N -0.35 0.78 3.75 2.75 0.00 -0.36 -5.07 105.19 106.69 2dbu n GLY 562 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2dbu n GLY 562 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dbu s GLU 563 N -0.77 4.43 -0.13 1.61 2.56 -1.25 -4.80 118.70 120.34 2dbu s GLU 563 Ca 0.00 2.03 -0.04 0.00 0.00 0.00 0.00 54.97 56.97 2dbu s GLU 563 Cb 0.00 -3.17 -0.03 0.00 2.00 0.00 0.00 34.13 32.92 2dbu s GLU 563 CO 0.00 -0.16 0.00 -0.51 -0.56 0.00 0.00 175.26 174.03 2dbu s LEU 564 N -0.64 3.52 -0.14 2.70 1.43 -1.26 -0.82 118.68 123.48 2dbu s LEU 564 Ca 0.53 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 2dbu s LEU 564 Cb -0.36 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.04 2dbu s LEU 564 CO 0.41 0.26 -0.14 -0.31 0.23 0.00 0.00 176.35 176.80 2dbu s TYR 565 N -0.18 2.08 0.26 0.29 2.02 -1.26 -5.02 117.35 115.54 2dbu s TYR 565 Ca 0.05 -1.12 0.07 0.00 -0.37 0.00 0.00 57.07 55.70 2dbu s TYR 565 Cb -0.13 -1.53 -0.05 0.00 -0.40 0.00 0.00 41.96 39.85 2dbu s TYR 565 CO 0.02 -0.61 -0.09 0.20 -1.57 0.00 0.00 175.55 173.50 2dbu s GLY 566 N 1.36 1.72 -0.24 0.71 0.00 -1.26 -4.27 107.32 105.33 2dbu s GLY 566 Ca 0.02 -1.83 -0.15 0.00 0.00 0.00 0.00 44.72 42.76 2dbu s GLY 566 CO -0.08 -1.82 0.60 0.00 0.00 0.00 0.00 173.10 171.80 2dbu s ALA 567 N -2.97 -1.60 -0.04 3.20 0.00 -0.64 -4.72 121.76 114.99 2dbu s ALA 567 Ca 0.28 2.08 -0.03 0.00 0.00 0.00 0.00 51.96 54.29 2dbu s ALA 567 Cb 0.02 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 2dbu s ALA 567 CO 0.11 -0.34 0.11 -1.12 0.00 0.00 0.00 175.76 174.52 2dbu s SER 568 N 1.38 5.97 0.22 0.00 0.01 -1.26 -1.88 113.70 118.14 2dbu s SER 568 Ca -0.08 0.27 -0.31 0.00 1.31 0.00 0.00 55.95 57.14 2dbu s SER 568 Cb -0.06 -1.81 -0.10 0.00 0.21 0.00 0.00 66.02 64.26 2dbu s SER 568 CO -0.15 0.31 1.54 -0.62 0.41 0.00 0.00 173.24 174.74 2dbu s ASP 569 N -1.54 6.55 0.37 2.44 -1.08 -0.25 -4.89 116.67 118.27 2dbu s ASP 569 Ca 0.21 2.71 0.27 0.00 -0.52 0.00 0.00 52.55 55.23 2dbu s ASP 569 Cb -0.12 -2.61 1.13 0.00 -1.46 0.00 0.00 42.92 39.86 2dbu s ASP 569 CO 0.12 -0.81 1.82 1.55 0.52 0.00 0.00 175.17 178.36 2dbu h PRO 570 N 5.87 0.00 0.00 4.34 0.13 -1.91 -2.98 132.00 137.46 2dbu h PRO 570 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dbu h PRO 570 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dbu h PRO 570 CO 0.85 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.62 2dbu h ARG 571 N 0.00 0.00 -4.69 0.86 3.08 -1.90 -3.40 114.38 108.32 2dbu h ARG 571 Ca 0.00 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.36 2dbu h ARG 571 Cb 0.42 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.17 2dbu h ARG 571 CO 0.00 0.00 -0.63 -1.12 -1.07 0.00 0.00 179.97 177.15 2dbu s SER 572 N -5.34 5.18 0.49 7.04 0.01 -1.13 -5.07 113.70 114.88 2dbu s SER 572 Ca 0.01 -1.24 -0.23 0.00 1.31 0.00 0.00 55.95 55.81 2dbu s SER 572 Cb 0.09 -1.82 -0.06 0.00 0.21 0.00 0.00 66.02 64.44 2dbu s SER 572 CO 0.49 -0.32 1.25 0.68 0.41 0.00 0.00 173.24 175.76 2dbu s VAL 573 N 1.34 2.65 -0.12 3.43 -7.23 -1.26 -3.04 120.40 116.17 2dbu s VAL 573 Ca -0.02 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.64 2dbu s VAL 573 Cb -0.20 -3.26 0.00 0.00 0.56 0.00 0.00 36.38 33.49 2dbu s VAL 573 CO 0.01 0.00 0.00 0.47 -0.31 0.00 0.00 175.10 175.27 2dbu n ASP 574 N -0.65 -4.09 -4.70 4.85 8.00 -1.26 -5.03 116.55 113.67 2dbu n ASP 574 Ca 0.08 0.03 -0.27 0.00 0.71 0.00 0.00 54.79 55.34 2dbu n ASP 574 Cb 0.46 -1.69 0.11 0.00 -0.02 0.00 0.00 41.12 39.98 2dbu n ASP 574 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2dbu s ASP 575 N -2.14 4.29 -0.24 -2.24 1.47 -1.17 -5.09 116.67 111.55 2dbu s ASP 575 Ca 0.00 0.39 -0.26 0.00 1.18 0.00 0.00 52.55 53.86 2dbu s ASP 575 Cb 0.00 -0.83 0.10 0.00 -0.34 0.00 0.00 42.92 41.85 2dbu s ASP 575 CO 0.00 -1.97 0.87 -0.22 0.68 0.00 0.00 175.17 174.53 2dbu s LEU 576 N -5.46 -0.58 -0.12 2.11 2.96 -1.26 -5.05 118.68 111.28 2dbu s LEU 576 Ca 0.65 1.04 0.02 0.00 -0.22 0.00 0.00 54.13 55.62 2dbu s LEU 576 Cb -0.09 2.18 0.01 0.00 0.50 0.00 0.00 46.19 48.80 2dbu s LEU 576 CO 0.48 -0.26 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.17 2dbu s THR 577 N 0.01 1.78 0.15 3.68 2.01 -1.26 -4.92 115.64 117.08 2dbu s THR 577 Ca -0.00 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.08 2dbu s THR 577 Cb -0.04 -1.59 -0.00 0.00 0.01 0.00 0.00 72.50 70.88 2dbu s THR 577 CO -0.01 0.50 0.29 0.00 -0.69 0.00 0.00 174.62 174.70 2dbu s ALA 578 N 0.80 -0.16 0.00 7.40 0.00 -1.26 -4.98 121.76 123.56 2dbu s ALA 578 Ca -0.09 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.12 2dbu s ALA 578 Cb -0.16 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.74 2dbu s ALA 578 CO 0.00 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.54 2dbu n GLY 579 N -0.19 2.92 0.00 0.00 0.00 -1.26 -5.11 105.19 101.54 2dbu n GLY 579 Ca -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2dbu n GLY 579 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90