#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w1h s PRO 407 N 0.00 4.52 0.44 1.61 0.04 -1.26 -5.03 135.00 135.32 1w1h s PRO 407 Ca 0.00 1.15 -0.26 0.00 0.04 0.00 0.00 61.00 61.94 1w1h s PRO 407 Cb 0.00 -3.06 -0.09 0.00 0.04 0.00 0.00 34.50 31.40 1w1h s PRO 407 CO 0.00 0.45 1.44 -0.48 0.04 0.00 0.00 177.00 178.46 1w1h s LEU 408 N -1.58 4.14 0.00 -3.56 -0.00 -1.26 -2.89 118.68 113.54 1w1h s LEU 408 Ca 0.41 2.96 0.00 0.00 -0.00 0.00 0.00 54.13 57.50 1w1h s LEU 408 Cb -0.21 -3.89 0.00 0.00 -0.00 0.00 0.00 46.19 42.09 1w1h s LEU 408 CO 0.25 -1.15 0.00 0.61 -0.00 0.00 0.00 176.35 176.06 1w1h n GLY 409 N 0.55 0.54 0.79 -3.48 0.00 -1.26 -4.96 105.19 97.37 1w1h n GLY 409 Ca 0.04 -0.42 0.09 0.00 0.00 0.00 0.00 46.02 45.74 1w1h n GLY 409 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w1h n SER 410 N 0.76 2.68 -4.73 1.61 3.41 -1.14 -5.00 113.62 111.20 1w1h n SER 410 Ca 0.00 -1.80 -0.42 0.00 -0.26 0.00 0.00 58.87 56.39 1w1h n SER 410 Cb 0.00 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 1w1h n SER 410 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1w1h s ASN 411 N -1.47 6.51 0.03 4.04 6.03 -1.26 -4.90 114.94 123.93 1w1h s ASN 411 Ca 0.24 2.76 0.22 0.00 -1.03 0.00 0.00 52.86 55.05 1w1h s ASN 411 Cb 0.16 -2.61 0.92 0.00 -3.03 0.00 0.00 41.25 36.69 1w1h s ASN 411 CO 0.24 -0.84 1.70 2.30 -2.03 0.00 0.00 177.10 178.46 1w1h n ILE 412 N 3.08 0.54 0.30 0.54 -5.35 -1.26 -2.86 119.36 114.34 1w1h n ILE 412 Ca 0.11 0.11 0.15 0.00 -0.27 0.00 0.00 62.75 62.85 1w1h n ILE 412 Cb 0.38 -0.78 0.93 0.00 -1.74 0.00 0.00 39.64 38.43 1w1h n ILE 412 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1w1h h GLU 413 N 0.00 0.00 -0.13 6.28 4.39 -1.94 -1.92 114.58 121.26 1w1h h GLU 413 Ca 0.00 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.74 1w1h h GLU 413 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1w1h h GLU 413 CO 0.00 0.00 0.12 -0.56 -1.16 0.00 0.00 179.01 177.41 1w1h h GLN 414 N 0.00 0.00 -0.00 2.33 3.07 -1.93 -1.41 115.11 117.17 1w1h h GLN 414 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1w1h h GLN 414 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.57 1w1h h GLN 414 CO -0.00 0.00 -0.28 0.66 0.09 0.00 0.00 178.83 179.30 1w1h n TYR 415 N -4.07 0.00 -3.91 0.06 4.01 -0.72 -4.87 117.16 107.66 1w1h n TYR 415 Ca 0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.39 1w1h n TYR 415 Cb 0.24 -0.25 -0.11 0.00 -0.31 0.00 0.00 39.34 38.92 1w1h n TYR 415 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1w1h s ILE 416 N -2.77 4.73 -0.33 -0.72 1.01 -0.53 -0.85 121.20 121.74 1w1h s ILE 416 Ca 0.19 -0.05 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1w1h s ILE 416 Cb 0.19 -3.16 0.10 0.00 0.01 0.00 0.00 42.46 39.59 1w1h s ILE 416 CO 0.58 0.41 0.03 -1.00 0.00 0.00 0.00 174.94 174.97 1w1h s HIS 417 N 0.80 3.64 0.23 3.97 3.76 0.10 -4.99 115.29 122.80 1w1h s HIS 417 Ca 0.04 -2.89 -0.30 0.00 -0.15 0.00 0.00 55.06 51.77 1w1h s HIS 417 Cb -0.13 -2.78 -0.09 0.00 1.11 0.00 0.00 32.58 30.69 1w1h s HIS 417 CO 0.02 -0.94 1.20 -0.51 -0.85 0.00 0.00 174.74 173.66 1w1h s ASP 418 N 0.95 7.07 -0.13 1.40 1.01 -1.26 -1.28 116.67 124.43 1w1h s ASP 418 Ca 0.09 2.33 0.07 0.00 0.71 0.00 0.00 52.55 55.75 1w1h s ASP 418 Cb -0.19 -2.62 -0.13 0.00 1.01 0.00 0.00 42.92 40.99 1w1h s ASP 418 CO -0.08 -0.34 -0.02 0.18 0.21 0.00 0.00 175.17 175.11 1w1h n LEU 419 N 1.89 1.00 0.00 1.23 4.77 0.34 -4.95 117.00 121.29 1w1h n LEU 419 Ca 0.02 -0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 1w1h n LEU 419 Cb 0.44 0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1w1h n LEU 419 CO 0.56 0.45 0.28 -0.90 -1.33 0.00 0.00 177.39 176.45 1w1h n ASP 420 N -2.60 -0.68 0.25 -1.43 5.68 -1.05 -4.97 116.55 111.74 1w1h n ASP 420 Ca -0.22 -1.38 0.17 0.00 -0.50 0.00 0.00 54.79 52.86 1w1h n ASP 420 Cb 0.85 1.12 0.82 0.00 -1.14 0.00 0.00 41.12 42.77 1w1h n ASP 420 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1w1h h SER 421 N 0.73 0.00 -0.24 -1.12 4.64 -2.03 -2.29 113.55 113.25 1w1h h SER 421 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1w1h h SER 421 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1w1h h SER 421 CO 0.14 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.69 1w1h n ASN 422 N -2.78 2.60 -3.78 4.97 3.02 -1.26 -5.04 115.26 112.98 1w1h n ASN 422 Ca -0.01 -1.89 -0.13 0.00 -0.03 0.00 0.00 54.58 52.52 1w1h n ASN 422 Cb 0.16 -0.16 -0.12 0.00 -0.61 0.00 0.00 39.78 39.05 1w1h n ASN 422 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1w1h s SER 423 N -0.96 -0.25 0.23 6.41 0.01 -0.86 -4.15 113.70 114.13 1w1h s SER 423 Ca 0.18 0.49 -0.20 0.00 1.31 0.00 0.00 55.95 57.72 1w1h s SER 423 Cb 0.10 0.48 0.03 0.00 0.21 0.00 0.00 66.02 66.83 1w1h s SER 423 CO 0.13 -0.09 0.63 0.72 0.41 0.00 0.00 173.24 175.03 1w1h s PHE 424 N 0.28 -0.21 0.05 2.43 -0.12 -0.92 -0.50 117.98 118.98 1w1h s PHE 424 Ca -0.01 -0.15 -0.02 0.00 -0.05 0.00 0.00 56.93 56.70 1w1h s PHE 424 Cb -0.03 0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 42.89 1w1h s PHE 424 CO -0.01 -1.05 -0.00 -1.83 -0.05 0.00 0.00 175.22 172.28 1w1h s GLU 425 N -3.88 0.58 -0.01 1.99 -1.05 -0.40 -1.54 118.70 114.39 1w1h s GLU 425 Ca 0.09 -1.06 -0.00 0.00 -0.15 0.00 0.00 54.97 53.85 1w1h s GLU 425 Cb -0.03 0.21 -0.04 0.00 -0.44 0.00 0.00 34.13 33.83 1w1h s GLU 425 CO 0.00 -0.12 0.05 -0.51 0.95 0.00 0.00 175.26 175.64 1w1h s LEU 426 N -2.61 3.77 0.06 1.83 1.43 0.24 -0.72 118.68 122.69 1w1h s LEU 426 Ca 0.02 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 52.93 1w1h s LEU 426 Cb 0.04 -2.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 1w1h s LEU 426 CO -0.08 0.29 1.08 -1.81 0.23 0.00 0.00 176.35 176.06 1w1h s ASP 427 N -1.61 7.25 -1.33 2.29 1.01 -0.03 -4.94 116.67 119.32 1w1h s ASP 427 Ca 0.21 1.88 -0.07 0.00 0.71 0.00 0.00 52.55 55.29 1w1h s ASP 427 Cb -0.12 -2.58 0.12 0.00 1.01 0.00 0.00 42.92 41.35 1w1h s ASP 427 CO 0.12 -0.32 2.29 0.18 0.21 0.00 0.00 175.17 177.65 1w1h n LEU 428 N 3.54 7.76 -0.01 1.23 4.77 -1.26 -4.24 117.00 128.80 1w1h n LEU 428 Ca 0.06 -4.81 0.00 0.00 -0.03 0.00 0.00 56.01 51.24 1w1h n LEU 428 Cb 0.48 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.18 1w1h n LEU 428 CO 0.54 1.90 0.39 0.00 -1.33 0.00 0.00 177.39 178.89 1w1h n GLN 429 N 2.32 1.68 -3.69 3.23 1.13 -1.26 -5.08 117.38 115.70 1w1h n GLN 429 Ca 0.58 -1.11 -0.31 0.00 -1.94 0.00 0.00 57.00 54.22 1w1h n GLN 429 Cb 0.27 -0.80 -0.04 0.00 0.11 0.00 0.00 30.24 29.78 1w1h n GLN 429 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 1w1h s PHE 430 N -0.62 3.48 0.80 1.08 -0.12 -1.26 -5.11 117.98 116.24 1w1h s PHE 430 Ca 0.01 0.50 -0.12 0.00 -0.05 0.00 0.00 56.93 57.27 1w1h s PHE 430 Cb 0.01 -1.96 0.07 0.00 -0.63 0.00 0.00 43.02 40.51 1w1h s PHE 430 CO 0.00 0.44 1.17 -1.54 -0.05 0.00 0.00 175.22 175.24 1w1h s SER 431 N -2.55 4.57 0.36 1.98 1.04 -1.26 -4.82 113.70 113.02 1w1h s SER 431 Ca 0.40 0.83 0.06 0.00 0.48 0.00 0.00 55.95 57.72 1w1h s SER 431 Cb -0.12 -1.36 0.73 0.00 0.10 0.00 0.00 66.02 65.37 1w1h s SER 431 CO 0.26 -1.87 1.96 -0.33 0.98 0.00 0.00 173.24 174.23 1w1h h GLU 432 N -1.03 0.75 -0.35 4.02 4.39 -1.99 0.56 114.58 120.92 1w1h h GLU 432 Ca -0.46 -0.04 -0.13 0.00 0.34 0.00 0.00 59.36 59.07 1w1h h GLU 432 Cb 1.32 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1w1h h GLU 432 CO 0.66 0.49 -0.29 0.22 -1.16 0.00 0.00 179.01 178.93 1w1h h ASP 433 N 0.77 0.77 0.22 1.42 3.58 -2.01 -2.16 116.42 119.01 1w1h h ASP 433 Ca 0.32 -0.30 -0.13 0.00 0.42 0.00 0.00 57.03 57.33 1w1h h ASP 433 Cb 0.25 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1w1h h ASP 433 CO -0.11 1.01 -0.50 -0.33 -2.88 0.00 0.00 179.24 176.43 1w1h h GLU 434 N 0.64 0.32 -0.50 0.28 5.08 -1.75 -2.70 114.58 115.95 1w1h h GLU 434 Ca 0.08 -0.19 0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1w1h h GLU 434 Cb 0.81 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.02 1w1h h GLU 434 CO 0.07 0.75 0.20 -0.22 -1.00 0.00 0.00 179.01 178.81 1w1h h LYS 435 N 0.26 0.38 -0.61 2.33 3.64 -0.69 0.27 116.57 122.14 1w1h h LYS 435 Ca 0.01 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1w1h h LYS 435 Cb 0.97 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.67 1w1h h LYS 435 CO 0.08 0.25 0.38 -0.09 -2.27 0.00 0.00 179.45 177.80 1w1h h ARG 436 N 0.39 0.72 -0.61 1.90 2.43 -1.11 0.72 114.38 118.81 1w1h h ARG 436 Ca 0.23 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1w1h h ARG 436 Cb 0.22 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1w1h h ARG 436 CO -0.22 0.48 0.15 -0.07 -1.51 0.00 0.00 179.97 178.80 1w1h h LEU 437 N 0.74 0.93 -0.93 3.80 3.38 -1.05 -1.02 115.31 121.16 1w1h h LEU 437 Ca 0.25 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1w1h h LEU 437 Cb 0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1w1h h LEU 437 CO -0.10 0.92 -0.06 -0.07 0.09 0.00 0.00 178.44 179.21 1w1h h LEU 438 N 0.89 0.69 -0.45 1.67 3.38 -0.16 -1.75 115.31 119.58 1w1h h LEU 438 Ca 0.19 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1w1h h LEU 438 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1w1h h LEU 438 CO 0.00 0.80 -0.23 0.25 0.09 0.00 0.00 178.44 179.35 1w1h h LEU 439 N 0.66 0.98 -0.75 1.67 5.85 -0.61 -1.12 115.31 121.99 1w1h h LEU 439 Ca 0.12 -0.41 0.07 0.00 0.84 0.00 0.00 57.88 58.51 1w1h h LEU 439 Cb 0.50 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 1w1h h LEU 439 CO 0.03 1.17 0.43 -0.08 -0.34 0.00 0.00 178.44 179.65 1w1h h GLU 440 N 0.79 0.74 -0.43 1.25 4.81 -1.01 0.17 114.58 120.90 1w1h h GLU 440 Ca 0.10 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1w1h h GLU 440 Cb 0.81 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 1w1h h GLU 440 CO 0.07 0.49 0.04 -0.22 -0.73 0.00 0.00 179.01 178.66 1w1h h LYS 441 N 0.76 0.74 -0.20 1.92 3.64 -1.05 -2.21 116.57 120.18 1w1h h LYS 441 Ca 0.35 -0.22 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1w1h h LYS 441 Cb 0.25 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1w1h h LYS 441 CO -0.21 0.79 0.09 0.37 -2.27 0.00 0.00 179.45 178.22 1w1h h GLN 442 N 0.59 0.19 0.00 1.90 4.15 -0.81 -1.26 115.11 119.87 1w1h h GLN 442 Ca 0.13 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.50 1w1h h GLN 442 Cb 0.43 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1w1h h GLN 442 CO 0.02 0.13 -0.18 0.00 -1.93 0.00 0.00 178.83 176.86 1w1h h ALA 443 N 1.11 1.50 0.00 3.38 0.00 -0.43 -0.48 119.26 124.34 1w1h h ALA 443 Ca 0.08 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1w1h h ALA 443 Cb 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1w1h h ALA 443 CO -0.07 0.22 -1.21 0.78 0.00 0.00 0.00 179.25 178.97 1w1h h GLY 444 N 0.72 0.00 0.00 0.00 0.00 -1.01 -3.43 103.07 99.35 1w1h h GLY 444 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1w1h h GLY 444 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.17 1w1h n GLY 445 N 1.37 0.98 3.43 4.60 0.00 -0.51 -5.01 105.19 110.05 1w1h n GLY 445 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1w1h n GLY 445 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w1h s ASN 446 N -0.43 5.74 0.00 1.61 3.84 -0.21 -4.96 114.94 120.53 1w1h s ASN 446 Ca 0.00 -0.72 0.18 0.00 0.21 0.00 0.00 52.86 52.53 1w1h s ASN 446 Cb 0.00 -2.04 0.85 0.00 -0.55 0.00 0.00 41.25 39.51 1w1h s ASN 446 CO 0.00 -0.29 1.56 -0.81 -2.79 0.00 0.00 177.10 174.77 1w1h n PRO 447 N 5.02 0.15 0.00 0.43 -0.04 -1.26 -1.26 135.00 138.03 1w1h n PRO 447 Ca -0.13 0.15 0.13 0.00 -0.04 0.00 0.00 63.50 63.61 1w1h n PRO 447 Cb 0.48 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.80 1w1h n PRO 447 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1w1h n TRP 448 N -1.38 0.00 -0.30 0.54 7.02 -1.26 -4.38 117.44 117.69 1w1h n TRP 448 Ca 0.07 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.64 1w1h n TRP 448 Cb 0.17 -0.17 0.26 0.00 -2.42 0.00 0.00 31.31 29.15 1w1h n TRP 448 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1w1h h HIS 449 N 0.75 0.69 0.00 -5.99 2.76 -1.48 -1.96 115.15 109.92 1w1h h HIS 449 Ca 0.00 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1w1h h HIS 449 Cb 0.49 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.28 1w1h h HIS 449 CO 0.00 0.07 0.00 0.00 -1.30 0.00 0.00 177.93 176.70 1w1h n GLN 450 N -4.96 0.06 0.00 5.26 10.64 -1.26 -2.30 117.38 124.81 1w1h n GLN 450 Ca 0.19 0.44 0.11 0.00 -1.83 0.00 0.00 57.00 55.91 1w1h n GLN 450 Cb 0.53 -1.65 0.02 0.00 -0.86 0.00 0.00 30.24 28.28 1w1h n GLN 450 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1w1h n PHE 451 N -1.77 0.00 -1.05 2.61 3.72 -0.74 -4.51 117.46 115.73 1w1h n PHE 451 Ca 0.01 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.47 1w1h n PHE 451 Cb 0.09 -0.05 0.26 0.00 -0.94 0.00 0.00 39.48 38.85 1w1h n PHE 451 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1w1h n VAL 452 N -0.89 2.39 -3.50 -4.37 0.24 -0.97 -4.98 118.33 106.25 1w1h n VAL 452 Ca 0.07 -1.95 -0.26 0.00 -2.04 0.00 0.00 64.34 60.16 1w1h n VAL 452 Cb 0.38 -0.27 0.02 0.00 -1.47 0.00 0.00 33.84 32.50 1w1h n VAL 452 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1w1h n GLU 453 N -0.51 -4.75 -1.61 7.34 1.02 -1.26 -0.93 120.64 119.93 1w1h n GLU 453 Ca 0.25 0.64 -0.16 0.00 -0.02 0.00 0.00 57.16 57.87 1w1h n GLU 453 Cb 0.96 -5.47 -0.06 0.00 -0.02 0.00 0.00 31.44 26.85 1w1h n GLU 453 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1w1h n ASN 454 N -2.58 -4.90 -4.83 1.62 5.15 -1.26 -5.00 115.26 103.46 1w1h n ASN 454 Ca -0.01 0.32 -0.37 0.00 -0.60 0.00 0.00 54.58 53.92 1w1h n ASN 454 Cb 0.55 -3.84 -0.06 0.00 -0.53 0.00 0.00 39.78 35.90 1w1h n ASN 454 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1w1h s ASN 455 N -2.73 6.93 0.11 1.20 0.01 -0.11 -5.03 114.94 115.31 1w1h s ASN 455 Ca 0.00 1.16 -0.31 0.00 -0.71 0.00 0.00 52.86 53.00 1w1h s ASN 455 Cb 0.00 -2.32 -0.08 0.00 0.41 0.00 0.00 41.25 39.26 1w1h s ASN 455 CO 0.00 0.18 1.49 -0.22 -1.51 0.00 0.00 177.10 177.03 1w1h s LEU 456 N -1.60 4.36 -0.27 0.60 2.96 -1.26 -4.81 118.68 118.67 1w1h s LEU 456 Ca 0.34 2.42 -0.29 0.00 -0.22 0.00 0.00 54.13 56.38 1w1h s LEU 456 Cb -0.17 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.95 1w1h s LEU 456 CO 0.19 -0.75 1.09 -0.63 -1.32 0.00 0.00 176.35 174.93 1w1h s ILE 457 N 1.53 4.53 -0.12 6.68 1.01 -1.26 -1.09 121.20 132.47 1w1h s ILE 457 Ca 0.68 1.80 0.17 0.00 0.00 0.00 0.00 60.65 63.29 1w1h s ILE 457 Cb -0.39 -4.32 -0.18 0.00 0.01 0.00 0.00 42.46 37.58 1w1h s ILE 457 CO 0.30 -0.34 0.66 0.18 0.00 0.00 0.00 174.94 175.74 1w1h n LEU 458 N 6.70 0.66 -3.64 2.97 4.77 0.76 -4.81 117.00 124.41 1w1h n LEU 458 Ca 0.12 0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 56.29 1w1h n LEU 458 Cb 0.46 0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.63 1w1h n LEU 458 CO 0.57 0.22 0.37 -0.75 -1.33 0.00 0.00 177.39 176.47 1w1h s LYS 459 N -2.87 0.76 0.06 3.23 2.20 -0.99 -0.59 119.74 121.55 1w1h s LYS 459 Ca -0.05 1.10 -0.04 0.00 -0.36 0.00 0.00 55.97 56.62 1w1h s LYS 459 Cb 0.09 0.27 -0.02 0.00 -1.51 0.00 0.00 37.83 36.65 1w1h s LYS 459 CO 0.82 -0.12 0.06 0.00 -0.36 0.00 0.00 175.35 175.75 1w1h s MET 460 N 0.99 0.69 0.00 4.03 0.23 -0.59 -0.89 119.30 123.77 1w1h s MET 460 Ca -0.05 -1.08 0.00 0.00 -1.03 0.00 0.00 55.69 53.53 1w1h s MET 460 Cb -0.05 0.26 0.00 0.00 -1.53 0.00 0.00 34.83 33.51 1w1h s MET 460 CO -0.09 -0.17 0.00 0.41 -2.03 0.00 0.00 175.02 173.14 1w1h n GLY 461 N 0.11 0.63 3.77 3.16 0.00 -0.72 -2.17 105.19 109.96 1w1h n GLY 461 Ca -0.15 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1w1h n GLY 461 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1w1h s PRO 462 N -2.00 4.44 0.03 1.61 0.02 -1.26 -1.44 135.00 136.40 1w1h s PRO 462 Ca 0.00 2.09 -0.02 0.00 0.02 0.00 0.00 61.00 63.09 1w1h s PRO 462 Cb 0.00 -3.11 -0.02 0.00 0.02 0.00 0.00 34.50 31.39 1w1h s PRO 462 CO 0.00 -0.07 0.02 0.14 -0.33 0.00 0.00 177.00 176.76 1w1h s VAL 463 N -1.13 0.14 -0.27 3.83 -7.23 0.07 -4.41 120.40 111.39 1w1h s VAL 463 Ca 0.48 -1.13 -0.14 0.00 -1.81 0.00 0.00 61.98 59.37 1w1h s VAL 463 Cb -0.37 -0.71 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 1w1h s VAL 463 CO 0.49 -0.62 0.34 -1.81 -0.31 0.00 0.00 175.10 173.19 1w1h s ASP 464 N -1.94 6.21 -0.17 4.85 1.01 0.12 0.17 116.67 126.92 1w1h s ASP 464 Ca -0.08 0.21 -0.07 0.00 0.71 0.00 0.00 52.55 53.33 1w1h s ASP 464 Cb -0.04 -2.19 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 1w1h s ASP 464 CO -0.04 -0.17 0.05 -0.75 0.21 0.00 0.00 175.17 174.48 1w1h s LYS 465 N 2.01 3.83 0.23 8.23 2.20 -0.21 -0.92 119.74 135.11 1w1h s LYS 465 Ca 0.13 -0.35 -0.30 0.00 -0.36 0.00 0.00 55.97 55.10 1w1h s LYS 465 Cb -0.16 -3.15 -0.09 0.00 -1.51 0.00 0.00 37.83 32.92 1w1h s LYS 465 CO 0.10 0.35 1.22 0.50 -0.36 0.00 0.00 175.35 177.16 1w1h s ARG 466 N 0.15 4.47 -0.16 4.03 6.06 -0.14 -1.40 118.95 131.97 1w1h s ARG 466 Ca 0.04 1.96 -0.03 0.00 -2.50 0.00 0.00 55.73 55.21 1w1h s ARG 466 Cb -0.12 -3.19 0.05 0.00 0.06 0.00 0.00 34.95 31.75 1w1h s ARG 466 CO 0.01 -0.08 0.05 0.21 -2.50 0.00 0.00 175.30 172.98 1w1h s LYS 467 N -0.74 0.43 6.64 5.12 2.47 0.51 -4.75 119.74 129.43 1w1h s LYS 467 Ca 0.51 -0.18 0.00 0.00 -1.56 0.00 0.00 55.97 54.74 1w1h s LYS 467 Cb -0.35 -1.73 0.00 0.00 -1.46 0.00 0.00 37.83 34.29 1w1h s LYS 467 CO 0.41 -0.57 0.00 0.41 0.16 0.00 0.00 175.35 175.76 1w1h n GLY 468 N 5.15 3.25 0.17 5.54 0.00 -1.26 -2.71 105.19 115.32 1w1h n GLY 468 Ca -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1w1h n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1w1h h LEU 469 N 0.00 0.05 -9.25 0.99 3.38 -2.01 -3.46 115.31 105.01 1w1h h LEU 469 Ca 0.00 -0.02 -0.65 0.00 0.09 0.00 0.00 57.88 57.30 1w1h h LEU 469 Cb 0.00 -0.02 -0.16 0.00 0.09 0.00 0.00 40.66 40.58 1w1h h LEU 469 CO 0.00 0.52 -0.75 -0.36 0.09 0.00 0.00 178.44 177.94 1w1h s PHE 470 N -3.97 2.63 0.04 1.13 0.08 -1.10 -5.08 117.98 111.71 1w1h s PHE 470 Ca -0.03 -0.22 -0.02 0.00 0.12 0.00 0.00 56.93 56.79 1w1h s PHE 470 Cb 0.14 -1.34 -0.04 0.00 -0.57 0.00 0.00 43.02 41.21 1w1h s PHE 470 CO 0.75 0.46 0.23 0.00 -0.10 0.00 0.00 175.22 176.56 1w1h s ALA 471 N -1.45 3.95 0.04 5.36 0.00 -1.26 -0.36 121.76 128.04 1w1h s ALA 471 Ca 0.22 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.47 1w1h s ALA 471 Cb -0.10 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 1w1h s ALA 471 CO 0.14 0.76 -0.10 1.03 0.00 0.00 0.00 175.76 177.59 1w1h s ARG 472 N -2.24 0.68 0.07 0.00 0.52 -0.49 -4.90 118.95 112.60 1w1h s ARG 472 Ca 0.32 -0.67 -0.31 0.00 -0.52 0.00 0.00 55.73 54.55 1w1h s ARG 472 Cb -0.13 -0.60 -0.06 0.00 0.52 0.00 0.00 34.95 34.68 1w1h s ARG 472 CO 0.23 0.14 1.27 0.50 0.02 0.00 0.00 175.30 177.46 1w1h s ARG 473 N -1.17 4.39 0.15 3.54 6.06 -1.26 -1.05 118.95 129.60 1w1h s ARG 473 Ca -0.03 1.87 0.05 0.00 -2.50 0.00 0.00 55.73 55.12 1w1h s ARG 473 Cb -0.08 -3.33 -0.04 0.00 0.06 0.00 0.00 34.95 31.56 1w1h s ARG 473 CO 0.01 -0.33 -0.11 1.03 -2.50 0.00 0.00 175.30 173.40 1w1h s ARG 474 N 1.15 1.06 -0.24 5.12 1.81 0.13 -4.43 118.95 123.55 1w1h s ARG 474 Ca 0.61 -1.43 -0.14 0.00 -1.72 0.00 0.00 55.73 53.05 1w1h s ARG 474 Cb -0.32 -0.67 -0.04 0.00 -0.45 0.00 0.00 34.95 33.47 1w1h s ARG 474 CO 0.29 0.09 0.31 -1.14 -0.68 0.00 0.00 175.30 174.17 1w1h s GLN 475 N -3.60 4.08 -0.18 3.54 2.00 -0.00 -0.75 119.66 124.74 1w1h s GLN 475 Ca 0.16 -0.01 -0.09 0.00 -2.00 0.00 0.00 55.36 53.41 1w1h s GLN 475 Cb 0.01 -3.59 -0.05 0.00 0.80 0.00 0.00 33.01 30.19 1w1h s GLN 475 CO 0.01 -0.10 0.13 -1.17 -0.50 0.00 0.00 175.29 173.66 1w1h s LEU 476 N 1.53 4.24 -0.17 3.68 2.96 -0.52 -0.90 118.68 129.50 1w1h s LEU 476 Ca 0.14 0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 54.32 1w1h s LEU 476 Cb -0.15 -2.08 0.05 0.00 0.50 0.00 0.00 46.19 44.51 1w1h s LEU 476 CO 0.08 0.23 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.54 1w1h s LEU 477 N 0.06 1.62 -0.22 -0.68 1.43 0.05 -1.75 118.68 119.18 1w1h s LEU 477 Ca 0.09 -0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 52.33 1w1h s LEU 477 Cb -0.11 -0.88 -0.04 0.00 0.03 0.00 0.00 46.19 45.19 1w1h s LEU 477 CO -0.01 -0.21 0.32 -0.22 0.23 0.00 0.00 176.35 176.46 1w1h s LEU 478 N 1.65 4.13 0.20 1.79 2.96 -0.06 -1.02 118.68 128.32 1w1h s LEU 478 Ca -0.00 0.36 0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1w1h s LEU 478 Cb -0.16 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.11 1w1h s LEU 478 CO -0.07 -0.05 -0.01 0.42 -1.32 0.00 0.00 176.35 175.32 1w1h s THR 479 N 1.33 0.88 0.75 3.68 -4.23 -0.07 -0.17 115.64 117.81 1w1h s THR 479 Ca 0.15 -2.01 -0.15 0.00 -1.18 0.00 0.00 61.69 58.49 1w1h s THR 479 Cb -0.14 -2.23 0.01 0.00 1.34 0.00 0.00 72.50 71.48 1w1h s THR 479 CO 0.07 -0.41 0.90 -1.84 -0.54 0.00 0.00 174.62 172.81 1w1h n GLU 480 N -0.33 0.38 0.00 3.99 0.28 -0.25 -1.58 120.64 123.13 1w1h n GLU 480 Ca -0.06 0.19 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1w1h n GLU 480 Cb 0.63 -2.17 0.00 0.00 1.43 0.00 0.00 31.44 31.33 1w1h n GLU 480 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1w1h n GLY 481 N 1.12 2.88 3.91 -1.84 0.00 -1.26 -3.76 105.19 106.24 1w1h n GLY 481 Ca 0.12 -0.46 -0.27 0.00 0.00 0.00 0.00 46.02 45.41 1w1h n GLY 481 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1w1h s PRO 482 N 0.00 2.82 0.03 1.61 0.02 -1.26 -5.10 135.00 133.12 1w1h s PRO 482 Ca 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 61.00 61.07 1w1h s PRO 482 Cb 0.00 -2.21 -0.03 0.00 0.02 0.00 0.00 34.50 32.28 1w1h s PRO 482 CO 0.00 -0.83 -0.02 -1.01 -0.33 0.00 0.00 177.00 174.81 1w1h s HIS 483 N -3.10 0.37 -0.29 6.54 3.76 -0.61 -4.75 115.29 117.21 1w1h s HIS 483 Ca 0.55 -0.77 0.01 0.00 -0.15 0.00 0.00 55.06 54.70 1w1h s HIS 483 Cb -0.11 -0.27 0.09 0.00 1.11 0.00 0.00 32.58 33.39 1w1h s HIS 483 CO 0.46 -0.29 0.04 -0.51 -0.85 0.00 0.00 174.74 173.59 1w1h s LEU 484 N -2.17 2.91 0.08 0.89 1.43 -1.26 -0.89 118.68 119.67 1w1h s LEU 484 Ca -0.05 -1.59 -0.02 0.00 -1.03 0.00 0.00 54.13 51.44 1w1h s LEU 484 Cb -0.01 -1.13 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 1w1h s LEU 484 CO -0.05 -0.35 0.27 -0.31 0.23 0.00 0.00 176.35 176.14 1w1h s TYR 485 N 1.39 3.51 -0.05 0.29 2.02 -0.19 -0.58 117.35 123.73 1w1h s TYR 485 Ca 0.05 0.39 0.02 0.00 -0.37 0.00 0.00 57.07 57.16 1w1h s TYR 485 Cb -0.18 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.53 1w1h s TYR 485 CO -0.14 0.54 -0.09 1.52 -1.57 0.00 0.00 175.55 175.81 1w1h s TYR 486 N -1.53 1.16 -0.03 2.71 1.13 -0.59 -0.77 117.35 119.42 1w1h s TYR 486 Ca 0.36 -0.39 0.07 0.00 -1.41 0.00 0.00 57.07 55.70 1w1h s TYR 486 Cb -0.13 -0.89 -0.01 0.00 -1.10 0.00 0.00 41.96 39.83 1w1h s TYR 486 CO 0.25 -0.22 -0.23 0.08 -2.51 0.00 0.00 175.55 172.92 1w1h s VAL 487 N 0.66 1.88 -0.36 -3.49 1.01 -0.07 -0.94 120.40 119.10 1w1h s VAL 487 Ca -0.12 -1.00 -0.29 0.00 0.00 0.00 0.00 61.98 60.57 1w1h s VAL 487 Cb -0.14 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1w1h s VAL 487 CO 0.02 0.53 1.40 -0.62 0.00 0.00 0.00 175.10 176.43 1w1h s ASP 488 N -0.35 6.45 0.39 3.32 -1.08 0.11 -0.82 116.67 124.68 1w1h s ASP 488 Ca 0.03 1.03 0.26 0.00 -0.52 0.00 0.00 52.55 53.35 1w1h s ASP 488 Cb -0.11 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 39.53 1w1h s ASP 488 CO 0.01 -1.30 1.73 1.55 0.52 0.00 0.00 175.17 177.68 1w1h h PRO 489 N 10.26 0.00 0.03 4.34 0.13 -1.87 0.72 132.00 145.61 1w1h h PRO 489 Ca -0.28 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 1w1h h PRO 489 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1w1h h PRO 489 CO 1.06 0.00 -0.81 0.28 -0.23 0.00 0.00 178.00 178.31 1w1h h VAL 490 N 0.00 1.29 -0.01 1.56 2.07 -1.91 -3.37 116.25 115.88 1w1h h VAL 490 Ca 0.00 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.22 1w1h h VAL 490 Cb 0.78 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1w1h h VAL 490 CO 0.00 0.51 -0.29 0.59 0.02 0.00 0.00 177.57 178.40 1w1h n ASN 491 N -4.39 1.08 -3.45 0.57 3.02 -1.23 -4.99 115.26 105.86 1w1h n ASN 491 Ca -0.22 -0.91 -0.20 0.00 -0.03 0.00 0.00 54.58 53.22 1w1h n ASN 491 Cb 0.65 0.17 0.06 0.00 -0.61 0.00 0.00 39.78 40.05 1w1h n ASN 491 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1w1h n LYS 492 N -0.64 -3.18 -3.82 3.52 4.76 0.23 -5.02 118.16 114.02 1w1h n LYS 492 Ca 0.12 0.73 -0.13 0.00 -2.87 0.00 0.00 58.31 56.16 1w1h n LYS 492 Cb 0.36 -5.35 -0.14 0.00 -1.84 0.00 0.00 35.03 28.06 1w1h n LYS 492 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1w1h s VAL 493 N -3.45 -0.01 0.15 -0.18 0.11 -1.14 -4.99 120.40 110.89 1w1h s VAL 493 Ca 0.31 0.05 -0.31 0.00 -2.93 0.00 0.00 61.98 59.10 1w1h s VAL 493 Cb -0.06 -0.15 -0.09 0.00 -1.53 0.00 0.00 36.38 34.55 1w1h s VAL 493 CO 0.78 0.02 1.46 -0.22 -3.33 0.00 0.00 175.10 173.81 1w1h s LEU 494 N 0.32 4.37 -0.12 2.54 2.96 -1.26 -0.71 118.68 126.78 1w1h s LEU 494 Ca -0.02 2.48 0.19 0.00 -0.22 0.00 0.00 54.13 56.56 1w1h s LEU 494 Cb -0.03 -3.59 -0.28 0.00 0.50 0.00 0.00 46.19 42.78 1w1h s LEU 494 CO -0.01 -0.72 0.26 0.29 -1.32 0.00 0.00 176.35 174.85 1w1h n LYS 495 N 3.71 0.71 -3.59 1.98 4.76 -0.11 -4.89 118.16 120.73 1w1h n LYS 495 Ca 0.12 -0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1w1h n LYS 495 Cb 0.41 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 1w1h n LYS 495 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1w1h n GLY 496 N 1.55 -1.67 3.17 0.72 0.00 -1.09 -5.02 105.19 102.85 1w1h n GLY 496 Ca -0.19 -1.11 -0.17 0.00 0.00 0.00 0.00 46.02 44.55 1w1h n GLY 496 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w1h s GLU 497 N -1.50 0.82 -0.23 1.61 2.02 -1.26 -1.55 118.70 118.61 1w1h s GLU 497 Ca 0.00 -1.01 -0.20 0.00 0.02 0.00 0.00 54.97 53.78 1w1h s GLU 497 Cb 0.00 -0.72 -0.02 0.00 0.10 0.00 0.00 34.13 33.48 1w1h s GLU 497 CO 0.00 0.15 0.58 0.42 0.02 0.00 0.00 175.26 176.43 1w1h s ILE 498 N -1.63 5.04 0.07 -1.63 1.01 0.26 -5.00 121.20 119.31 1w1h s ILE 498 Ca 0.00 1.06 -0.31 0.00 0.00 0.00 0.00 60.65 61.40 1w1h s ILE 498 Cb -0.08 -3.90 -0.06 0.00 0.01 0.00 0.00 42.46 38.44 1w1h s ILE 498 CO 0.02 0.09 1.21 -2.16 0.00 0.00 0.00 174.94 174.10 1w1h s PRO 499 N 2.12 4.43 0.15 2.79 0.04 -1.26 -4.07 135.00 139.20 1w1h s PRO 499 Ca 0.25 1.80 -0.19 0.00 0.04 0.00 0.00 61.00 62.90 1w1h s PRO 499 Cb -0.16 -3.33 -0.07 0.00 0.04 0.00 0.00 34.50 30.98 1w1h s PRO 499 CO 0.09 -0.26 0.65 -1.58 0.04 0.00 0.00 177.00 175.94 1w1h s TRP 500 N 1.00 3.74 0.31 0.56 0.52 -1.26 -4.84 118.94 118.96 1w1h s TRP 500 Ca 0.59 1.33 -0.18 0.00 0.02 0.00 0.00 56.10 57.86 1w1h s TRP 500 Cb -0.30 -2.56 0.06 0.00 -1.15 0.00 0.00 33.47 29.52 1w1h s TRP 500 CO 0.30 0.47 0.86 -1.54 0.02 0.00 0.00 176.95 177.06 1w1h s SER 501 N -1.39 -0.02 0.58 2.95 1.04 -1.26 -4.99 113.70 110.60 1w1h s SER 501 Ca 0.36 -0.94 0.29 0.00 0.48 0.00 0.00 55.95 56.14 1w1h s SER 501 Cb -0.18 0.73 1.77 0.00 0.10 0.00 0.00 66.02 68.43 1w1h s SER 501 CO 0.21 -1.44 2.23 0.06 0.98 0.00 0.00 173.24 175.28 1w1h h GLN 502 N 2.00 0.00 -0.00 4.02 -0.00 -1.99 -1.16 115.11 117.98 1w1h h GLN 502 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.35 1w1h h GLN 502 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.72 1w1h h GLN 502 CO 0.37 0.02 -0.07 0.39 -0.00 0.00 0.00 178.83 179.54 1w1h n GLU 503 N -3.81 0.15 -2.05 0.06 1.02 -1.26 -4.84 120.64 109.91 1w1h n GLU 503 Ca -0.03 -0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.68 1w1h n GLU 503 Cb 0.11 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.00 1w1h n GLU 503 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1w1h s LEU 504 N -2.86 4.39 -0.15 -4.62 0.20 -0.44 -4.68 118.68 110.52 1w1h s LEU 504 Ca 0.18 2.63 -0.10 0.00 0.69 0.00 0.00 54.13 57.53 1w1h s LEU 504 Cb 0.19 -3.62 0.05 0.00 -0.43 0.00 0.00 46.19 42.37 1w1h s LEU 504 CO 0.53 -0.66 0.37 0.00 -0.29 0.00 0.00 176.35 176.30 1w1h s ARG 505 N -0.46 0.38 0.38 1.98 1.70 -0.52 -4.95 118.95 117.47 1w1h s ARG 505 Ca 0.58 0.62 -0.09 0.00 -0.47 0.00 0.00 55.73 56.37 1w1h s ARG 505 Cb -0.41 0.07 -0.06 0.00 -0.57 0.00 0.00 34.95 33.98 1w1h s ARG 505 CO 0.43 -0.11 0.73 -1.25 -1.08 0.00 0.00 175.30 174.02 1w1h s PRO 506 N 0.80 3.74 -0.09 3.89 0.04 -1.26 -0.57 135.00 141.56 1w1h s PRO 506 Ca -0.05 0.37 -0.04 0.00 0.04 0.00 0.00 61.00 61.32 1w1h s PRO 506 Cb -0.06 -2.44 0.05 0.00 0.04 0.00 0.00 34.50 32.09 1w1h s PRO 506 CO -0.06 0.01 0.18 -2.00 0.04 0.00 0.00 177.00 175.17 1w1h s GLU 507 N -3.82 0.08 -0.27 4.56 2.12 -0.05 -4.95 118.70 116.37 1w1h s GLU 507 Ca 0.50 0.57 -0.14 0.00 0.36 0.00 0.00 54.97 56.25 1w1h s GLU 507 Cb -0.10 -0.20 -0.04 0.00 0.26 0.00 0.00 34.13 34.05 1w1h s GLU 507 CO 0.31 -0.27 0.35 0.00 -0.54 0.00 0.00 175.26 175.11 1w1h s ALA 508 N 2.06 3.56 0.14 6.30 0.00 -1.26 -0.52 121.76 132.04 1w1h s ALA 508 Ca -0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.07 1w1h s ALA 508 Cb -0.12 -2.68 -0.06 0.00 0.00 0.00 0.00 23.12 20.26 1w1h s ALA 508 CO -0.07 -0.65 1.34 0.87 0.00 0.00 0.00 175.76 177.25 1w1h h LYS 509 N 8.20 0.37 0.00 0.00 1.57 -1.39 -3.49 116.57 121.84 1w1h h LYS 509 Ca -0.32 -0.39 0.02 0.00 -1.87 0.00 0.00 60.65 58.09 1w1h h LYS 509 Cb 1.17 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.58 1w1h h LYS 509 CO 0.63 1.06 0.07 0.27 -0.57 0.00 0.00 179.45 180.91 1w1h n ASN 510 N -3.74 -0.25 0.00 0.86 0.23 -1.15 -4.98 115.26 106.23 1w1h n ASN 510 Ca -0.06 -1.14 0.12 0.00 -0.53 0.00 0.00 54.58 52.97 1w1h n ASN 510 Cb 0.81 0.41 0.67 0.00 -2.08 0.00 0.00 39.78 39.59 1w1h n ASN 510 CO 0.00 0.00 0.00 2.22 -0.93 0.00 0.00 177.26 178.55 1w1h n PHE 511 N -0.09 0.00 -0.04 -2.53 -1.74 -1.26 -3.36 117.46 108.44 1w1h n PHE 511 Ca -0.00 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.84 1w1h n PHE 511 Cb 0.08 -0.07 -0.05 0.00 1.52 0.00 0.00 39.48 40.96 1w1h n PHE 511 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 1w1h n LYS 512 N -1.07 1.95 -4.50 3.97 5.02 -1.26 -0.89 118.16 121.39 1w1h n LYS 512 Ca 0.16 0.02 -0.34 0.00 -2.02 0.00 0.00 58.31 56.13 1w1h n LYS 512 Cb 0.11 -1.17 -0.12 0.00 -0.02 0.00 0.00 35.03 33.82 1w1h n LYS 512 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1w1h s THR 513 N -2.16 3.73 0.03 -0.18 2.01 -1.21 0.86 115.64 118.71 1w1h s THR 513 Ca -0.06 -0.42 -0.10 0.00 0.31 0.00 0.00 61.69 61.41 1w1h s THR 513 Cb 0.02 -2.61 0.01 0.00 0.01 0.00 0.00 72.50 69.93 1w1h s THR 513 CO 0.25 0.51 0.21 0.72 -0.69 0.00 0.00 174.62 175.62 1w1h s PHE 514 N 0.19 0.02 0.11 4.92 -0.71 -0.58 -0.89 117.98 121.04 1w1h s PHE 514 Ca -0.03 -0.20 0.08 0.00 -1.04 0.00 0.00 56.93 55.74 1w1h s PHE 514 Cb -0.14 -0.00 -0.04 0.00 -1.21 0.00 0.00 43.02 41.63 1w1h s PHE 514 CO 0.03 -0.43 -0.15 -0.06 -1.34 0.00 0.00 175.22 173.27 1w1h s PHE 515 N -2.42 2.61 -0.25 3.49 0.08 0.33 -0.87 117.98 120.95 1w1h s PHE 515 Ca -0.06 -0.22 0.02 0.00 0.12 0.00 0.00 56.93 56.78 1w1h s PHE 515 Cb -0.02 -1.39 0.05 0.00 -0.57 0.00 0.00 43.02 41.09 1w1h s PHE 515 CO -0.03 0.39 -0.11 0.08 -0.10 0.00 0.00 175.22 175.46 1w1h s VAL 516 N -1.16 2.33 -0.11 -0.44 1.01 -0.23 -0.87 120.40 120.94 1w1h s VAL 516 Ca 0.19 -1.42 -0.19 0.00 0.00 0.00 0.00 61.98 60.57 1w1h s VAL 516 Cb -0.11 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1w1h s VAL 516 CO 0.11 0.09 0.51 -1.00 0.00 0.00 0.00 175.10 174.81 1w1h s HIS 517 N 1.18 3.53 0.14 5.22 3.76 0.27 -0.77 115.29 128.61 1w1h s HIS 517 Ca -0.05 0.94 0.04 0.00 -0.15 0.00 0.00 55.06 55.84 1w1h s HIS 517 Cb -0.18 -2.58 -0.04 0.00 1.11 0.00 0.00 32.58 30.88 1w1h s HIS 517 CO -0.06 0.17 -0.09 0.95 -0.85 0.00 0.00 174.74 174.85 1w1h s THR 518 N 0.61 1.09 0.29 1.30 -4.23 -0.42 -1.44 115.64 112.84 1w1h s THR 518 Ca 0.27 -2.04 0.04 0.00 -1.18 0.00 0.00 61.69 58.78 1w1h s THR 518 Cb -0.15 -1.83 0.29 0.00 1.34 0.00 0.00 72.50 72.14 1w1h s THR 518 CO 0.11 -0.76 1.77 -0.65 -0.54 0.00 0.00 174.62 174.55 1w1h h PRO 519 N 2.80 0.69 -0.01 3.99 0.11 -1.93 -2.31 132.00 135.34 1w1h h PRO 519 Ca -0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1w1h h PRO 519 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1w1h h PRO 519 CO 0.64 0.46 -0.59 -1.71 -0.21 0.00 0.00 178.00 176.59 1w1h n ASN 520 N -4.81 1.25 -3.64 -2.05 5.15 -1.26 -4.97 115.26 104.93 1w1h n ASN 520 Ca 0.22 -1.01 -0.06 0.00 -0.60 0.00 0.00 54.58 53.13 1w1h n ASN 520 Cb 0.55 0.52 -0.07 0.00 -0.53 0.00 0.00 39.78 40.24 1w1h n ASN 520 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1w1h s ARG 521 N -2.73 0.39 -0.14 1.20 3.52 -0.87 -5.14 118.95 115.19 1w1h s ARG 521 Ca 0.15 0.53 -0.06 0.00 -0.13 0.00 0.00 55.73 56.23 1w1h s ARG 521 Cb 0.18 0.16 -0.04 0.00 -1.56 0.00 0.00 34.95 33.69 1w1h s ARG 521 CO 0.67 -0.06 0.07 0.99 -0.81 0.00 0.00 175.30 176.16 1w1h s THR 522 N 0.55 4.87 -0.15 4.11 2.01 -1.26 -1.30 115.64 124.46 1w1h s THR 522 Ca -0.00 -0.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.90 1w1h s THR 522 Cb -0.05 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.29 1w1h s THR 522 CO -0.10 0.55 0.10 -0.31 -0.69 0.00 0.00 174.62 174.16 1w1h s TYR 523 N -0.38 3.39 -0.28 4.92 1.51 0.05 -4.96 117.35 121.60 1w1h s TYR 523 Ca 0.09 0.30 -0.03 0.00 -1.01 0.00 0.00 57.07 56.43 1w1h s TYR 523 Cb -0.12 -2.02 0.04 0.00 -0.11 0.00 0.00 41.96 39.75 1w1h s TYR 523 CO 0.02 0.42 -0.00 0.71 -1.11 0.00 0.00 175.55 175.58 1w1h s TYR 524 N -0.24 3.18 0.17 2.71 2.02 -1.26 -1.06 117.35 122.87 1w1h s TYR 524 Ca 0.09 -1.61 0.09 0.00 -0.37 0.00 0.00 57.07 55.27 1w1h s TYR 524 Cb -0.12 -2.12 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 1w1h s TYR 524 CO 0.01 -0.74 -0.19 -0.51 -1.57 0.00 0.00 175.55 172.55 1w1h s LEU 525 N 1.32 2.44 -0.02 -1.29 1.43 -0.05 -0.96 118.68 121.54 1w1h s LEU 525 Ca -0.02 -0.87 0.01 0.00 -1.03 0.00 0.00 54.13 52.22 1w1h s LEU 525 Cb -0.18 -0.86 0.02 0.00 0.03 0.00 0.00 46.19 45.20 1w1h s LEU 525 CO -0.02 -0.02 -0.02 -0.04 0.23 0.00 0.00 176.35 176.48 1w1h s MET 526 N -2.82 0.40 -0.47 1.70 -1.94 -0.09 -1.53 119.30 114.56 1w1h s MET 526 Ca 0.17 -0.02 -0.17 0.00 -1.71 0.00 0.00 55.69 53.96 1w1h s MET 526 Cb -0.06 -0.49 0.05 0.00 2.01 0.00 0.00 34.83 36.34 1w1h s MET 526 CO 0.07 -0.06 0.45 0.34 -0.01 0.00 0.00 175.02 175.81 1w1h s ASP 527 N 0.68 6.17 0.00 3.03 -1.08 0.25 -0.70 116.67 125.02 1w1h s ASP 527 Ca -0.07 -1.06 0.08 0.00 -0.52 0.00 0.00 52.55 50.97 1w1h s ASP 527 Cb -0.10 -2.21 0.39 0.00 -1.46 0.00 0.00 42.92 39.53 1w1h s ASP 527 CO -0.01 -0.67 1.14 -0.81 0.52 0.00 0.00 175.17 175.33 1w1h n PRO 528 N 5.51 0.09 0.00 4.34 -0.04 -1.26 -1.32 135.00 142.32 1w1h n PRO 528 Ca -0.10 0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.72 1w1h n PRO 528 Cb 0.45 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.60 1w1h n PRO 528 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1w1h n SER 529 N -1.32 1.33 -1.87 3.54 3.41 -1.26 -4.99 113.62 112.46 1w1h n SER 529 Ca 0.03 -1.06 -0.15 0.00 -0.26 0.00 0.00 58.87 57.43 1w1h n SER 529 Cb 0.07 0.34 0.01 0.00 -0.26 0.00 0.00 64.21 64.37 1w1h n SER 529 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w1h n GLY 530 N 1.40 -0.20 2.13 5.00 0.00 -0.44 -4.95 105.19 108.14 1w1h n GLY 530 Ca 0.10 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 1w1h n GLY 530 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1w1h n ASN 531 N -0.96 4.76 -0.16 1.61 3.02 -1.03 -4.70 115.26 117.79 1w1h n ASN 531 Ca -0.13 -3.68 0.11 0.00 -0.03 0.00 0.00 54.58 50.85 1w1h n ASN 531 Cb 0.61 -0.37 0.44 0.00 -0.61 0.00 0.00 39.78 39.85 1w1h n ASN 531 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w1h h ALA 532 N 2.27 1.93 -0.46 5.41 0.00 -1.29 -1.74 119.26 125.38 1w1h h ALA 532 Ca 0.34 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 1w1h h ALA 532 Cb 1.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1w1h h ALA 532 CO 0.76 -0.10 0.06 0.45 0.00 0.00 0.00 179.25 180.41 1w1h h HIS 533 N 0.55 0.75 -0.40 0.00 3.86 -1.83 -0.44 115.15 117.64 1w1h h HIS 533 Ca 0.34 -0.08 -0.13 0.00 -1.16 0.00 0.00 60.37 59.35 1w1h h HIS 533 Cb 0.59 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.83 1w1h h HIS 533 CO -0.00 0.67 -0.27 0.87 0.86 0.00 0.00 177.93 180.06 1w1h h LYS 534 N 0.69 0.83 -0.02 2.45 1.57 -1.72 0.11 116.57 120.48 1w1h h LYS 534 Ca 0.15 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1w1h h LYS 534 Cb 0.34 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1w1h h LYS 534 CO 0.01 1.00 0.00 -1.49 -0.57 0.00 0.00 179.45 178.40 1w1h h TRP 535 N 0.71 0.00 -0.70 -1.35 4.06 -1.06 -1.36 115.95 116.26 1w1h h TRP 535 Ca 0.09 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.03 1w1h h TRP 535 Cb 0.81 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.94 1w1h h TRP 535 CO 0.05 0.00 0.38 0.00 -3.56 0.00 0.00 178.44 175.31 1w1h h ARG 537 N 0.96 0.37 -0.26 0.00 2.43 -0.69 -0.83 114.38 116.36 1w1h h ARG 537 Ca 0.25 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.25 1w1h h ARG 537 Cb 0.04 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1w1h h ARG 537 CO -0.04 0.25 -0.42 -0.22 -1.51 0.00 0.00 179.97 178.03 1w1h h LYS 538 N 0.38 0.64 -0.34 0.20 1.63 -1.09 0.60 116.57 118.59 1w1h h LYS 538 Ca 0.11 -0.33 -0.02 0.00 -0.85 0.00 0.00 60.65 59.56 1w1h h LYS 538 Cb -0.03 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1w1h h LYS 538 CO -0.04 0.94 0.15 0.82 -3.45 0.00 0.00 179.45 177.87 1w1h h ILE 539 N 0.52 1.17 -0.93 2.00 2.04 -1.18 -1.21 117.51 119.92 1w1h h ILE 539 Ca 0.04 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.40 1w1h h ILE 539 Cb 0.94 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.85 1w1h h ILE 539 CO 0.08 0.18 0.61 1.56 0.00 0.00 0.00 178.15 180.58 1w1h h GLN 540 N 0.41 1.23 -0.74 2.37 1.08 -0.85 0.12 115.11 118.74 1w1h h GLN 540 Ca 0.12 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 1w1h h GLN 540 Cb 0.14 -0.27 -0.04 0.00 -0.05 0.00 0.00 27.48 27.27 1w1h h GLN 540 CO -0.01 0.82 0.43 1.49 -0.95 0.00 0.00 178.83 180.61 1w1h h GLU 541 N 1.26 1.02 -0.44 1.46 4.81 -0.48 0.51 114.58 122.72 1w1h h GLU 541 Ca 0.34 -0.11 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1w1h h GLU 541 Cb -0.13 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.03 1w1h h GLU 541 CO -0.07 0.74 -0.06 0.28 -0.73 0.00 0.00 179.01 179.17 1w1h h VAL 542 N 1.02 1.27 -0.23 0.32 2.07 -0.84 -1.40 116.25 118.45 1w1h h VAL 542 Ca 0.26 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1w1h h VAL 542 Cb -0.00 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 1w1h h VAL 542 CO -0.05 0.39 -0.11 -0.25 0.02 0.00 0.00 177.57 177.57 1w1h h TRP 543 N 0.64 -0.26 -0.86 1.57 7.01 -0.35 -0.43 115.95 123.28 1w1h h TRP 543 Ca 0.12 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.15 1w1h h TRP 543 Cb 0.58 0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 27.74 1w1h h TRP 543 CO 0.04 -0.17 0.56 0.00 -2.79 0.00 0.00 178.44 176.09 1w1h h ARG 544 N -0.08 1.15 -0.49 2.65 3.08 -0.70 0.19 114.38 120.18 1w1h h ARG 544 Ca 0.12 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1w1h h ARG 544 Cb 0.26 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1w1h h ARG 544 CO -0.28 0.77 0.31 0.37 -1.07 0.00 0.00 179.97 180.07 1w1h h GLN 545 N 1.18 0.65 0.09 0.04 4.15 -0.89 -1.48 115.11 118.84 1w1h h GLN 545 Ca 0.32 -0.05 -0.16 0.00 0.77 0.00 0.00 58.65 59.53 1w1h h GLN 545 Cb -0.12 -0.14 0.02 0.00 0.21 0.00 0.00 27.48 27.45 1w1h h GLN 545 CO -0.07 0.45 -0.68 -0.09 -1.93 0.00 0.00 178.83 176.52 1w1h h ARG 546 N 0.65 0.30 0.02 1.69 9.65 -0.56 -2.54 114.38 123.60 1w1h h ARG 546 Ca 0.18 -0.44 -0.37 0.00 -1.10 0.00 0.00 59.98 58.24 1w1h h ARG 546 Cb -0.04 0.15 -0.06 0.00 -1.39 0.00 0.00 29.97 28.63 1w1h h ARG 546 CO -0.04 1.17 -2.29 0.66 2.80 0.00 0.00 179.97 182.28 1w1h n TYR 547 N -4.20 0.29 -0.02 2.20 4.01 0.01 -3.13 117.16 116.31 1w1h n TYR 547 Ca -0.12 0.08 -0.11 0.00 -0.16 0.00 0.00 57.90 57.59 1w1h n TYR 547 Cb 0.74 -1.04 -0.09 0.00 -0.31 0.00 0.00 39.34 38.64 1w1h n TYR 547 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1w1h h GLN 548 N 0.01 -0.06 0.00 -0.72 4.20 -1.43 -3.38 115.11 113.73 1w1h h GLN 548 Ca -0.51 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 57.96 1w1h h GLN 548 Cb 2.05 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 29.81 1w1h h GLN 548 CO -0.00 0.57 -1.49 0.77 -0.67 0.00 0.00 178.83 178.00 1w1h h SER 549 N -0.88 0.00 -1.39 1.46 0.02 -1.31 -3.40 113.55 108.04 1w1h h SER 549 Ca -0.01 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.47 1w1h h SER 549 Cb 0.66 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.79 1w1h h SER 549 CO 0.01 0.88 -1.00 1.41 -1.14 0.00 0.00 176.83 176.99 1w1h n HIS 550 N -3.06 2.04 -1.79 3.45 8.25 -0.97 -5.02 115.22 118.12 1w1h n HIS 550 Ca -0.12 -3.11 -0.33 0.00 -0.26 0.00 0.00 57.72 53.90 1w1h n HIS 550 Cb 0.97 -0.29 0.04 0.00 1.12 0.00 0.00 29.99 31.83 1w1h n HIS 550 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1w1h s PRO 551 N -3.21 2.93 -1.35 -0.41 0.04 -1.22 -4.21 135.00 127.56 1w1h s PRO 551 Ca 0.37 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.61 1w1h s PRO 551 Cb 0.41 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 33.00 1w1h s PRO 551 CO -0.07 -1.13 1.04 -3.47 0.04 0.00 0.00 177.00 173.42 1w1h n ASP 552 N -2.46 -4.45 -4.75 6.66 4.64 -1.26 -4.96 116.55 109.98 1w1h n ASP 552 Ca 0.09 -0.64 -0.38 0.00 -1.38 0.00 0.00 54.79 52.48 1w1h n ASP 552 Cb 0.52 -4.69 0.04 0.00 -1.04 0.00 0.00 41.12 35.95 1w1h n ASP 552 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1w1h s ALA 553 N -3.37 2.75 0.34 -1.67 0.00 -1.26 -4.98 121.76 113.58 1w1h s ALA 553 Ca 0.40 1.28 -0.29 0.00 0.00 0.00 0.00 51.96 53.35 1w1h s ALA 553 Cb -0.19 -3.55 -0.11 0.00 0.00 0.00 0.00 23.12 19.28 1w1h s ALA 553 CO 0.76 -1.35 1.51 0.00 0.00 0.00 0.00 175.76 176.68 1w1h s ALA 554 N -1.35 3.63 -1.40 0.00 0.00 -1.26 -4.94 121.76 116.44 1w1h s ALA 554 Ca 0.73 1.55 0.16 0.00 0.00 0.00 0.00 51.96 54.41 1w1h s ALA 554 Cb -0.39 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.09 1w1h s ALA 554 CO 0.45 -1.00 0.84 1.33 0.00 0.00 0.00 175.76 177.38 1w1h n VAL 555 N 1.10 0.00 -1.34 0.00 0.24 -1.26 -5.28 118.33 111.79 1w1h n VAL 555 Ca 0.03 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1w1h n VAL 555 Cb 0.39 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.92 1w1h n VAL 555 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69