#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k0j s GLU 405 N 0.00 0.62 -0.61 -0.52 0.41 -1.26 -5.07 118.70 112.27 3k0j s GLU 405 Ca 0.00 0.94 -0.28 0.00 -0.41 0.00 0.00 54.97 55.23 3k0j s GLU 405 Cb 0.00 0.18 0.03 0.00 -1.78 0.00 0.00 34.13 32.56 3k0j s GLU 405 CO 0.00 -0.12 1.20 0.95 -0.49 0.00 0.00 175.26 176.79 3k0j s THR 406 N 1.02 3.97 -0.23 3.63 -4.23 -1.26 -4.97 115.64 113.58 3k0j s THR 406 Ca -0.06 0.76 -0.14 0.00 -1.18 0.00 0.00 61.69 61.08 3k0j s THR 406 Cb -0.05 -4.76 -0.04 0.00 1.34 0.00 0.00 72.50 68.98 3k0j s THR 406 CO -0.09 -1.44 0.32 -0.13 -0.54 0.00 0.00 174.62 172.74 3k0j s ARG 407 N 5.06 4.11 -0.00 3.99 0.52 -1.26 -5.02 118.95 126.35 3k0j s ARG 407 Ca 0.41 0.03 -0.30 0.00 -0.52 0.00 0.00 55.73 55.34 3k0j s ARG 407 Cb -0.08 -3.56 -0.06 0.00 0.52 0.00 0.00 34.95 31.77 3k0j s ARG 407 CO 0.23 -0.06 1.54 -2.14 0.02 0.00 0.00 175.30 174.88 3k0j s PRO 408 N 1.41 4.23 0.33 3.54 0.02 -1.26 -4.78 135.00 138.49 3k0j s PRO 408 Ca 0.15 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.30 3k0j s PRO 408 Cb -0.15 -3.70 -0.00 0.00 0.02 0.00 0.00 34.50 30.66 3k0j s PRO 408 CO 0.07 -0.70 0.40 0.27 -0.33 0.00 0.00 177.00 176.71 3k0j n ASN 409 N 5.99 -1.09 -0.09 2.53 6.94 -1.26 -5.07 115.26 123.21 3k0j n ASN 409 Ca 0.15 -2.92 0.09 0.00 -0.02 0.00 0.00 54.58 51.88 3k0j n ASN 409 Cb 0.42 2.15 0.50 0.00 -2.36 0.00 0.00 39.78 40.50 3k0j n ASN 409 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k0j n HIS 410 N -0.57 0.03 -5.11 -2.53 1.44 -1.26 -4.75 115.22 102.47 3k0j n HIS 410 Ca 0.03 -0.02 -0.32 0.00 -2.01 0.00 0.00 57.72 55.40 3k0j n HIS 410 Cb 0.57 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.53 3k0j n HIS 410 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 3k0j s THR 411 N -1.97 2.48 0.10 0.61 2.01 -1.26 -1.55 115.64 116.07 3k0j s THR 411 Ca 0.27 -0.93 0.06 0.00 0.31 0.00 0.00 61.69 61.41 3k0j s THR 411 Cb 0.13 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 3k0j s THR 411 CO 0.21 0.57 -0.04 0.27 -0.69 0.00 0.00 174.62 174.94 3k0j s ILE 412 N -0.40 3.70 -0.26 1.82 -4.36 -0.75 -2.78 121.20 118.18 3k0j s ILE 412 Ca 0.04 -1.16 0.01 0.00 -0.26 0.00 0.00 60.65 59.28 3k0j s ILE 412 Cb -0.12 -2.76 0.07 0.00 1.25 0.00 0.00 42.46 40.90 3k0j s ILE 412 CO 0.02 0.09 -0.04 -0.47 0.24 0.00 0.00 174.94 174.78 3k0j s TYR 413 N -1.31 2.62 0.09 1.37 6.14 0.54 -1.50 117.35 125.30 3k0j s TYR 413 Ca 0.24 -1.97 -0.05 0.00 0.64 0.00 0.00 57.07 55.93 3k0j s TYR 413 Cb -0.11 -1.79 -0.05 0.00 0.42 0.00 0.00 41.96 40.43 3k0j s TYR 413 CO 0.16 -0.82 0.32 0.42 0.64 0.00 0.00 175.55 176.28 3k0j s ILE 414 N 1.32 5.24 0.30 3.14 1.09 -0.74 -1.96 121.20 129.58 3k0j s ILE 414 Ca -0.03 0.01 -0.05 0.00 -1.10 0.00 0.00 60.65 59.48 3k0j s ILE 414 Cb -0.19 -3.61 -0.00 0.00 -1.06 0.00 0.00 42.46 37.59 3k0j s ILE 414 CO -0.08 0.15 0.44 0.54 -0.10 0.00 0.00 174.94 175.89 3k0j s ASN 415 N -2.23 0.56 -0.71 3.58 2.20 -0.55 -2.03 114.94 115.76 3k0j s ASN 415 Ca 0.36 -1.33 0.00 0.00 -0.94 0.00 0.00 52.86 50.95 3k0j s ASN 415 Cb -0.13 0.61 0.00 0.00 -2.00 0.00 0.00 41.25 39.73 3k0j s ASN 415 CO 0.23 -1.21 0.00 -3.20 -2.94 0.00 0.00 177.10 169.98 3k0j n ASN 416 N -1.01 -3.11 -4.85 3.54 5.15 -1.16 -3.07 115.26 110.77 3k0j n ASN 416 Ca 0.00 0.04 -0.32 0.00 -0.60 0.00 0.00 54.58 53.70 3k0j n ASN 416 Cb 0.62 -2.16 -0.06 0.00 -0.53 0.00 0.00 39.78 37.66 3k0j n ASN 416 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3k0j s LEU 417 N -2.15 4.01 -0.06 1.20 1.43 -0.16 -4.65 118.68 118.29 3k0j s LEU 417 Ca 0.00 1.33 -0.29 0.00 -1.03 0.00 0.00 54.13 54.13 3k0j s LEU 417 Cb 0.00 -4.15 -0.07 0.00 0.03 0.00 0.00 46.19 42.00 3k0j s LEU 417 CO 0.00 -0.26 1.95 0.21 0.23 0.00 0.00 176.35 178.48 3k0j s ASN 418 N -2.39 6.24 0.40 2.29 3.84 -1.26 -4.52 114.94 119.54 3k0j s ASN 418 Ca 0.55 2.33 0.15 0.00 0.21 0.00 0.00 52.86 56.10 3k0j s ASN 418 Cb -0.10 -2.53 0.86 0.00 -0.55 0.00 0.00 41.25 38.93 3k0j s ASN 418 CO 0.19 -1.27 1.88 1.05 -2.79 0.00 0.00 177.10 176.16 3k0j h GLU 419 N 11.50 0.00 0.00 0.43 -0.00 -1.93 -3.15 114.58 121.43 3k0j h GLU 419 Ca -0.45 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 58.88 3k0j h GLU 419 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.97 3k0j h GLU 419 CO 0.95 0.31 -0.16 1.57 -0.00 0.00 0.00 179.01 181.68 3k0j h LYS 420 N 0.00 0.00 -6.74 1.06 -0.00 -2.00 -3.45 116.57 105.44 3k0j h LYS 420 Ca -0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 60.65 60.14 3k0j h LYS 420 Cb 0.58 0.00 0.01 0.00 -0.00 0.00 0.00 32.23 32.82 3k0j h LYS 420 CO 0.04 0.16 0.49 0.42 -0.00 0.00 0.00 179.45 180.56 3k0j s ILE 421 N -3.78 3.62 0.08 0.07 1.09 -1.19 -4.97 121.20 116.11 3k0j s ILE 421 Ca -0.00 1.51 -0.33 0.00 -1.10 0.00 0.00 60.65 60.72 3k0j s ILE 421 Cb 0.11 -3.96 -0.13 0.00 -1.06 0.00 0.00 42.46 37.42 3k0j s ILE 421 CO 0.61 0.31 1.73 0.29 -0.10 0.00 0.00 174.94 177.77 3k0j n LYS 422 N 1.78 2.30 -0.08 2.79 5.02 -1.26 -4.82 118.16 123.90 3k0j n LYS 422 Ca 0.01 0.84 0.19 0.00 -2.02 0.00 0.00 58.31 57.33 3k0j n LYS 422 Cb 0.45 -2.66 0.63 0.00 -0.02 0.00 0.00 35.03 33.43 3k0j n LYS 422 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3k0j h LYS 423 N 7.50 0.14 -0.15 1.97 6.56 -1.93 0.22 116.57 130.88 3k0j h LYS 423 Ca -0.46 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.09 3k0j h LYS 423 Cb 1.25 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.87 3k0j h LYS 423 CO 0.92 0.10 -0.02 0.22 -2.06 0.00 0.00 179.45 178.61 3k0j h ASP 424 N 0.15 0.28 -0.40 0.86 3.58 -2.00 -1.66 116.42 117.23 3k0j h ASP 424 Ca 0.31 -0.34 -0.14 0.00 0.42 0.00 0.00 57.03 57.28 3k0j h ASP 424 Cb 1.02 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.98 3k0j h ASP 424 CO -0.05 0.55 -0.28 -0.33 -2.88 0.00 0.00 179.24 176.26 3k0j h GLU 425 N 0.00 0.93 -0.65 0.28 4.39 -1.61 -2.96 114.58 114.96 3k0j h GLU 425 Ca 0.04 -0.42 0.08 0.00 0.34 0.00 0.00 59.36 59.39 3k0j h GLU 425 Cb 0.42 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.99 3k0j h GLU 425 CO 0.01 1.08 0.32 1.25 -1.16 0.00 0.00 179.01 180.52 3k0j h LEU 426 N 0.79 0.43 -0.92 1.33 5.85 -0.50 0.11 115.31 122.38 3k0j h LEU 426 Ca 0.09 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3k0j h LEU 426 Cb 0.85 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.81 3k0j h LEU 426 CO 0.08 0.26 0.59 0.50 -0.34 0.00 0.00 178.44 179.52 3k0j h LYS 427 N 0.57 1.23 0.01 1.25 3.64 -1.15 0.11 116.57 122.24 3k0j h LYS 427 Ca 0.31 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 3k0j h LYS 427 Cb 0.29 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3k0j h LYS 427 CO -0.24 0.84 -0.00 0.87 -2.27 0.00 0.00 179.45 178.65 3k0j h LYS 428 N 1.26 -0.01 0.00 1.90 1.57 -0.97 0.15 116.57 120.47 3k0j h LYS 428 Ca 0.33 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 3k0j h LYS 428 Cb -0.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 3k0j h LYS 428 CO -0.07 0.19 -0.05 0.77 -0.57 0.00 0.00 179.45 179.72 3k0j h SER 429 N -0.21 0.00 0.77 0.86 0.02 -0.55 -1.08 113.55 113.35 3k0j h SER 429 Ca -0.00 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.73 3k0j h SER 429 Cb 0.21 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 3k0j h SER 429 CO 0.00 0.05 -0.99 -0.07 -1.14 0.00 0.00 176.83 174.68 3k0j h LEU 430 N 0.00 0.17 0.01 5.07 3.38 -0.19 -2.91 115.31 120.84 3k0j h LEU 430 Ca -0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3k0j h LEU 430 Cb 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3k0j h LEU 430 CO 0.01 1.06 -0.01 -0.74 0.09 0.00 0.00 178.44 178.85 3k0j h HIS 431 N 0.05 -0.01 0.02 1.13 2.76 0.27 -2.71 115.15 116.65 3k0j h HIS 431 Ca -0.05 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.12 3k0j h HIS 431 Cb 1.69 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.65 3k0j h HIS 431 CO 0.02 0.34 -0.02 0.00 -1.30 0.00 0.00 177.93 176.97 3k0j h ALA 432 N 0.61 -0.74 -0.98 5.26 0.00 -1.45 0.35 119.26 122.31 3k0j h ALA 432 Ca -0.00 -0.01 0.35 0.00 0.00 0.00 0.00 54.91 55.25 3k0j h ALA 432 Cb 0.36 0.30 -0.17 0.00 0.00 0.00 0.00 17.79 18.29 3k0j h ALA 432 CO 0.00 -0.74 0.43 0.97 0.00 0.00 0.00 179.25 179.92 3k0j h ILE 433 N -0.04 0.13 0.00 0.00 -0.00 -1.63 -1.70 117.51 114.27 3k0j h ILE 433 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 64.86 64.82 3k0j h ILE 433 Cb 0.04 -0.00 0.00 0.00 -0.00 0.00 0.00 36.82 36.85 3k0j h ILE 433 CO -0.00 0.02 -1.08 0.49 -0.00 0.00 0.00 178.15 177.57 3k0j n PHE 434 N -5.23 0.08 0.68 2.19 3.72 -1.02 -4.25 117.46 113.63 3k0j n PHE 434 Ca 0.32 0.02 0.04 0.00 -0.05 0.00 0.00 57.45 57.78 3k0j n PHE 434 Cb 1.05 -0.23 0.22 0.00 -0.94 0.00 0.00 39.48 39.58 3k0j n PHE 434 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3k0j n SER 435 N -1.74 0.00 0.07 4.37 3.41 0.12 -2.11 113.62 117.74 3k0j n SER 435 Ca 0.02 -0.45 -0.02 0.00 -0.26 0.00 0.00 58.87 58.17 3k0j n SER 435 Cb 0.39 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.28 3k0j n SER 435 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3k0j h ARG 436 N 0.00 0.00 -0.87 4.33 3.08 -1.74 -3.34 114.38 115.84 3k0j h ARG 436 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 3k0j h ARG 436 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 3k0j h ARG 436 CO 0.00 0.51 0.13 1.19 -1.07 0.00 0.00 179.97 180.73 3k0j n PHE 437 N -3.10 1.29 0.00 3.04 3.72 -0.90 -5.02 117.46 116.49 3k0j n PHE 437 Ca -0.05 -0.69 0.00 0.00 -0.05 0.00 0.00 57.45 56.66 3k0j n PHE 437 Cb 0.85 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 3k0j n PHE 437 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k0j n GLY 438 N 0.07 -0.83 3.74 1.37 0.00 -1.26 -4.53 105.19 103.75 3k0j n GLY 438 Ca 0.21 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 3k0j n GLY 438 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k0j s GLN 439 N 0.00 4.20 -0.19 1.61 2.00 -1.26 -4.72 119.66 121.30 3k0j s GLN 439 Ca 0.00 2.43 -0.01 0.00 -2.00 0.00 0.00 55.36 55.77 3k0j s GLN 439 Cb 0.00 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.72 3k0j s GLN 439 CO 0.00 -0.56 -0.12 0.42 -0.50 0.00 0.00 175.29 174.52 3k0j s ILE 440 N 0.40 2.73 -0.54 -2.34 1.01 -1.26 -1.61 121.20 119.58 3k0j s ILE 440 Ca 0.65 -0.72 0.24 0.00 0.00 0.00 0.00 60.65 60.82 3k0j s ILE 440 Cb -0.45 -2.19 0.12 0.00 0.01 0.00 0.00 42.46 39.94 3k0j s ILE 440 CO 0.40 0.49 1.38 -0.07 0.00 0.00 0.00 174.94 177.14 3k0j h LEU 441 N 7.90 0.00 0.00 2.97 3.38 -0.82 -3.47 115.31 125.28 3k0j h LEU 441 Ca -0.42 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3k0j h LEU 441 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3k0j h LEU 441 CO 0.61 0.05 0.00 -0.67 0.09 0.00 0.00 178.44 178.53 3k0j n ASP 442 N -2.39 0.00 -4.10 -0.43 2.03 -1.19 -5.00 116.55 105.48 3k0j n ASP 442 Ca 0.03 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.03 3k0j n ASP 442 Cb 0.47 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.71 3k0j n ASP 442 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3k0j s ILE 443 N -1.91 1.77 -0.41 5.18 1.01 -1.26 -0.66 121.20 124.92 3k0j s ILE 443 Ca 0.00 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.79 3k0j s ILE 443 Cb 0.00 -1.59 0.09 0.00 0.01 0.00 0.00 42.46 40.96 3k0j s ILE 443 CO 0.00 0.49 0.22 -0.76 0.00 0.00 0.00 174.94 174.89 3k0j s LEU 444 N 0.99 5.06 -0.07 2.97 1.43 0.41 -4.96 118.68 124.52 3k0j s LEU 444 Ca -0.05 -1.63 -0.17 0.00 -1.03 0.00 0.00 54.13 51.25 3k0j s LEU 444 Cb -0.15 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 3k0j s LEU 444 CO -0.03 -0.52 0.44 -0.69 0.23 0.00 0.00 176.35 175.78 3k0j s VAL 445 N 1.33 5.12 0.67 -1.59 1.01 -1.26 -0.37 120.40 125.32 3k0j s VAL 445 Ca 0.03 0.88 -0.16 0.00 0.00 0.00 0.00 61.98 62.74 3k0j s VAL 445 Cb -0.23 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.40 3k0j s VAL 445 CO -0.00 0.43 1.15 -0.44 0.00 0.00 0.00 175.10 176.24 3k0j s SER 446 N -0.06 4.82 -0.01 3.32 0.01 -0.95 -5.01 113.70 115.83 3k0j s SER 446 Ca 0.24 2.17 0.01 0.00 1.31 0.00 0.00 55.95 59.68 3k0j s SER 446 Cb -0.16 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.51 3k0j s SER 446 CO 0.11 -1.83 0.72 -2.11 0.41 0.00 0.00 173.24 170.53 3k0j n ARG 447 N -2.38 0.99 -4.21 12.44 1.85 -1.26 -4.85 116.66 119.24 3k0j n ARG 447 Ca 0.12 -0.93 -0.35 0.00 -1.00 0.00 0.00 57.85 55.68 3k0j n ARG 447 Cb 0.51 -0.70 -0.09 0.00 -1.05 0.00 0.00 32.46 31.14 3k0j n ARG 447 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3k0j s SER 448 N -0.50 5.55 0.00 2.89 1.04 -1.26 -4.95 113.70 116.46 3k0j s SER 448 Ca 0.01 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3k0j s SER 448 Cb 0.01 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.43 3k0j s SER 448 CO 0.00 0.35 0.05 0.00 0.98 0.00 0.00 173.24 174.62 3k0j n LEU 449 N 2.36 0.08 0.00 2.42 -0.00 -1.26 0.55 117.00 121.15 3k0j n LEU 449 Ca -0.19 -0.04 0.00 0.00 -0.00 0.00 0.00 56.01 55.78 3k0j n LEU 449 Cb 0.54 -0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 3k0j n LEU 449 CO 0.30 0.02 -0.33 2.29 -0.00 0.00 0.00 177.39 179.67 3k0j n LYS 450 N 0.35 1.62 -0.61 1.47 2.85 -1.26 -4.70 118.16 117.89 3k0j n LYS 450 Ca 0.00 0.00 0.10 0.00 -1.05 0.00 0.00 58.31 57.36 3k0j n LYS 450 Cb 0.02 -0.83 0.36 0.00 -0.65 0.00 0.00 35.03 33.93 3k0j n LYS 450 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 3k0j n MET 451 N -1.75 3.67 -1.69 -1.58 2.00 0.19 -4.98 117.12 112.98 3k0j n MET 451 Ca 0.00 -2.90 -0.44 0.00 0.00 0.00 0.00 57.70 54.36 3k0j n MET 451 Cb 0.33 -1.88 -0.03 0.00 0.00 0.00 0.00 33.22 31.64 3k0j n MET 451 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 3k0j n ARG 452 N 1.24 2.39 -0.26 0.03 3.00 0.33 -2.78 116.66 120.61 3k0j n ARG 452 Ca 0.26 0.86 0.00 0.00 -0.01 0.00 0.00 57.85 58.96 3k0j n ARG 452 Cb 0.88 -2.64 0.00 0.00 0.00 0.00 0.00 32.46 30.70 3k0j n ARG 452 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3k0j n GLY 453 N 3.26 0.79 3.48 -0.13 0.00 -1.26 -4.93 105.19 106.40 3k0j n GLY 453 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 3k0j n GLY 453 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k0j s GLN 454 N -0.74 1.69 -0.08 1.61 -0.21 -1.12 -0.99 119.66 119.83 3k0j s GLN 454 Ca 0.00 -1.93 -0.31 0.00 0.02 0.00 0.00 55.36 53.13 3k0j s GLN 454 Cb 0.00 -1.02 0.12 0.00 1.00 0.00 0.00 33.01 33.10 3k0j s GLN 454 CO 0.00 -0.14 1.05 0.00 -2.12 0.00 0.00 175.29 174.07 3k0j s ALA 455 N -3.17 -1.94 -0.03 6.09 0.00 -0.86 -2.24 121.76 119.60 3k0j s ALA 455 Ca 0.36 1.20 0.06 0.00 0.00 0.00 0.00 51.96 53.57 3k0j s ALA 455 Cb 0.08 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 23.38 3k0j s ALA 455 CO 0.16 -0.68 -0.19 -0.06 0.00 0.00 0.00 175.76 174.98 3k0j s PHE 456 N -2.80 2.54 -0.28 0.00 0.40 0.50 -1.79 117.98 116.55 3k0j s PHE 456 Ca 0.08 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.15 3k0j s PHE 456 Cb -0.01 -1.57 0.08 0.00 0.51 0.00 0.00 43.02 42.03 3k0j s PHE 456 CO -0.06 0.09 -0.02 0.08 0.70 0.00 0.00 175.22 176.01 3k0j s VAL 457 N -0.69 1.90 -0.45 -0.44 1.01 -0.56 -0.44 120.40 120.73 3k0j s VAL 457 Ca 0.11 -1.74 -0.24 0.00 0.00 0.00 0.00 61.98 60.11 3k0j s VAL 457 Cb -0.10 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.08 3k0j s VAL 457 CO -0.00 -0.30 0.85 -0.63 0.00 0.00 0.00 175.10 175.02 3k0j s ILE 458 N 1.16 4.57 0.15 2.22 1.01 0.16 -1.80 121.20 128.67 3k0j s ILE 458 Ca 0.00 0.59 -0.12 0.00 0.00 0.00 0.00 60.65 61.12 3k0j s ILE 458 Cb -0.19 -4.37 -0.07 0.00 0.01 0.00 0.00 42.46 37.84 3k0j s ILE 458 CO -0.08 -0.77 0.52 -0.36 0.00 0.00 0.00 174.94 174.25 3k0j s PHE 459 N 3.51 3.56 0.14 3.97 0.08 -0.60 -0.11 117.98 128.54 3k0j s PHE 459 Ca 0.33 0.97 -0.16 0.00 0.12 0.00 0.00 56.93 58.20 3k0j s PHE 459 Cb -0.11 -2.31 0.01 0.00 -0.57 0.00 0.00 43.02 40.04 3k0j s PHE 459 CO 0.24 0.41 1.72 -0.22 -0.10 0.00 0.00 175.22 177.27 3k0j h LYS 460 N 3.37 0.60 -6.17 0.44 3.64 -1.60 -3.44 116.57 113.42 3k0j h LYS 460 Ca -0.48 -0.09 -0.64 0.00 -1.27 0.00 0.00 60.65 58.17 3k0j h LYS 460 Cb 1.19 -0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.81 3k0j h LYS 460 CO 0.67 0.52 -0.60 -1.21 -2.27 0.00 0.00 179.45 176.56 3k0j s GLU 461 N -5.71 2.89 0.06 1.90 2.02 -1.26 -5.04 118.70 113.56 3k0j s GLU 461 Ca -0.13 -0.68 -0.15 0.00 0.02 0.00 0.00 54.97 54.03 3k0j s GLU 461 Cb 0.10 -2.74 -0.24 0.00 0.10 0.00 0.00 34.13 31.36 3k0j s GLU 461 CO 0.75 0.57 1.16 0.28 0.02 0.00 0.00 175.26 178.04 3k0j h VAL 462 N 2.62 1.31 -0.54 2.63 2.07 -1.87 -3.15 116.25 119.31 3k0j h VAL 462 Ca -0.47 -2.24 0.10 0.00 0.82 0.00 0.00 66.70 64.91 3k0j h VAL 462 Cb 1.16 2.46 -0.08 0.00 -1.52 0.00 0.00 31.29 33.31 3k0j h VAL 462 CO 0.66 0.68 0.10 0.77 0.02 0.00 0.00 177.57 179.80 3k0j h SER 463 N 0.29 -0.01 -0.27 0.57 4.64 -1.96 -1.45 113.55 115.35 3k0j h SER 463 Ca -0.13 0.10 0.03 0.00 -0.47 0.00 0.00 61.79 61.33 3k0j h SER 463 Cb 1.65 0.14 -0.05 0.00 -0.31 0.00 0.00 62.40 63.83 3k0j h SER 463 CO 0.19 0.01 -0.37 0.28 -0.87 0.00 0.00 176.83 176.08 3k0j h SER 464 N 0.24 -1.24 -1.01 4.97 0.02 -1.79 0.29 113.55 115.03 3k0j h SER 464 Ca 0.28 0.16 0.30 0.00 -0.84 0.00 0.00 61.79 61.69 3k0j h SER 464 Cb 0.39 0.51 -0.14 0.00 0.14 0.00 0.00 62.40 63.30 3k0j h SER 464 CO -0.36 -0.27 0.59 0.00 -1.14 0.00 0.00 176.83 175.65 3k0j h ALA 465 N -0.47 1.93 -0.13 3.77 0.00 -1.26 0.59 119.26 123.69 3k0j h ALA 465 Ca 0.05 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3k0j h ALA 465 Cb 0.39 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3k0j h ALA 465 CO -0.40 -0.51 0.05 1.15 0.00 0.00 0.00 179.25 179.55 3k0j h THR 466 N 0.39 1.16 -0.47 0.00 2.02 0.50 -0.94 112.91 115.57 3k0j h THR 466 Ca 0.71 -0.50 -0.08 0.00 0.77 0.00 0.00 66.41 67.31 3k0j h THR 466 Cb 1.57 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 69.21 3k0j h THR 466 CO -0.56 0.15 -0.05 0.78 0.37 0.00 0.00 175.52 176.21 3k0j h ASN 467 N 0.04 0.78 0.36 4.18 2.35 -0.14 -2.21 115.58 120.95 3k0j h ASN 467 Ca 0.04 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 3k0j h ASN 467 Cb 0.19 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3k0j h ASN 467 CO -0.00 0.88 -0.43 0.00 -1.65 0.00 0.00 177.43 176.22 3k0j h ALA 468 N 1.20 -1.06 -0.05 -0.83 0.00 -0.67 -0.58 119.26 117.28 3k0j h ALA 468 Ca 0.14 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3k0j h ALA 468 Cb 0.52 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3k0j h ALA 468 CO 0.03 -1.11 -0.10 1.25 0.00 0.00 0.00 179.25 179.32 3k0j h LEU 469 N -0.81 -0.34 -0.05 0.00 6.46 -1.03 -1.88 115.31 117.66 3k0j h LEU 469 Ca -0.04 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3k0j h LEU 469 Cb 0.72 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 3k0j h LEU 469 CO -0.09 -0.08 -0.03 0.54 -0.62 0.00 0.00 178.44 178.16 3k0j n ARG 470 N -3.16 -0.02 -0.05 1.25 1.74 -0.84 -0.94 116.66 114.64 3k0j n ARG 470 Ca -0.01 1.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.97 3k0j n ARG 470 Cb 0.07 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.94 3k0j n ARG 470 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 3k0j h SER 471 N 0.00 -1.26 0.28 0.55 0.02 -1.01 -2.29 113.55 109.83 3k0j h SER 471 Ca 0.01 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3k0j h SER 471 Cb 0.02 0.50 0.00 0.00 0.14 0.00 0.00 62.40 63.06 3k0j h SER 471 CO -0.05 -0.32 0.00 0.23 -1.14 0.00 0.00 176.83 175.56 3k0j n MET 472 N -4.58 0.39 -1.47 3.45 2.81 -0.72 -4.82 117.12 112.18 3k0j n MET 472 Ca -0.04 0.07 -0.48 0.00 -1.81 0.00 0.00 57.70 55.44 3k0j n MET 472 Cb 0.26 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.20 3k0j n MET 472 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 3k0j n GLN 473 N -1.21 1.10 -0.65 0.03 -0.06 -0.12 -0.10 117.38 116.37 3k0j n GLN 473 Ca 0.11 0.27 0.00 0.00 -2.00 0.00 0.00 57.00 55.38 3k0j n GLN 473 Cb 0.14 -2.57 0.00 0.00 -4.06 0.00 0.00 30.24 23.75 3k0j n GLN 473 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3k0j n GLY 474 N 6.43 0.77 3.72 1.69 0.00 -0.42 -4.98 105.19 112.40 3k0j n GLY 474 Ca 0.41 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 3k0j n GLY 474 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3k0j s PHE 475 N -2.81 3.00 0.34 1.61 2.19 0.86 -4.24 117.98 118.93 3k0j s PHE 475 Ca 0.00 0.64 -0.29 0.00 0.33 0.00 0.00 56.93 57.61 3k0j s PHE 475 Cb 0.00 -3.97 -0.11 0.00 -1.31 0.00 0.00 43.02 37.63 3k0j s PHE 475 CO 0.00 -3.52 1.46 -1.25 1.83 0.00 0.00 175.22 173.74 3k0j s PRO 476 N 0.79 4.18 -0.28 10.12 0.04 -1.26 -0.71 135.00 147.88 3k0j s PRO 476 Ca 0.69 2.47 -0.00 0.00 0.04 0.00 0.00 61.00 64.20 3k0j s PRO 476 Cb -0.45 -3.01 0.17 0.00 0.04 0.00 0.00 34.50 31.24 3k0j s PRO 476 CO 0.35 -0.46 0.48 0.12 0.04 0.00 0.00 177.00 177.53 3k0j s PHE 477 N -0.83 -1.26 -1.35 0.56 5.36 -1.10 -4.88 117.98 114.48 3k0j s PHE 477 Ca 0.54 1.05 -0.06 0.00 -0.96 0.00 0.00 56.93 57.51 3k0j s PHE 477 Cb -0.45 0.20 0.02 0.00 -0.34 0.00 0.00 43.02 42.46 3k0j s PHE 477 CO 0.56 -0.87 0.98 0.66 -1.46 0.00 0.00 175.22 175.09 3k0j n TYR 478 N 5.39 -2.36 -3.45 10.12 4.01 -1.26 -2.67 117.16 126.93 3k0j n TYR 478 Ca -0.01 0.93 -0.19 0.00 -0.16 0.00 0.00 57.90 58.47 3k0j n TYR 478 Cb 0.51 -4.65 0.08 0.00 -0.31 0.00 0.00 39.34 34.97 3k0j n TYR 478 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3k0j n ASP 479 N -3.01 -3.65 -3.24 7.72 8.00 -1.26 -4.80 116.55 116.32 3k0j n ASP 479 Ca -0.12 -0.57 0.04 0.00 0.71 0.00 0.00 54.79 54.84 3k0j n ASP 479 Cb 0.60 -4.95 -0.02 0.00 -0.02 0.00 0.00 41.12 36.73 3k0j n ASP 479 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3k0j s LYS 480 N -5.68 0.35 0.17 -1.24 1.02 -1.09 -5.03 119.74 108.24 3k0j s LYS 480 Ca 0.22 0.70 -0.33 0.00 0.02 0.00 0.00 55.97 56.58 3k0j s LYS 480 Cb -0.10 0.40 -0.13 0.00 -0.52 0.00 0.00 37.83 37.49 3k0j s LYS 480 CO 0.71 -0.31 1.68 -0.35 -0.92 0.00 0.00 175.35 176.16 3k0j n PRO 481 N 5.35 2.51 -1.47 -1.68 -0.04 -1.26 -2.70 135.00 135.71 3k0j n PRO 481 Ca -0.06 0.91 -0.32 0.00 -0.04 0.00 0.00 63.50 63.99 3k0j n PRO 481 Cb 0.52 -2.73 0.07 0.00 -0.04 0.00 0.00 33.50 31.33 3k0j n PRO 481 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3k0j s MET 482 N 1.31 2.49 -0.04 0.54 -1.94 0.11 -4.83 119.30 116.94 3k0j s MET 482 Ca 0.78 1.26 -0.01 0.00 -1.71 0.00 0.00 55.69 56.01 3k0j s MET 482 Cb -0.58 -1.92 0.03 0.00 2.01 0.00 0.00 34.83 34.37 3k0j s MET 482 CO 0.36 -1.47 0.04 1.03 -0.01 0.00 0.00 175.02 174.96 3k0j s ARG 483 N -4.56 0.08 -0.00 2.03 0.52 -1.17 -1.30 118.95 114.54 3k0j s ARG 483 Ca 0.64 0.27 0.04 0.00 -0.52 0.00 0.00 55.73 56.16 3k0j s ARG 483 Cb -0.19 -0.53 -0.01 0.00 0.52 0.00 0.00 34.95 34.74 3k0j s ARG 483 CO 0.50 -0.27 -0.13 0.42 0.02 0.00 0.00 175.30 175.83 3k0j s ILE 484 N 1.81 1.06 0.23 1.52 1.01 -1.26 -1.49 121.20 124.07 3k0j s ILE 484 Ca 0.01 -0.65 0.03 0.00 0.00 0.00 0.00 60.65 60.04 3k0j s ILE 484 Cb -0.12 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.44 3k0j s ILE 484 CO -0.03 0.24 0.25 0.00 0.00 0.00 0.00 174.94 175.40 3k0j n GLN 485 N 2.59 0.35 -3.43 2.79 10.64 -0.83 -4.96 117.38 124.53 3k0j n GLN 485 Ca -0.15 -2.12 -0.33 0.00 -1.83 0.00 0.00 57.00 52.57 3k0j n GLN 485 Cb 0.55 1.85 -0.05 0.00 -0.86 0.00 0.00 30.24 31.72 3k0j n GLN 485 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 3k0j s TYR 486 N -3.17 3.48 0.35 2.61 2.02 -1.26 -0.34 117.35 121.04 3k0j s TYR 486 Ca 0.24 0.89 -0.25 0.00 -0.37 0.00 0.00 57.07 57.58 3k0j s TYR 486 Cb 0.01 -2.26 -0.10 0.00 -0.40 0.00 0.00 41.96 39.21 3k0j s TYR 486 CO 0.17 0.33 0.97 0.00 -1.57 0.00 0.00 175.55 175.46 3k0j s ALA 487 N -1.70 3.16 0.37 3.71 0.00 -1.12 -4.72 121.76 121.46 3k0j s ALA 487 Ca 0.44 0.55 -0.28 0.00 0.00 0.00 0.00 51.96 52.67 3k0j s ALA 487 Cb -0.12 -3.20 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 3k0j s ALA 487 CO 0.21 0.08 1.51 0.15 0.00 0.00 0.00 175.76 177.71 3k0j s LYS 488 N -2.29 4.09 0.00 0.00 3.01 -1.26 -4.86 119.74 118.43 3k0j s LYS 488 Ca 0.53 2.60 0.00 0.00 -1.01 0.00 0.00 55.97 58.09 3k0j s LYS 488 Cb -0.18 -2.97 0.00 0.00 -1.01 0.00 0.00 37.83 33.67 3k0j s LYS 488 CO 0.23 -0.57 0.00 2.41 0.51 0.00 0.00 175.35 177.93