#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wel s SER 406 N 0.00 -0.14 -0.01 1.61 1.04 -1.25 -3.27 113.70 111.68 1wel s SER 406 Ca 0.00 0.09 0.02 0.00 0.48 0.00 0.00 55.95 56.54 1wel s SER 406 Cb 0.00 0.33 -0.00 0.00 0.10 0.00 0.00 66.02 66.45 1wel s SER 406 CO 0.00 -0.35 -0.08 -0.55 0.98 0.00 0.00 173.24 173.24 1wel s SER 407 N -1.05 0.97 -0.90 7.02 0.15 -1.26 -4.95 113.70 113.68 1wel s SER 407 Ca -0.11 -0.15 -0.33 0.00 0.70 0.00 0.00 55.95 56.06 1wel s SER 407 Cb -0.05 -0.17 -0.21 0.00 -1.71 0.00 0.00 66.02 63.88 1wel s SER 407 CO 0.03 0.08 2.60 0.61 1.20 0.00 0.00 173.24 177.76 1wel n GLY 408 N 3.05 -0.40 3.45 9.45 0.00 -1.26 -4.87 105.19 114.61 1wel n GLY 408 Ca -0.15 1.13 -0.38 0.00 0.00 0.00 0.00 46.02 46.62 1wel n GLY 408 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wel s SER 409 N 8.67 5.52 0.03 1.61 0.01 -1.26 -5.08 113.70 123.20 1wel s SER 409 Ca 1.32 -0.44 -0.20 0.00 1.31 0.00 0.00 55.95 57.94 1wel s SER 409 Cb -1.25 -2.00 -0.06 0.00 0.21 0.00 0.00 66.02 62.92 1wel s SER 409 CO 0.51 -0.16 0.57 -0.44 0.41 0.00 0.00 173.24 174.12 1wel s SER 410 N 1.62 7.00 0.15 2.44 0.01 -1.26 -5.05 113.70 118.62 1wel s SER 410 Ca 0.05 1.19 -0.21 0.00 1.31 0.00 0.00 55.95 58.29 1wel s SER 410 Cb -0.17 -2.35 0.07 0.00 0.21 0.00 0.00 66.02 63.78 1wel s SER 410 CO 0.06 0.20 0.99 0.61 0.41 0.00 0.00 173.24 175.51 1wel n GLY 411 N 2.07 0.60 3.60 3.44 0.00 -1.26 -5.15 105.19 108.49 1wel n GLY 411 Ca -0.09 -1.12 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 1wel n GLY 411 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wel s LYS 412 N -2.04 3.93 -0.24 1.61 -2.85 -1.26 -5.08 119.74 113.81 1wel s LYS 412 Ca 0.22 -0.36 -0.21 0.00 -1.00 0.00 0.00 55.97 54.63 1wel s LYS 412 Cb -0.02 -3.33 0.06 0.00 -2.06 0.00 0.00 37.83 32.48 1wel s LYS 412 CO 0.04 0.11 0.63 0.45 0.10 0.00 0.00 175.35 176.68 1wel s SER 413 N 0.85 -0.67 1.17 0.03 0.15 -1.26 -5.17 113.70 108.80 1wel s SER 413 Ca 0.05 1.28 -0.18 0.00 0.70 0.00 0.00 55.95 57.79 1wel s SER 413 Cb -0.13 1.28 0.27 0.00 -1.71 0.00 0.00 66.02 65.73 1wel s SER 413 CO 0.03 -0.22 1.11 -2.16 1.20 0.00 0.00 173.24 173.19 1wel s PRO 414 N 0.46 -0.99 0.09 5.44 0.04 -1.26 -5.09 135.00 133.69 1wel s PRO 414 Ca -0.01 0.03 0.03 0.00 0.04 0.00 0.00 61.00 61.09 1wel s PRO 414 Cb -0.05 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.85 1wel s PRO 414 CO -0.01 -3.58 -0.09 0.45 0.04 0.00 0.00 177.00 173.81 1wel s SER 415 N -3.81 1.32 0.00 6.66 0.15 -1.26 -5.15 113.70 111.61 1wel s SER 415 Ca 0.70 -0.79 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1wel s SER 415 Cb -0.11 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 1wel s SER 415 CO 0.56 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.34 1wel n GLY 416 N 0.64 2.54 3.89 9.45 0.00 -1.26 -5.15 105.19 115.30 1wel n GLY 416 Ca -0.17 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 1wel n GLY 416 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wel s GLN 417 N -2.00 3.70 0.13 1.61 -2.07 -1.26 -5.10 119.66 114.67 1wel s GLN 417 Ca 0.00 0.08 0.09 0.00 -1.82 0.00 0.00 55.36 53.71 1wel s GLN 417 Cb 0.00 -2.74 -0.04 0.00 -1.09 0.00 0.00 33.01 29.14 1wel s GLN 417 CO 0.00 0.38 -0.21 0.21 -1.32 0.00 0.00 175.29 174.34 1wel s LYS 418 N -2.82 1.24 -0.07 9.60 2.47 -1.26 -5.14 119.74 123.76 1wel s LYS 418 Ca 0.44 -1.28 0.04 0.00 -1.56 0.00 0.00 55.97 53.61 1wel s LYS 418 Cb -0.12 -1.49 0.00 0.00 -1.46 0.00 0.00 37.83 34.76 1wel s LYS 418 CO 0.24 0.34 -0.19 1.03 0.16 0.00 0.00 175.35 176.92 1wel s ARG 419 N -2.21 2.23 -1.01 4.03 1.81 -1.26 -5.07 118.95 117.46 1wel s ARG 419 Ca 0.11 -0.67 -0.23 0.00 -1.72 0.00 0.00 55.73 53.22 1wel s ARG 419 Cb -0.09 -1.80 0.03 0.00 -0.45 0.00 0.00 34.95 32.64 1wel s ARG 419 CO 0.06 0.18 1.55 -1.54 -0.68 0.00 0.00 175.30 174.86 1wel s SER 420 N 0.28 6.28 0.13 0.23 1.04 -1.26 -4.86 113.70 115.55 1wel s SER 420 Ca -0.11 -1.36 -0.29 0.00 0.48 0.00 0.00 55.95 54.66 1wel s SER 420 Cb -0.15 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.35 1wel s SER 420 CO 0.05 -1.71 1.58 0.03 0.98 0.00 0.00 173.24 174.16 1wel h ARG 421 N 9.96 -0.46 -6.49 4.02 2.47 -2.06 -3.40 114.38 118.41 1wel h ARG 421 Ca 0.19 0.03 -0.58 0.00 -1.26 0.00 0.00 59.98 58.36 1wel h ARG 421 Cb 1.00 0.11 0.05 0.00 -1.65 0.00 0.00 29.97 29.48 1wel h ARG 421 CO 1.39 -0.31 0.83 -1.13 0.56 0.00 0.00 179.97 181.31 1wel n SER 422 N -5.43 3.14 0.22 7.04 3.41 -1.26 -4.92 113.62 115.81 1wel n SER 422 Ca -0.04 1.07 -0.10 0.00 -0.26 0.00 0.00 58.87 59.55 1wel n SER 422 Cb 0.36 -1.42 -0.05 0.00 -0.26 0.00 0.00 64.21 62.84 1wel n SER 422 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1wel h ARG 423 N 6.24 -0.60 -3.36 4.33 2.43 -2.04 -3.49 114.38 117.90 1wel h ARG 423 Ca -0.45 0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 58.68 1wel h ARG 423 Cb 1.25 0.14 0.05 0.00 -0.42 0.00 0.00 29.97 30.99 1wel h ARG 423 CO 0.89 -0.40 -0.23 0.45 -1.51 0.00 0.00 179.97 179.17 1wel n SER 424 N -5.17 -2.65 -0.04 -3.80 2.88 -1.26 -4.98 113.62 98.59 1wel n SER 424 Ca -0.08 -0.19 -0.09 0.00 -1.33 0.00 0.00 58.87 57.18 1wel n SER 424 Cb 0.25 -1.82 0.06 0.00 -0.75 0.00 0.00 64.21 61.95 1wel n SER 424 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1wel h PRO 425 N -0.42 0.68 -5.92 -1.46 0.13 -2.03 -3.44 132.00 119.54 1wel h PRO 425 Ca -0.17 -0.36 -0.66 0.00 -0.87 0.00 0.00 66.00 63.94 1wel h PRO 425 Cb 1.09 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 32.13 1wel h PRO 425 CO 0.13 0.97 -0.56 -1.01 -0.23 0.00 0.00 178.00 177.30 1wel s HIS 426 N -4.26 3.33 0.04 1.56 3.76 -1.26 -5.11 115.29 113.34 1wel s HIS 426 Ca -0.09 0.27 0.05 0.00 -0.15 0.00 0.00 55.06 55.14 1wel s HIS 426 Cb 0.12 -1.79 -0.04 0.00 1.11 0.00 0.00 32.58 31.99 1wel s HIS 426 CO 0.84 0.57 -0.09 -1.21 -0.85 0.00 0.00 174.74 174.01 1wel s GLU 427 N -1.46 2.39 -0.11 1.40 8.01 -1.26 -5.03 118.70 122.63 1wel s GLU 427 Ca 0.20 -0.84 -0.07 0.00 0.01 0.00 0.00 54.97 54.27 1wel s GLU 427 Cb -0.12 -2.41 -0.05 0.00 -4.31 0.00 0.00 34.13 27.24 1wel s GLU 427 CO 0.10 0.57 -0.17 0.00 0.01 0.00 0.00 175.26 175.77 1wel n ALA 428 N 1.30 2.10 -2.73 5.21 0.00 -1.26 -5.05 120.51 120.09 1wel n ALA 428 Ca -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1wel n ALA 428 Cb 0.52 0.29 0.00 0.00 0.00 0.00 0.00 19.45 20.26 1wel n ALA 428 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wel n GLY 429 N 2.25 4.02 2.67 0.00 0.00 -1.26 -4.89 105.19 107.98 1wel n GLY 429 Ca -0.22 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 1wel n GLY 429 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wel s PHE 430 N -0.13 1.40 0.36 1.61 0.08 -1.26 -4.69 117.98 115.35 1wel s PHE 430 Ca 0.00 -1.65 0.04 0.00 0.12 0.00 0.00 56.93 55.44 1wel s PHE 430 Cb 0.00 -1.52 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 1wel s PHE 430 CO 0.00 -0.85 0.13 0.00 -0.10 0.00 0.00 175.22 174.39 1wel s VAL 432 N -3.36 -0.02 -0.24 0.00 -7.23 0.56 -3.94 120.40 106.18 1wel s VAL 432 Ca 0.30 0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 60.42 1wel s VAL 432 Cb 0.05 -0.40 -0.05 0.00 0.56 0.00 0.00 36.38 36.54 1wel s VAL 432 CO 0.16 0.03 0.19 -0.47 -0.31 0.00 0.00 175.10 174.69 1wel s TYR 433 N 0.66 3.31 -0.06 2.82 5.04 0.38 -2.08 117.35 127.42 1wel s TYR 433 Ca -0.04 0.26 0.03 0.00 -2.44 0.00 0.00 57.07 54.87 1wel s TYR 433 Cb -0.06 -2.30 -0.03 0.00 0.35 0.00 0.00 41.96 39.92 1wel s TYR 433 CO -0.04 0.04 -0.13 -0.51 -1.34 0.00 0.00 175.55 173.57 1wel s LEU 434 N 1.14 2.82 -0.07 6.97 1.43 -0.25 -1.51 118.68 129.21 1wel s LEU 434 Ca 0.09 -0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 1wel s LEU 434 Cb -0.14 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.53 1wel s LEU 434 CO 0.05 0.33 0.01 -0.54 0.23 0.00 0.00 176.35 176.43 1wel s LYS 435 N -0.64 0.56 0.00 1.70 1.02 -0.76 -1.34 119.74 120.27 1wel s LYS 435 Ca 0.10 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.21 1wel s LYS 435 Cb -0.11 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.25 1wel s LYS 435 CO 0.01 -0.31 0.00 0.41 -0.92 0.00 0.00 175.35 174.55 1wel n GLY 436 N 5.16 1.18 2.28 -3.33 0.00 -0.91 0.24 105.19 109.80 1wel n GLY 436 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1wel n GLY 436 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wel n LEU 437 N 0.00 -2.78 -4.71 0.99 4.77 -1.26 -4.56 117.00 109.46 1wel n LEU 437 Ca 0.00 0.43 -0.29 0.00 -0.03 0.00 0.00 56.01 56.11 1wel n LEU 437 Cb 0.00 -0.59 0.15 0.00 -2.33 0.00 0.00 43.42 40.64 1wel n LEU 437 CO 0.00 -3.49 0.66 -2.16 -1.33 0.00 0.00 177.39 171.07 1wel s PRO 438 N -0.79 1.02 0.13 3.23 0.04 -1.26 -4.48 135.00 132.89 1wel s PRO 438 Ca 0.39 0.74 -0.15 0.00 0.04 0.00 0.00 61.00 62.02 1wel s PRO 438 Cb -0.33 -1.79 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 1wel s PRO 438 CO 0.48 -2.38 1.64 0.74 0.04 0.00 0.00 177.00 177.52 1wel h PHE 439 N -1.65 0.69 -0.97 0.56 0.04 -1.91 -2.87 116.94 110.84 1wel h PHE 439 Ca -0.51 -0.08 -0.59 0.00 2.80 0.00 0.00 57.97 59.59 1wel h PHE 439 Cb 1.30 -0.20 -0.29 0.00 2.20 0.00 0.00 35.95 38.96 1wel h PHE 439 CO 0.39 0.65 0.76 -0.85 -0.60 0.00 0.00 178.31 178.66 1wel n GLU 440 N -4.55 2.46 -0.67 1.51 0.28 -1.26 -0.18 120.64 118.23 1wel n GLU 440 Ca -0.00 -3.08 -0.28 0.00 -0.16 0.00 0.00 57.16 53.64 1wel n GLU 440 Cb 0.20 -2.21 0.23 0.00 1.43 0.00 0.00 31.44 31.10 1wel n GLU 440 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wel s ALA 441 N -3.50 -0.14 0.02 -1.84 0.00 -1.09 -5.07 121.76 110.14 1wel s ALA 441 Ca 0.60 -0.15 -0.21 0.00 0.00 0.00 0.00 51.96 52.20 1wel s ALA 441 Cb 0.48 -3.23 0.04 0.00 0.00 0.00 0.00 23.12 20.42 1wel s ALA 441 CO 0.04 -3.62 0.48 -1.21 0.00 0.00 0.00 175.76 171.44 1wel s GLU 442 N -4.57 0.94 0.31 0.00 2.02 -1.26 -5.01 118.70 111.13 1wel s GLU 442 Ca 0.68 -0.19 0.14 0.00 0.02 0.00 0.00 54.97 55.63 1wel s GLU 442 Cb -0.24 0.43 1.04 0.00 0.10 0.00 0.00 34.13 35.47 1wel s GLU 442 CO 0.63 -0.32 1.35 0.09 0.02 0.00 0.00 175.26 177.03 1wel n ASN 443 N 0.67 0.21 -0.14 -0.19 4.13 -1.26 0.18 115.26 118.85 1wel n ASN 443 Ca -0.19 1.43 -0.05 0.00 1.68 0.00 0.00 54.58 57.45 1wel n ASN 443 Cb 0.59 -0.66 0.04 0.00 -1.54 0.00 0.00 39.78 38.21 1wel n ASN 443 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 1wel h LYS 444 N 0.00 0.40 -0.62 3.52 2.10 -1.99 0.13 116.57 120.11 1wel h LYS 444 Ca 0.68 -0.02 0.09 0.00 -2.00 0.00 0.00 60.65 59.40 1wel h LYS 444 Cb 1.74 -0.09 -0.07 0.00 -0.90 0.00 0.00 32.23 32.91 1wel h LYS 444 CO -0.69 0.26 0.25 0.45 -2.00 0.00 0.00 179.45 177.73 1wel h HIS 445 N 0.41 0.44 -0.19 0.07 3.86 0.15 -1.50 115.15 118.39 1wel h HIS 445 Ca 0.20 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.40 1wel h HIS 445 Cb 0.14 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1wel h HIS 445 CO -0.12 0.13 -0.04 0.28 0.86 0.00 0.00 177.93 179.04 1wel h VAL 446 N 0.45 1.28 0.08 2.45 2.07 -1.21 -2.97 116.25 118.40 1wel h VAL 446 Ca 0.31 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.85 1wel h VAL 446 Cb 0.37 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1wel h VAL 446 CO -0.29 0.30 -0.36 0.40 0.02 0.00 0.00 177.57 177.63 1wel h ILE 447 N 0.09 0.00 -0.72 4.57 2.04 -0.41 -2.51 117.51 120.58 1wel h ILE 447 Ca 0.05 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.04 1wel h ILE 447 Cb 0.47 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.42 1wel h ILE 447 CO 0.02 0.00 -0.30 -0.78 0.00 0.00 0.00 178.15 177.09 1wel h ASP 448 N -0.51 -1.08 -0.94 1.72 3.58 -1.37 0.12 116.42 117.94 1wel h ASP 448 Ca -0.00 0.24 0.25 0.00 0.42 0.00 0.00 57.03 57.94 1wel h ASP 448 Cb 0.52 0.58 -0.18 0.00 1.72 0.00 0.00 39.33 41.97 1wel h ASP 448 CO -0.20 -0.29 0.00 0.33 -2.88 0.00 0.00 179.24 176.21 1wel n PHE 449 N -5.46 0.58 -1.99 0.28 7.35 -0.96 0.74 117.46 118.00 1wel n PHE 449 Ca 0.07 1.13 -0.35 0.00 -0.76 0.00 0.00 57.45 57.55 1wel n PHE 449 Cb 0.38 -1.19 0.03 0.00 0.35 0.00 0.00 39.48 39.04 1wel n PHE 449 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1wel n PHE 450 N -5.40 3.12 -1.03 -5.13 3.72 0.39 -4.89 117.46 108.23 1wel n PHE 450 Ca 0.22 -2.62 -0.33 0.00 -0.05 0.00 0.00 57.45 54.66 1wel n PHE 450 Cb 0.71 -0.88 0.13 0.00 -0.94 0.00 0.00 39.48 38.49 1wel n PHE 450 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1wel n LYS 451 N -0.59 0.06 -2.89 -1.08 5.02 0.23 -3.11 118.16 115.79 1wel n LYS 451 Ca 0.51 0.09 -0.19 0.00 -2.02 0.00 0.00 58.31 56.70 1wel n LYS 451 Cb 0.45 -2.30 0.03 0.00 -0.02 0.00 0.00 35.03 33.19 1wel n LYS 451 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1wel n LYS 452 N -2.97 -4.13 -4.05 1.97 3.00 -1.26 -5.00 118.16 105.72 1wel n LYS 452 Ca 0.12 0.77 -0.09 0.00 -0.00 0.00 0.00 58.31 59.11 1wel n LYS 452 Cb 0.51 -5.33 -0.09 0.00 0.00 0.00 0.00 35.03 30.12 1wel n LYS 452 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1wel s LEU 453 N -5.68 1.45 -0.62 3.14 1.43 -1.18 -5.09 118.68 112.13 1wel s LEU 453 Ca 0.25 -1.03 -0.21 0.00 -1.03 0.00 0.00 54.13 52.12 1wel s LEU 453 Cb -0.11 0.71 0.09 0.00 0.03 0.00 0.00 46.19 46.90 1wel s LEU 453 CO 0.31 -0.79 0.82 -1.81 0.23 0.00 0.00 176.35 175.11 1wel s ASP 454 N -3.00 6.18 -0.28 2.29 1.11 -1.26 -5.01 116.67 116.71 1wel s ASP 454 Ca 0.19 -1.20 0.00 0.00 0.18 0.00 0.00 52.55 51.72 1wel s ASP 454 Cb 0.06 -2.35 0.05 0.00 1.07 0.00 0.00 42.92 41.74 1wel s ASP 454 CO -0.00 -1.25 -0.05 -0.63 1.18 0.00 0.00 175.17 174.42 1wel s ILE 455 N 3.29 2.63 -0.61 0.77 1.01 -1.26 -3.62 121.20 123.40 1wel s ILE 455 Ca 0.16 -1.46 -0.26 0.00 0.00 0.00 0.00 60.65 59.10 1wel s ILE 455 Cb -0.21 -2.50 -0.08 0.00 0.01 0.00 0.00 42.46 39.68 1wel s ILE 455 CO 0.08 -0.04 2.31 -0.69 0.00 0.00 0.00 174.94 176.60 1wel s VAL 456 N 1.20 3.08 0.30 2.92 1.01 -1.20 -4.78 120.40 122.93 1wel s VAL 456 Ca -0.06 0.00 0.21 0.00 0.00 0.00 0.00 61.98 62.13 1wel s VAL 456 Cb -0.20 -3.21 0.33 0.00 0.00 0.00 0.00 36.38 33.30 1wel s VAL 456 CO -0.03 -0.20 1.11 -0.62 0.00 0.00 0.00 175.10 175.36 1wel n GLU 457 N 8.98 -0.03 0.14 2.72 4.71 -1.26 0.02 120.64 135.92 1wel n GLU 457 Ca 0.37 0.92 -0.06 0.00 -0.01 0.00 0.00 57.16 58.38 1wel n GLU 457 Cb 0.51 -1.76 -0.03 0.00 -1.01 0.00 0.00 31.44 29.15 1wel n GLU 457 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 1wel h ASP 458 N 0.00 -0.33 -0.74 1.62 3.58 -1.99 -3.30 116.42 115.25 1wel h ASP 458 Ca 0.62 0.01 0.12 0.00 0.42 0.00 0.00 57.03 58.20 1wel h ASP 458 Cb 1.90 0.09 -0.12 0.00 1.72 0.00 0.00 39.33 42.91 1wel h ASP 458 CO -0.39 -0.10 -0.28 -1.54 -2.88 0.00 0.00 179.24 174.04 1wel n SER 459 N -3.79 -0.46 -3.21 2.28 3.41 0.10 -4.49 113.62 107.47 1wel n SER 459 Ca -0.05 1.29 -0.45 0.00 -0.26 0.00 0.00 58.87 59.40 1wel n SER 459 Cb 0.15 -0.31 -0.07 0.00 -0.26 0.00 0.00 64.21 63.73 1wel n SER 459 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1wel n ILE 460 N -5.10 0.00 -3.93 -1.33 5.41 -0.98 -4.79 119.36 108.65 1wel n ILE 460 Ca 0.08 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.63 1wel n ILE 460 Cb 0.30 -0.27 -0.17 0.00 -0.71 0.00 0.00 39.64 38.80 1wel n ILE 460 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1wel s TYR 461 N 1.62 0.58 -0.07 1.39 6.14 0.79 -4.97 117.35 122.83 1wel s TYR 461 Ca 0.70 -0.12 0.05 0.00 0.64 0.00 0.00 57.07 58.33 1wel s TYR 461 Cb -0.99 -0.65 -0.00 0.00 0.42 0.00 0.00 41.96 40.74 1wel s TYR 461 CO 0.52 -0.23 -0.22 0.42 0.64 0.00 0.00 175.55 176.68 1wel s ILE 462 N 1.41 1.89 0.14 3.14 1.01 -1.26 0.53 121.20 128.06 1wel s ILE 462 Ca -0.04 -0.95 -0.28 0.00 0.00 0.00 0.00 60.65 59.38 1wel s ILE 462 Cb -0.13 -1.62 -0.07 0.00 0.01 0.00 0.00 42.46 40.64 1wel s ILE 462 CO -0.03 0.53 0.87 0.00 0.00 0.00 0.00 174.94 176.31 1wel s ALA 463 N 0.14 3.34 -0.00 9.38 0.00 0.68 -5.00 121.76 130.29 1wel s ALA 463 Ca -0.11 0.48 0.07 0.00 0.00 0.00 0.00 51.96 52.40 1wel s ALA 463 Cb -0.15 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1wel s ALA 463 CO 0.06 0.12 -0.21 0.71 0.00 0.00 0.00 175.76 176.44 1wel s TYR 464 N -0.56 1.89 0.86 0.00 2.02 -1.26 -2.32 117.35 117.98 1wel s TYR 464 Ca 0.41 -0.36 -0.12 0.00 -0.37 0.00 0.00 57.07 56.63 1wel s TYR 464 Cb -0.23 -1.20 0.11 0.00 -0.40 0.00 0.00 41.96 40.23 1wel s TYR 464 CO 0.28 -0.01 1.14 0.20 -1.57 0.00 0.00 175.55 175.59 1wel s GLY 465 N -0.63 1.59 0.31 0.71 0.00 -0.01 -4.78 107.32 104.51 1wel s GLY 465 Ca 0.08 -0.48 0.26 0.00 0.00 0.00 0.00 44.72 44.58 1wel s GLY 465 CO -0.00 0.03 1.76 -0.56 0.00 0.00 0.00 173.10 174.33 1wel h PRO 466 N -1.29 0.00 -0.64 2.90 0.13 -1.94 -2.42 132.00 128.74 1wel h PRO 466 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1wel h PRO 466 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1wel h PRO 466 CO 0.62 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.48 1wel n ASN 467 N -2.40 4.36 -2.08 1.44 3.02 -1.26 -4.91 115.26 113.42 1wel n ASN 467 Ca 0.02 -2.43 -0.13 0.00 -0.03 0.00 0.00 54.58 52.01 1wel n ASN 467 Cb 0.24 -0.56 0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1wel n ASN 467 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wel n GLY 468 N 1.01 0.14 2.77 7.41 0.00 -0.91 -5.03 105.19 110.58 1wel n GLY 468 Ca 0.23 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1wel n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wel s LYS 469 N -5.62 0.68 -0.32 1.61 -0.14 -1.25 -4.92 119.74 109.78 1wel s LYS 469 Ca 0.29 -0.05 -0.40 0.00 -1.36 0.00 0.00 55.97 54.45 1wel s LYS 469 Cb -0.13 -1.31 -0.15 0.00 -1.68 0.00 0.00 37.83 34.56 1wel s LYS 469 CO 0.36 -0.39 1.83 0.00 -0.76 0.00 0.00 175.35 176.39 1wel n ALA 470 N 5.11 -0.02 -0.01 5.17 0.00 0.75 -0.83 120.51 130.68 1wel n ALA 470 Ca -0.08 0.31 0.03 0.00 0.00 0.00 0.00 53.44 53.71 1wel n ALA 470 Cb 0.49 -2.25 0.40 0.00 0.00 0.00 0.00 19.45 18.09 1wel n ALA 470 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1wel h THR 471 N 5.63 1.12 0.00 0.00 1.35 -1.76 -3.38 112.91 115.86 1wel h THR 471 Ca -0.41 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1wel h THR 471 Cb 1.33 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 1wel h THR 471 CO 0.98 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.99 1wel n GLY 472 N -1.39 1.91 2.97 5.82 0.00 -1.26 -4.93 105.19 108.31 1wel n GLY 472 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1wel n GLY 472 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wel s GLU 473 N -0.24 1.74 0.27 1.61 2.02 -1.26 -2.15 118.70 120.69 1wel s GLU 473 Ca 0.00 -1.14 0.12 0.00 0.02 0.00 0.00 54.97 53.97 1wel s GLU 473 Cb 0.00 -2.68 -0.05 0.00 0.10 0.00 0.00 34.13 31.50 1wel s GLU 473 CO 0.00 -0.62 -0.18 0.20 0.02 0.00 0.00 175.26 174.68 1wel s GLY 474 N 1.30 1.85 -0.06 -1.39 0.00 -0.45 -0.23 107.32 108.33 1wel s GLY 474 Ca -0.05 -1.83 -0.05 0.00 0.00 0.00 0.00 44.72 42.79 1wel s GLY 474 CO -0.07 -1.92 0.16 -1.36 0.00 0.00 0.00 173.10 169.92 1wel s PHE 475 N -2.43 -0.18 0.05 1.90 0.08 0.19 -1.09 117.98 116.49 1wel s PHE 475 Ca 0.30 0.45 0.03 0.00 0.12 0.00 0.00 56.93 57.83 1wel s PHE 475 Cb -0.05 0.03 -0.03 0.00 -0.57 0.00 0.00 43.02 42.40 1wel s PHE 475 CO 0.15 -0.11 -0.09 0.08 -0.10 0.00 0.00 175.22 175.15 1wel s VAL 476 N 0.39 0.68 -0.12 -0.44 1.01 -0.88 -0.15 120.40 120.89 1wel s VAL 476 Ca -0.03 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.82 1wel s VAL 476 Cb -0.04 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.63 1wel s VAL 476 CO -0.02 -0.35 -0.14 -0.70 0.00 0.00 0.00 175.10 173.90 1wel s GLU 477 N -1.64 2.12 -0.50 2.72 2.12 -1.26 -0.32 118.70 121.94 1wel s GLU 477 Ca -0.08 -0.51 -0.20 0.00 0.36 0.00 0.00 54.97 54.55 1wel s GLU 477 Cb -0.10 -1.91 0.05 0.00 0.26 0.00 0.00 34.13 32.43 1wel s GLU 477 CO 0.01 -0.16 0.66 -0.06 -0.54 0.00 0.00 175.26 175.17 1wel s PHE 478 N 1.28 3.03 0.25 5.30 0.08 -0.53 -3.24 117.98 124.14 1wel s PHE 478 Ca -0.01 -0.40 -0.07 0.00 0.12 0.00 0.00 56.93 56.57 1wel s PHE 478 Cb -0.14 -3.55 0.40 0.00 -0.57 0.00 0.00 43.02 39.17 1wel s PHE 478 CO -0.06 -1.03 1.37 0.54 -0.10 0.00 0.00 175.22 175.94 1wel n ARG 479 N 6.32 -0.08 -2.68 0.44 1.74 -1.24 -4.39 116.66 116.76 1wel n ARG 479 Ca -0.05 1.37 -0.25 0.00 -0.77 0.00 0.00 57.85 58.16 1wel n ARG 479 Cb 0.46 -2.05 0.02 0.00 -1.02 0.00 0.00 32.46 29.87 1wel n ARG 479 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1wel s ASN 480 N -5.23 5.71 -0.19 0.55 0.01 -1.26 -4.99 114.94 109.54 1wel s ASN 480 Ca -0.13 0.49 -0.02 0.00 -0.71 0.00 0.00 52.86 52.49 1wel s ASN 480 Cb 0.24 -1.61 -0.22 0.00 0.41 0.00 0.00 41.25 40.07 1wel s ASN 480 CO 0.69 -0.89 0.08 1.21 -1.51 0.00 0.00 177.10 176.68 1wel n GLU 481 N -2.33 0.71 -0.09 -0.60 2.13 -1.26 -3.73 120.64 115.46 1wel n GLU 481 Ca 0.03 0.21 -0.07 0.00 0.66 0.00 0.00 57.16 57.99 1wel n GLU 481 Cb 0.58 -1.62 -0.00 0.00 0.27 0.00 0.00 31.44 30.66 1wel n GLU 481 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wel h ALA 482 N 0.05 -0.04 -0.66 4.31 0.00 -1.96 -1.24 119.26 119.72 1wel h ALA 482 Ca -0.50 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1wel h ALA 482 Cb 1.97 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 20.27 1wel h ALA 482 CO 0.00 -0.63 0.10 0.38 0.00 0.00 0.00 179.25 179.10 1wel h ASP 483 N -0.20 1.06 -0.68 0.00 2.03 -1.96 -3.01 116.42 113.66 1wel h ASP 483 Ca 0.17 -0.26 0.15 0.00 -0.73 0.00 0.00 57.03 56.36 1wel h ASP 483 Cb 0.46 -0.28 -0.11 0.00 -0.83 0.00 0.00 39.33 38.57 1wel h ASP 483 CO -0.46 1.05 0.07 0.22 -1.03 0.00 0.00 179.24 179.09 1wel h TYR 484 N 1.03 0.07 -0.21 4.15 3.20 -1.33 -0.82 116.97 123.06 1wel h TYR 484 Ca 0.20 0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.16 1wel h TYR 484 Cb 0.45 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.75 1wel h TYR 484 CO 0.03 -0.15 -0.09 0.87 -1.64 0.00 0.00 178.16 177.18 1wel h LYS 485 N 0.17 -0.06 -0.69 1.82 1.57 -1.25 -2.12 116.57 116.00 1wel h LYS 485 Ca 0.37 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.29 1wel h LYS 485 Cb 0.62 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.85 1wel h LYS 485 CO -0.54 -0.04 0.21 0.00 -0.57 0.00 0.00 179.45 178.51 1wel h ALA 486 N 1.12 0.90 -0.72 3.86 0.00 -1.20 -1.33 119.26 121.89 1wel h ALA 486 Ca 0.11 0.13 0.16 0.00 0.00 0.00 0.00 54.91 55.31 1wel h ALA 486 Cb 0.23 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.04 1wel h ALA 486 CO -0.25 -0.27 -0.04 0.00 0.00 0.00 0.00 179.25 178.69 1wel h ALA 487 N 1.53 0.67 -0.46 0.00 0.00 -0.80 0.10 119.26 120.30 1wel h ALA 487 Ca 0.37 0.24 0.09 0.00 0.00 0.00 0.00 54.91 55.62 1wel h ALA 487 Cb 0.57 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1wel h ALA 487 CO -0.42 -0.42 -0.05 -0.07 0.00 0.00 0.00 179.25 178.29 1wel h LEU 488 N 0.07 -0.30 -1.89 0.00 -0.00 -1.18 0.36 115.31 112.39 1wel h LEU 488 Ca 0.38 0.12 0.00 0.00 -0.00 0.00 0.00 57.88 58.38 1wel h LEU 488 Cb 0.64 0.23 0.00 0.00 -0.00 0.00 0.00 40.66 41.54 1wel h LEU 488 CO -0.66 -0.10 0.27 0.00 -0.00 0.00 0.00 178.44 177.94 1wel n ARG 490 N -2.72 1.50 -2.66 0.00 5.12 0.13 -4.91 116.66 113.11 1wel n ARG 490 Ca -0.02 -0.87 -0.30 0.00 -1.93 0.00 0.00 57.85 54.73 1wel n ARG 490 Cb 0.31 -1.41 -0.02 0.00 -1.16 0.00 0.00 32.46 30.18 1wel n ARG 490 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1wel s HIS 491 N -0.75 3.50 -1.26 -1.55 5.65 -0.80 -4.18 115.29 115.90 1wel s HIS 491 Ca 0.22 1.09 -0.05 0.00 0.25 0.00 0.00 55.06 56.57 1wel s HIS 491 Cb 0.15 -2.49 0.01 0.00 -1.18 0.00 0.00 32.58 29.06 1wel s HIS 491 CO -0.02 -0.23 1.08 1.17 -0.65 0.00 0.00 174.74 176.10 1wel n LYS 492 N -1.64 -7.23 -3.97 2.88 4.81 -1.26 -5.00 118.16 106.75 1wel n LYS 492 Ca 0.03 0.83 -0.30 0.00 -0.87 0.00 0.00 58.31 58.00 1wel n LYS 492 Cb 0.54 -5.83 -0.04 0.00 0.02 0.00 0.00 35.03 29.72 1wel n LYS 492 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1wel s GLN 493 N -5.84 3.28 -0.18 1.64 -1.52 -1.23 -5.02 119.66 110.78 1wel s GLN 493 Ca 0.30 -0.56 -0.03 0.00 -1.95 0.00 0.00 55.36 53.13 1wel s GLN 493 Cb -0.13 -2.93 -0.01 0.00 -0.22 0.00 0.00 33.01 29.71 1wel s GLN 493 CO 0.72 0.57 -0.07 0.71 -0.25 0.00 0.00 175.29 176.97 1wel s TYR 494 N -1.55 2.93 -1.13 0.91 1.51 -1.26 -2.15 117.35 116.61 1wel s TYR 494 Ca 0.33 -0.72 -0.20 0.00 -1.01 0.00 0.00 57.07 55.47 1wel s TYR 494 Cb -0.12 -2.00 0.08 0.00 -0.11 0.00 0.00 41.96 39.80 1wel s TYR 494 CO 0.26 -0.34 1.53 1.41 -1.11 0.00 0.00 175.55 177.30 1wel s MET 495 N 0.92 3.79 0.00 -0.62 1.75 0.51 -3.80 119.30 121.86 1wel s MET 495 Ca -0.01 -1.64 0.00 0.00 -1.25 0.00 0.00 55.69 52.79 1wel s MET 495 Cb -0.15 -5.36 0.00 0.00 2.84 0.00 0.00 34.83 32.16 1wel s MET 495 CO 0.01 -2.15 0.00 0.41 -0.65 0.00 0.00 175.02 172.64 1wel n GLY 496 N 5.95 0.78 0.00 2.11 0.00 -1.20 -1.80 105.19 111.03 1wel n GLY 496 Ca 0.38 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1wel n GLY 496 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wel n ASN 497 N 1.94 3.56 -4.64 1.61 3.02 -1.26 -4.35 115.26 115.13 1wel n ASN 497 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 1wel n ASN 497 Cb 0.00 0.47 0.11 0.00 -0.61 0.00 0.00 39.78 39.75 1wel n ASN 497 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1wel s ARG 498 N -1.62 1.64 -0.03 3.52 1.81 -0.75 -5.03 118.95 118.49 1wel s ARG 498 Ca 0.00 -0.76 0.04 0.00 -1.72 0.00 0.00 55.73 53.29 1wel s ARG 498 Cb 0.00 -2.21 -0.00 0.00 -0.45 0.00 0.00 34.95 32.29 1wel s ARG 498 CO 0.00 -1.54 -0.15 0.12 -0.68 0.00 0.00 175.30 173.05 1wel s PHE 499 N -3.29 1.46 0.08 -0.53 5.36 -1.26 -0.36 117.98 119.44 1wel s PHE 499 Ca 0.66 -0.37 0.05 0.00 -0.96 0.00 0.00 56.93 56.31 1wel s PHE 499 Cb -0.07 -0.98 -0.03 0.00 -0.34 0.00 0.00 43.02 41.60 1wel s PHE 499 CO 0.46 -0.11 -0.14 0.42 -1.46 0.00 0.00 175.22 174.39 1wel s ILE 500 N -0.05 1.14 -0.06 3.12 1.09 -0.91 -4.22 121.20 121.30 1wel s ILE 500 Ca -0.01 -1.41 0.02 0.00 -1.10 0.00 0.00 60.65 58.15 1wel s ILE 500 Cb -0.09 -1.18 -0.03 0.00 -1.06 0.00 0.00 42.46 40.10 1wel s ILE 500 CO 0.01 -0.29 -0.08 -1.10 -0.10 0.00 0.00 174.94 173.38 1wel s GLN 501 N -2.01 2.67 -0.14 2.79 1.11 0.14 -3.58 119.66 120.65 1wel s GLN 501 Ca 0.01 -0.60 -0.05 0.00 0.01 0.00 0.00 55.36 54.73 1wel s GLN 501 Cb -0.08 -2.54 -0.04 0.00 -1.01 0.00 0.00 33.01 29.34 1wel s GLN 501 CO 0.02 0.65 0.03 0.08 0.01 0.00 0.00 175.29 176.08 1wel s VAL 502 N -0.82 4.51 -0.16 1.09 1.01 -1.26 -1.83 120.40 122.94 1wel s VAL 502 Ca 0.13 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.88 1wel s VAL 502 Cb -0.11 -2.97 0.06 0.00 0.00 0.00 0.00 36.38 33.37 1wel s VAL 502 CO 0.02 0.53 0.36 -1.00 0.00 0.00 0.00 175.10 175.01 1wel s HIS 503 N -0.21 -0.56 0.12 5.22 3.76 -0.57 -4.91 115.29 118.13 1wel s HIS 503 Ca 0.06 1.19 -0.31 0.00 -0.15 0.00 0.00 55.06 55.86 1wel s HIS 503 Cb -0.12 0.19 -0.08 0.00 1.11 0.00 0.00 32.58 33.68 1wel s HIS 503 CO 0.02 -0.35 1.36 -1.25 -0.85 0.00 0.00 174.74 173.67 1wel s PRO 504 N 1.75 4.34 0.00 8.40 0.04 -1.26 -0.47 135.00 147.79 1wel s PRO 504 Ca -0.07 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1wel s PRO 504 Cb -0.10 -3.25 -0.00 0.00 0.04 0.00 0.00 34.50 31.18 1wel s PRO 504 CO -0.11 -0.40 -0.01 -1.50 0.04 0.00 0.00 177.00 175.02 1wel s ILE 505 N 1.01 0.06 0.87 0.56 2.07 -1.25 -4.89 121.20 119.63 1wel s ILE 505 Ca 0.63 -0.18 -0.10 0.00 -1.41 0.00 0.00 60.65 59.58 1wel s ILE 505 Cb -0.36 -0.09 0.12 0.00 0.13 0.00 0.00 42.46 42.26 1wel s ILE 505 CO 0.31 -0.08 1.13 0.42 -1.91 0.00 0.00 174.94 174.80 1wel s THR 506 N -0.27 2.48 0.11 4.00 -4.23 -1.26 -4.05 115.64 112.42 1wel s THR 506 Ca -0.03 0.16 -0.21 0.00 -1.18 0.00 0.00 61.69 60.43 1wel s THR 506 Cb -0.02 -2.34 -0.09 0.00 1.34 0.00 0.00 72.50 71.39 1wel s THR 506 CO -0.00 -0.21 1.76 0.50 -0.54 0.00 0.00 174.62 176.13 1wel h LYS 507 N -1.64 0.16 0.12 3.99 3.11 -1.90 -1.06 116.57 119.35 1wel h LYS 507 Ca -0.44 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.39 1wel h LYS 507 Cb 1.26 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.45 1wel h LYS 507 CO 0.45 0.11 -0.06 -0.22 -2.81 0.00 0.00 179.45 176.92 1wel h LYS 508 N 0.16 -0.16 -0.92 1.90 3.64 -1.96 -2.16 116.57 117.09 1wel h LYS 508 Ca 0.05 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.55 1wel h LYS 508 Cb -0.01 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.77 1wel h LYS 508 CO -0.02 -0.06 0.55 0.78 -2.27 0.00 0.00 179.45 178.42 1wel h GLY 509 N -0.21 1.47 0.92 5.01 0.00 -1.90 0.40 103.07 108.76 1wel h GLY 509 Ca -0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1wel h GLY 509 CO 0.03 0.14 0.06 1.98 0.00 0.00 0.00 176.54 178.75 1wel h MET 510 N 0.89 0.17 -0.40 4.80 1.85 -0.95 -3.00 114.93 118.29 1wel h MET 510 Ca 0.45 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.50 1wel h MET 510 Cb 0.44 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.42 1wel h MET 510 CO -0.26 0.21 0.19 -0.07 -0.40 0.00 0.00 176.91 176.58 1wel h LEU 511 N 0.09 0.52 -0.74 3.39 3.38 -0.75 -2.86 115.31 118.34 1wel h LEU 511 Ca 0.04 -0.13 0.13 0.00 0.09 0.00 0.00 57.88 58.01 1wel h LEU 511 Cb 0.09 -0.13 -0.13 0.00 0.09 0.00 0.00 40.66 40.58 1wel h LEU 511 CO -0.01 0.50 -0.32 -0.33 0.09 0.00 0.00 178.44 178.38 1wel h GLU 512 N 0.50 -0.08 0.59 1.13 5.08 -0.81 -1.25 114.58 119.75 1wel h GLU 512 Ca 0.14 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1wel h GLU 512 Cb 0.12 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 1wel h GLU 512 CO -0.02 -0.05 -0.35 0.87 -1.00 0.00 0.00 179.01 178.46 1wel h LYS 513 N -0.09 -0.86 -0.98 2.33 1.57 -1.40 -2.61 116.57 114.54 1wel h LYS 513 Ca 0.30 0.06 0.35 0.00 -1.87 0.00 0.00 60.65 59.49 1wel h LYS 513 Cb 0.57 0.19 -0.18 0.00 0.08 0.00 0.00 32.23 32.89 1wel h LYS 513 CO -0.79 -0.57 0.32 -0.89 -0.57 0.00 0.00 179.45 176.95 1wel n ILE 514 N -5.49 -0.41 -0.33 1.86 5.41 -0.55 0.18 119.36 120.02 1wel n ILE 514 Ca -0.13 2.07 -0.04 0.00 1.00 0.00 0.00 62.75 65.66 1wel n ILE 514 Cb 0.38 -3.21 0.09 0.00 -0.71 0.00 0.00 39.64 36.19 1wel n ILE 514 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1wel h ASP 515 N 0.00 1.07 -0.61 4.38 1.82 -0.96 -1.60 116.42 120.52 1wel h ASP 515 Ca 0.74 -0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 57.23 1wel h ASP 515 Cb 1.80 -0.27 -0.03 0.00 0.68 0.00 0.00 39.33 41.51 1wel h ASP 515 CO -0.83 0.82 0.10 0.24 -1.61 0.00 0.00 179.24 177.96 1wel h MET 516 N 1.22 1.03 -0.06 0.28 2.86 0.20 -0.91 114.93 119.56 1wel h MET 516 Ca 0.32 -0.27 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1wel h MET 516 Cb -0.05 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.48 1wel h MET 516 CO -0.06 0.95 0.02 0.82 1.06 0.00 0.00 176.91 179.70 1wel h ILE 517 N 0.97 1.19 -0.30 -1.22 2.04 -0.81 0.34 117.51 119.72 1wel h ILE 517 Ca 0.19 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1wel h ILE 517 Cb 0.42 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1wel h ILE 517 CO 0.01 0.16 0.15 0.03 0.00 0.00 0.00 178.15 178.50 1wel h ARG 518 N -0.11 0.43 0.46 2.37 3.08 -1.23 0.33 114.38 119.72 1wel h ARG 518 Ca 0.02 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1wel h ARG 518 Cb 0.23 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1wel h ARG 518 CO 0.00 0.40 -0.22 0.87 -1.07 0.00 0.00 179.97 179.94 1wel h LYS 519 N 0.35 -0.60 -0.99 0.04 1.79 -1.13 -1.86 116.57 114.18 1wel h LYS 519 Ca 0.10 0.04 0.15 0.00 -2.18 0.00 0.00 60.65 58.76 1wel h LYS 519 Cb 0.11 0.14 -0.09 0.00 -1.58 0.00 0.00 32.23 30.80 1wel h LYS 519 CO -0.01 -0.30 0.62 0.07 -1.08 0.00 0.00 179.45 178.75 1wel h ARG 520 N -0.90 0.84 -0.25 3.15 0.11 -0.32 -1.47 114.38 115.54 1wel h ARG 520 Ca -0.06 -0.05 -0.02 0.00 0.10 0.00 0.00 59.98 59.95 1wel h ARG 520 Cb 0.58 -0.19 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1wel h ARG 520 CO 0.10 0.56 0.10 -0.07 0.10 0.00 0.00 179.97 180.76 1wel h LEU 521 N 0.87 0.35 -9.21 0.08 3.38 -0.85 -3.44 115.31 106.48 1wel h LEU 521 Ca 0.51 -0.17 -0.50 0.00 0.09 0.00 0.00 57.88 57.81 1wel h LEU 521 Cb 0.66 -0.09 0.25 0.00 0.09 0.00 0.00 40.66 41.57 1wel h LEU 521 CO -0.29 0.43 -1.97 0.00 0.09 0.00 0.00 178.44 176.70 1wel n GLN 522 N -4.77 -0.35 -0.07 1.13 1.13 -0.55 -4.97 117.38 108.92 1wel n GLN 522 Ca -0.03 -0.10 -0.14 0.00 -1.94 0.00 0.00 57.00 54.80 1wel n GLN 522 Cb 0.14 -1.23 -0.05 0.00 0.11 0.00 0.00 30.24 29.20 1wel n GLN 522 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1wel n SER 523 N 1.98 1.59 0.00 1.08 7.64 -1.26 -5.01 113.62 119.63 1wel n SER 523 Ca -0.01 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1wel n SER 523 Cb 0.66 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1wel n SER 523 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wel n GLY 524 N 2.32 -1.83 3.56 0.23 0.00 -1.26 -5.11 105.19 103.10 1wel n GLY 524 Ca -0.27 0.83 -0.40 0.00 0.00 0.00 0.00 46.02 46.18 1wel n GLY 524 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wel s PRO 525 N 0.00 2.81 -0.18 1.61 0.04 -1.26 -4.94 135.00 133.08 1wel s PRO 525 Ca 0.00 0.78 -0.14 0.00 0.04 0.00 0.00 61.00 61.68 1wel s PRO 525 Cb 0.00 -4.33 0.05 0.00 0.04 0.00 0.00 34.50 30.26 1wel s PRO 525 CO 0.00 -2.51 0.47 -1.12 0.04 0.00 0.00 177.00 173.89 1wel s SER 526 N 7.50 -0.54 -0.02 6.66 0.01 -1.26 -5.16 113.70 120.89 1wel s SER 526 Ca 0.69 0.98 0.00 0.00 1.31 0.00 0.00 55.95 58.94 1wel s SER 526 Cb -0.14 0.94 0.02 0.00 0.21 0.00 0.00 66.02 67.05 1wel s SER 526 CO 0.24 -0.18 0.01 -0.44 0.41 0.00 0.00 173.24 173.28 1wel s SER 527 N 0.71 0.27 0.00 2.44 0.01 -1.26 -5.29 113.70 110.58 1wel s SER 527 Ca -0.04 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1wel s SER 527 Cb -0.05 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1wel s SER 527 CO -0.05 -0.09 0.35 0.61 0.41 0.00 0.00 173.24 174.47