#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 6.59 0.23 1.61 1.04 -1.26 -4.93 113.70 116.97 1wel s SER 406 Ca 0.00 0.41 -0.06 0.00 0.48 0.00 0.00 55.95 56.78 1wel s SER 406 Cb 0.00 -2.42 0.38 0.00 0.10 0.00 0.00 66.02 64.08 1wel s SER 406 CO 0.00 -0.77 1.75 0.77 0.98 0.00 0.00 173.24 175.97 1wel h SER 407 N 8.49 0.31 0.00 7.02 4.64 -2.14 -3.46 113.55 128.41 1wel h SER 407 Ca -0.24 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1wel h SER 407 Cb 1.09 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1wel h SER 407 CO 0.93 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 177.66 1wel n GLY 408 N -1.31 0.67 3.08 -0.77 0.00 -1.26 -4.86 105.19 100.74 1wel n GLY 408 Ca 0.12 -0.83 -0.10 0.00 0.00 0.00 0.00 46.02 45.21 1wel n GLY 408 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wel s SER 409 N -4.00 0.17 0.26 1.61 0.15 -1.26 -5.17 113.70 105.46 1wel s SER 409 Ca 0.00 -0.47 -0.03 0.00 0.70 0.00 0.00 55.95 56.15 1wel s SER 409 Cb 0.00 0.19 -0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1wel s SER 409 CO 0.00 -0.44 0.31 -0.94 1.20 0.00 0.00 173.24 173.37 1wel s SER 410 N -1.85 0.52 0.19 5.45 1.04 -1.26 -5.17 113.70 112.63 1wel s SER 410 Ca -0.09 -1.37 0.06 0.00 0.48 0.00 0.00 55.95 55.02 1wel s SER 410 Cb -0.04 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.56 1wel s SER 410 CO -0.03 -1.05 0.17 -0.83 0.98 0.00 0.00 173.24 172.49 1wel s GLY 411 N -3.18 1.60 -0.21 7.32 0.00 -1.26 -5.11 107.32 106.48 1wel s GLY 411 Ca 0.34 -1.27 0.02 0.00 0.00 0.00 0.00 44.72 43.80 1wel s GLY 411 CO 0.16 -1.29 -0.14 0.54 0.00 0.00 0.00 173.10 172.37 1wel s LYS 412 N -3.38 2.40 -0.61 2.90 1.02 -1.26 -5.05 119.74 115.76 1wel s LYS 412 Ca 0.32 -1.01 0.05 0.00 0.02 0.00 0.00 55.97 55.34 1wel s LYS 412 Cb -0.09 -2.63 0.17 0.00 -0.52 0.00 0.00 37.83 34.76 1wel s LYS 412 CO 0.24 -0.41 0.44 0.45 -0.92 0.00 0.00 175.35 175.16 1wel s SER 413 N 1.26 3.83 0.69 2.83 0.15 -1.26 -5.11 113.70 116.10 1wel s SER 413 Ca -0.02 -3.59 -0.14 0.00 0.70 0.00 0.00 55.95 52.91 1wel s SER 413 Cb -0.16 -1.28 0.02 0.00 -1.71 0.00 0.00 66.02 62.88 1wel s SER 413 CO -0.09 -0.12 1.11 -2.16 1.20 0.00 0.00 173.24 173.18 1wel s PRO 414 N -0.96 2.63 -0.02 5.44 0.04 -1.26 -5.03 135.00 135.83 1wel s PRO 414 Ca 0.27 1.33 -0.23 0.00 0.04 0.00 0.00 61.00 62.40 1wel s PRO 414 Cb -0.03 -1.93 0.05 0.00 0.04 0.00 0.00 34.50 32.63 1wel s PRO 414 CO -0.17 -1.38 0.51 -1.12 0.04 0.00 0.00 177.00 174.89 1wel s SER 415 N -2.82 -0.44 0.00 6.66 0.01 -1.26 -4.94 113.70 110.91 1wel s SER 415 Ca 0.65 0.39 0.00 0.00 1.31 0.00 0.00 55.95 58.30 1wel s SER 415 Cb -0.20 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1wel s SER 415 CO 0.46 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 174.16 1wel n GLY 416 N 0.98 2.01 3.93 3.44 0.00 -1.26 -4.67 105.19 109.63 1wel n GLY 416 Ca -0.20 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1wel n GLY 416 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wel n GLN 417 N 0.00 -0.93 -4.16 1.61 0.00 -1.26 -4.87 117.38 107.76 1wel n GLN 417 Ca 0.00 0.11 -0.16 0.00 0.00 0.00 0.00 57.00 56.95 1wel n GLN 417 Cb 0.00 -4.01 -0.11 0.00 0.00 0.00 0.00 30.24 26.12 1wel n GLN 417 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1wel s LYS 418 N -6.14 0.81 0.26 2.61 1.02 -1.26 -5.17 119.74 111.87 1wel s LYS 418 Ca 0.65 -1.05 0.06 0.00 0.02 0.00 0.00 55.97 55.66 1wel s LYS 418 Cb -0.38 -0.62 -0.06 0.00 -0.52 0.00 0.00 37.83 36.25 1wel s LYS 418 CO 0.80 0.12 -0.06 -0.98 -0.92 0.00 0.00 175.35 174.30 1wel s ARG 419 N -2.29 1.49 0.06 1.68 1.04 -1.26 -5.16 118.95 114.51 1wel s ARG 419 Ca 0.01 -1.74 0.07 0.00 -1.04 0.00 0.00 55.73 53.03 1wel s ARG 419 Cb -0.06 -1.09 -0.03 0.00 -2.04 0.00 0.00 34.95 31.73 1wel s ARG 419 CO 0.01 0.04 -0.19 -1.54 -0.04 0.00 0.00 175.30 173.59 1wel s SER 420 N -3.41 2.22 0.46 -2.89 1.04 -1.26 -5.15 113.70 104.71 1wel s SER 420 Ca 0.28 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 56.19 1wel s SER 420 Cb 0.03 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.99 1wel s SER 420 CO 0.11 0.09 0.11 0.00 0.98 0.00 0.00 173.24 174.52 1wel s ARG 421 N -1.38 2.07 -0.09 4.02 1.70 -1.26 -5.15 118.95 118.85 1wel s ARG 421 Ca 0.05 -2.30 0.03 0.00 -0.47 0.00 0.00 55.73 53.04 1wel s ARG 421 Cb -0.09 -0.82 0.01 0.00 -0.57 0.00 0.00 34.95 33.48 1wel s ARG 421 CO 0.02 -0.51 -0.20 -1.54 -1.08 0.00 0.00 175.30 172.00 1wel s SER 422 N -3.71 2.64 -0.03 -2.89 1.04 -1.26 -5.05 113.70 104.44 1wel s SER 422 Ca 0.16 -0.47 -0.17 0.00 0.48 0.00 0.00 55.95 55.94 1wel s SER 422 Cb 0.01 -1.21 -0.10 0.00 0.10 0.00 0.00 66.02 64.82 1wel s SER 422 CO 0.11 0.10 0.71 -0.09 0.98 0.00 0.00 173.24 175.05 1wel h ARG 423 N 6.91 -0.50 -4.89 4.02 2.43 -2.05 -3.46 114.38 116.82 1wel h ARG 423 Ca -0.25 0.03 -0.39 0.00 -0.81 0.00 0.00 59.98 58.57 1wel h ARG 423 Cb 1.21 0.11 -0.26 0.00 -0.42 0.00 0.00 29.97 30.62 1wel h ARG 423 CO 0.48 -0.28 -0.77 -1.12 -1.51 0.00 0.00 179.97 176.77 1wel s SER 424 N -4.98 1.22 -0.28 -3.80 0.01 -1.26 -5.11 113.70 99.51 1wel s SER 424 Ca -0.09 -0.34 -0.29 0.00 1.31 0.00 0.00 55.95 56.54 1wel s SER 424 Cb 0.01 -0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.14 1wel s SER 424 CO 0.29 0.02 1.65 -2.16 0.41 0.00 0.00 173.24 173.45 1wel s PRO 425 N -0.80 3.63 0.14 12.44 0.04 -1.26 -4.99 135.00 144.19 1wel s PRO 425 Ca 0.00 1.51 0.04 0.00 0.04 0.00 0.00 61.00 62.59 1wel s PRO 425 Cb -0.06 -4.08 -0.04 0.00 0.04 0.00 0.00 34.50 30.35 1wel s PRO 425 CO 0.00 -1.50 -0.10 -3.38 0.04 0.00 0.00 177.00 172.06 1wel s HIS 426 N 5.75 1.24 0.63 0.56 -3.43 -1.26 -5.13 115.29 113.64 1wel s HIS 426 Ca 0.73 -0.74 -0.19 0.00 -0.80 0.00 0.00 55.06 54.07 1wel s HIS 426 Cb -0.23 -0.64 -0.02 0.00 -1.43 0.00 0.00 32.58 30.27 1wel s HIS 426 CO 0.31 0.07 1.30 -2.00 -2.00 0.00 0.00 174.74 172.42 1wel s GLU 427 N -3.56 2.67 -0.29 -0.38 2.12 -1.26 -5.03 118.70 112.98 1wel s GLU 427 Ca 0.15 2.07 -0.25 0.00 0.36 0.00 0.00 54.97 57.29 1wel s GLU 427 Cb 0.01 -1.91 0.16 0.00 0.26 0.00 0.00 34.13 32.66 1wel s GLU 427 CO 0.01 -1.50 1.27 0.00 -0.54 0.00 0.00 175.26 174.49 1wel s ALA 428 N -1.40 -2.12 1.00 6.30 0.00 -1.26 -4.77 121.76 119.51 1wel s ALA 428 Ca 0.81 1.76 0.00 0.00 0.00 0.00 0.00 51.96 54.52 1wel s ALA 428 Cb -0.37 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.15 1wel s ALA 428 CO 0.40 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.41 1wel n GLY 429 N 1.71 -0.76 3.30 0.00 0.00 -1.26 -4.85 105.19 103.33 1wel n GLY 429 Ca -0.10 -1.36 -0.37 0.00 0.00 0.00 0.00 46.02 44.18 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 0.00 3.19 0.21 1.61 0.08 -1.26 -4.48 117.98 117.32 1wel s PHE 430 Ca 0.00 -1.22 0.04 0.00 0.12 0.00 0.00 56.93 55.87 1wel s PHE 430 Cb 0.00 -2.25 -0.05 0.00 -0.57 0.00 0.00 43.02 40.15 1wel s PHE 430 CO 0.00 -0.66 -0.04 0.00 -0.10 0.00 0.00 175.22 174.43 1wel s VAL 432 N -3.35 0.19 -0.29 0.00 -7.23 0.14 -3.43 120.40 106.43 1wel s VAL 432 Ca 0.25 -0.08 -0.09 0.00 -1.81 0.00 0.00 61.98 60.26 1wel s VAL 432 Cb 0.04 -0.18 -0.01 0.00 0.56 0.00 0.00 36.38 36.79 1wel s VAL 432 CO 0.07 0.07 0.12 -0.47 -0.31 0.00 0.00 175.10 174.57 1wel s TYR 433 N 0.09 3.15 -0.19 2.82 5.04 0.60 -2.04 117.35 126.83 1wel s TYR 433 Ca -0.01 -0.60 -0.07 0.00 -2.44 0.00 0.00 57.07 53.95 1wel s TYR 433 Cb -0.03 -2.31 -0.04 0.00 0.35 0.00 0.00 41.96 39.94 1wel s TYR 433 CO -0.00 -0.45 0.05 -0.51 -1.34 0.00 0.00 175.55 173.30 1wel s LEU 434 N 1.59 3.72 -0.07 6.97 1.43 -0.88 -1.98 118.68 129.45 1wel s LEU 434 Ca 0.05 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.20 1wel s LEU 434 Cb -0.17 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.12 1wel s LEU 434 CO 0.05 0.15 -0.14 -0.54 0.23 0.00 0.00 176.35 176.10 1wel s LYS 435 N 0.50 1.94 0.00 1.70 1.02 -0.89 -1.70 119.74 122.30 1wel s LYS 435 Ca 0.02 -0.49 0.00 0.00 0.02 0.00 0.00 55.97 55.52 1wel s LYS 435 Cb -0.13 -1.56 0.00 0.00 -0.52 0.00 0.00 37.83 35.62 1wel s LYS 435 CO 0.01 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.90 1wel n GLY 436 N 3.77 1.33 3.26 -3.33 0.00 -0.80 -0.03 105.19 109.39 1wel n GLY 436 Ca -0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.87 -4.66 0.99 4.77 -1.23 -4.58 117.00 109.42 1wel n LEU 437 Ca 0.00 0.57 -0.29 0.00 -0.03 0.00 0.00 56.01 56.26 1wel n LEU 437 Cb 0.00 -0.93 0.19 0.00 -2.33 0.00 0.00 43.42 40.35 1wel n LEU 437 CO 0.00 -4.55 0.63 -2.16 -1.33 0.00 0.00 177.39 169.98 1wel s PRO 438 N -1.58 0.03 0.25 3.23 0.04 -1.26 -4.25 135.00 131.46 1wel s PRO 438 Ca 0.57 0.39 0.04 0.00 0.04 0.00 0.00 61.00 62.03 1wel s PRO 438 Cb -0.41 -1.70 0.29 0.00 0.04 0.00 0.00 34.50 32.72 1wel s PRO 438 CO 0.66 -2.97 1.59 0.74 0.04 0.00 0.00 177.00 177.07 1wel h PHE 439 N -2.06 0.35 -0.61 0.56 -1.00 -1.92 -2.90 116.94 109.35 1wel h PHE 439 Ca -0.53 -0.12 -0.05 0.00 2.81 0.00 0.00 57.97 60.08 1wel h PHE 439 Cb 1.33 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 40.79 1wel h PHE 439 CO -0.13 0.76 0.06 0.39 -1.61 0.00 0.00 178.31 177.77 1wel n GLU 440 N -3.93 4.69 -1.21 1.51 -0.58 -1.26 -0.04 120.64 119.83 1wel n GLU 440 Ca -0.02 -3.15 -0.37 0.00 -0.42 0.00 0.00 57.16 53.19 1wel n GLU 440 Cb 0.57 -2.27 0.04 0.00 -0.57 0.00 0.00 31.44 29.21 1wel n GLU 440 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wel n ALA 441 N 0.47 -2.99 -3.34 0.62 0.00 -1.10 -5.01 120.51 109.17 1wel n ALA 441 Ca 0.31 -0.24 -0.15 0.00 0.00 0.00 0.00 53.44 53.36 1wel n ALA 441 Cb 1.25 -1.52 -0.07 0.00 0.00 0.00 0.00 19.45 19.12 1wel n ALA 441 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wel s GLU 442 N -1.82 0.93 0.36 0.00 2.02 -1.26 -4.93 118.70 113.99 1wel s GLU 442 Ca 0.57 -0.07 0.24 0.00 0.02 0.00 0.00 54.97 55.73 1wel s GLU 442 Cb -0.38 0.43 1.24 0.00 0.10 0.00 0.00 34.13 35.51 1wel s GLU 442 CO 0.66 -0.30 1.34 0.09 0.02 0.00 0.00 175.26 177.08 1wel n ASN 443 N 0.83 0.22 -0.04 -0.19 4.13 -1.26 0.17 115.26 119.12 1wel n ASN 443 Ca -0.19 1.27 -0.10 0.00 1.68 0.00 0.00 54.58 57.24 1wel n ASN 443 Cb 0.58 -0.62 -0.04 0.00 -1.54 0.00 0.00 39.78 38.16 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 0.24 -0.42 3.52 2.10 -1.99 -2.28 116.57 117.74 1wel h LYS 444 Ca 0.75 -0.01 0.06 0.00 -2.00 0.00 0.00 60.65 59.44 1wel h LYS 444 Cb 2.25 -0.05 -0.05 0.00 -0.90 0.00 0.00 32.23 33.48 1wel h LYS 444 CO -0.49 0.16 0.13 0.45 -2.00 0.00 0.00 179.45 177.69 1wel h HIS 445 N 0.25 0.22 -0.66 0.07 3.86 0.13 0.20 115.15 119.22 1wel h HIS 445 Ca 0.07 0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.37 1wel h HIS 445 Cb -0.02 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 28.37 1wel h HIS 445 CO -0.07 0.07 0.44 0.28 0.86 0.00 0.00 177.93 179.50 1wel h VAL 446 N 0.28 0.99 0.02 2.45 2.07 -1.23 -2.15 116.25 118.67 1wel h VAL 446 Ca 0.20 -0.22 -0.15 0.00 0.82 0.00 0.00 66.70 67.35 1wel h VAL 446 Cb 0.21 0.30 0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1wel h VAL 446 CO -0.23 0.12 -0.61 0.40 0.02 0.00 0.00 177.57 177.27 1wel h ILE 447 N 0.63 1.45 -0.06 4.57 2.04 -0.65 -3.10 117.51 122.40 1wel h ILE 447 Ca 0.29 -2.14 0.02 0.00 1.00 0.00 0.00 64.86 64.02 1wel h ILE 447 Cb 0.32 2.71 -0.00 0.00 -0.74 0.00 0.00 36.82 39.11 1wel h ILE 447 CO -0.09 0.62 0.17 -0.78 0.00 0.00 0.00 178.15 178.07 1wel h ASP 448 N -0.18 0.00 0.00 1.72 3.58 -0.15 0.32 116.42 121.71 1wel h ASP 448 Ca -0.08 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 1wel h ASP 448 Cb 1.34 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.39 1wel h ASP 448 CO 0.12 0.00 -0.04 0.15 -2.88 0.00 0.00 179.24 176.59 1wel h PHE 449 N 0.00 0.00 -1.40 0.28 3.57 -1.39 -3.36 116.94 114.65 1wel h PHE 449 Ca 0.03 0.00 -0.69 0.00 3.53 0.00 0.00 57.97 60.84 1wel h PHE 449 Cb 0.37 0.00 -0.31 0.00 2.79 0.00 0.00 35.95 38.80 1wel h PHE 449 CO 0.00 0.88 0.62 1.19 -2.23 0.00 0.00 178.31 178.77 1wel n PHE 450 N -4.63 3.11 -0.45 0.41 3.72 -0.80 -5.03 117.46 113.80 1wel n PHE 450 Ca -0.09 -2.69 -0.28 0.00 -0.05 0.00 0.00 57.45 54.34 1wel n PHE 450 Cb 0.42 -1.11 0.27 0.00 -0.94 0.00 0.00 39.48 38.13 1wel n PHE 450 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1wel s LYS 451 N -3.87 -1.36 -1.64 -1.08 1.02 0.03 -3.47 119.74 109.37 1wel s LYS 451 Ca 0.57 0.80 -0.01 0.00 0.02 0.00 0.00 55.97 57.35 1wel s LYS 451 Cb 0.46 -1.50 0.00 0.00 -0.52 0.00 0.00 37.83 36.27 1wel s LYS 451 CO -0.18 -4.01 0.08 1.63 -0.92 0.00 0.00 175.35 171.96 1wel n LYS 452 N -5.11 -2.19 -4.17 1.68 4.76 -1.26 -4.96 118.16 106.90 1wel n LYS 452 Ca 0.02 0.93 -0.11 0.00 -2.87 0.00 0.00 58.31 56.29 1wel n LYS 452 Cb 0.54 -5.61 -0.10 0.00 -1.84 0.00 0.00 35.03 28.02 1wel n LYS 452 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1wel s LEU 453 N -6.07 1.77 -0.65 -0.35 1.43 -1.23 -5.11 118.68 108.47 1wel s LEU 453 Ca 0.04 -1.22 -0.17 0.00 -1.03 0.00 0.00 54.13 51.75 1wel s LEU 453 Cb -0.02 0.25 0.14 0.00 0.03 0.00 0.00 46.19 46.58 1wel s LEU 453 CO 0.05 -0.72 0.69 -1.81 0.23 0.00 0.00 176.35 174.80 1wel s ASP 454 N -3.08 6.34 -0.14 2.29 1.11 -1.26 -5.03 116.67 116.90 1wel s ASP 454 Ca 0.26 -1.85 -0.00 0.00 0.18 0.00 0.00 52.55 51.13 1wel s ASP 454 Cb 0.07 -2.26 -0.01 0.00 1.07 0.00 0.00 42.92 41.79 1wel s ASP 454 CO 0.03 -0.92 -0.12 -0.63 1.18 0.00 0.00 175.17 174.70 1wel s ILE 455 N 1.84 3.06 -0.69 0.77 1.01 -1.26 -3.12 121.20 122.80 1wel s ILE 455 Ca 0.12 -0.65 -0.26 0.00 0.00 0.00 0.00 60.65 59.86 1wel s ILE 455 Cb -0.21 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 1wel s ILE 455 CO 0.01 0.52 1.96 -0.69 0.00 0.00 0.00 174.94 176.73 1wel s VAL 456 N 0.46 3.34 0.49 2.92 1.01 -1.22 -4.80 120.40 122.60 1wel s VAL 456 Ca -0.09 0.01 0.43 0.00 0.00 0.00 0.00 61.98 62.32 1wel s VAL 456 Cb -0.16 -3.84 0.63 0.00 0.00 0.00 0.00 36.38 33.01 1wel s VAL 456 CO 0.04 -0.81 1.42 -0.62 0.00 0.00 0.00 175.10 175.14 1wel n GLU 457 N 9.06 -0.01 -0.03 2.72 1.02 -1.26 0.13 120.64 132.27 1wel n GLU 457 Ca 0.29 1.02 -0.13 0.00 -0.02 0.00 0.00 57.16 58.32 1wel n GLU 457 Cb 0.50 -2.28 -0.11 0.00 -0.02 0.00 0.00 31.44 29.54 1wel n GLU 457 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1wel h ASP 458 N 0.00 -0.01 -0.42 1.62 5.19 -2.00 -3.31 116.42 117.49 1wel h ASP 458 Ca 0.85 -0.69 0.08 0.00 -0.62 0.00 0.00 57.03 56.65 1wel h ASP 458 Cb 3.28 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 42.72 1wel h ASP 458 CO -0.10 0.69 -0.05 0.77 -3.12 0.00 0.00 179.24 177.44 1wel h SER 459 N -0.73 -0.27 0.00 6.45 4.64 0.72 -3.41 113.55 120.95 1wel h SER 459 Ca -0.00 0.11 -0.56 0.00 -0.47 0.00 0.00 61.79 60.87 1wel h SER 459 Cb 0.70 0.21 -0.07 0.00 -0.31 0.00 0.00 62.40 62.94 1wel h SER 459 CO 0.00 -0.09 1.49 -0.38 -0.87 0.00 0.00 176.83 176.97 1wel n ILE 460 N -5.26 0.00 -5.13 0.95 5.41 -0.79 -4.78 119.36 109.77 1wel n ILE 460 Ca 0.03 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.46 1wel n ILE 460 Cb 0.22 -0.46 -0.15 0.00 -0.71 0.00 0.00 39.64 38.54 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 7.34 2.50 -0.04 1.39 6.14 -0.30 -4.98 117.35 129.40 1wel s TYR 461 Ca 1.21 -0.42 0.02 0.00 0.64 0.00 0.00 57.07 58.53 1wel s TYR 461 Cb -1.25 -1.58 0.01 0.00 0.42 0.00 0.00 41.96 39.55 1wel s TYR 461 CO 0.51 -0.01 -0.10 0.42 0.64 0.00 0.00 175.55 177.01 1wel s ILE 462 N -0.50 0.95 0.04 3.14 1.01 -1.26 0.07 121.20 124.64 1wel s ILE 462 Ca 0.07 -0.41 -0.28 0.00 0.00 0.00 0.00 60.65 60.03 1wel s ILE 462 Cb -0.11 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 1wel s ILE 462 CO 0.01 0.30 0.89 0.00 0.00 0.00 0.00 174.94 176.14 1wel s ALA 463 N 0.44 3.26 -0.04 9.38 0.00 -0.49 -5.02 121.76 129.28 1wel s ALA 463 Ca -0.08 0.44 0.06 0.00 0.00 0.00 0.00 51.96 52.38 1wel s ALA 463 Cb -0.12 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1wel s ALA 463 CO 0.02 -0.08 -0.22 0.71 0.00 0.00 0.00 175.76 176.18 1wel s TYR 464 N 0.43 2.48 0.93 0.00 2.02 -1.26 -2.80 117.35 119.16 1wel s TYR 464 Ca 0.45 -0.45 -0.12 0.00 -0.37 0.00 0.00 57.07 56.58 1wel s TYR 464 Cb -0.21 -1.58 0.15 0.00 -0.40 0.00 0.00 41.96 39.92 1wel s TYR 464 CO 0.26 -0.04 1.09 0.20 -1.57 0.00 0.00 175.55 175.50 1wel s GLY 465 N -0.47 1.60 0.00 0.71 0.00 0.12 -4.81 107.32 104.47 1wel s GLY 465 Ca 0.06 -0.16 0.15 0.00 0.00 0.00 0.00 44.72 44.76 1wel s GLY 465 CO 0.01 0.37 1.39 -1.55 0.00 0.00 0.00 173.10 173.31 1wel n PRO 466 N -3.98 0.30 -0.46 2.90 -0.04 -1.26 -2.04 135.00 130.42 1wel n PRO 466 Ca 0.06 0.10 0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1wel n PRO 466 Cb 0.56 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.79 1wel n PRO 466 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1wel n ASN 467 N -1.19 4.01 -1.80 3.54 4.13 -1.26 -4.94 115.26 117.74 1wel n ASN 467 Ca 0.09 -2.72 -0.13 0.00 1.68 0.00 0.00 54.58 53.49 1wel n ASN 467 Cb 0.10 -0.50 0.02 0.00 -1.54 0.00 0.00 39.78 37.85 1wel n ASN 467 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wel n GLY 468 N 0.04 -0.05 2.90 7.41 0.00 -0.86 -5.02 105.19 109.59 1wel n GLY 468 Ca 0.21 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 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 -5.11 0.84 -0.10 1.61 -0.14 -1.25 -4.93 119.74 110.67 1wel s LYS 469 Ca 0.15 -0.11 -0.36 0.00 -1.36 0.00 0.00 55.97 54.28 1wel s LYS 469 Cb -0.06 -0.85 -0.14 0.00 -1.68 0.00 0.00 37.83 35.10 1wel s LYS 469 CO 0.18 -0.08 1.73 0.00 -0.76 0.00 0.00 175.35 176.42 1wel n ALA 470 N 4.04 0.36 0.22 5.17 0.00 0.95 0.15 120.51 131.38 1wel n ALA 470 Ca -0.25 0.37 0.08 0.00 0.00 0.00 0.00 53.44 53.64 1wel n ALA 470 Cb 0.51 -2.33 0.49 0.00 0.00 0.00 0.00 19.45 18.11 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 4.86 0.80 0.00 0.00 1.35 -1.81 -3.38 112.91 114.72 1wel h THR 471 Ca -0.47 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.31 1wel h THR 471 Cb 1.29 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 1wel h THR 471 CO 0.92 0.26 0.00 0.61 -0.25 0.00 0.00 175.52 177.06 1wel n GLY 472 N -0.22 1.07 3.10 5.82 0.00 -1.26 -4.96 105.19 108.74 1wel n GLY 472 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.04 0.25 0.22 1.61 2.02 -1.26 -1.91 118.70 119.58 1wel s GLU 473 Ca 0.00 0.45 -0.04 0.00 0.02 0.00 0.00 54.97 55.40 1wel s GLU 473 Cb 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 34.13 34.20 1wel s GLU 473 CO 0.00 -0.10 0.23 0.20 0.02 0.00 0.00 175.26 175.60 1wel s GLY 474 N 0.75 1.23 -0.05 -1.39 0.00 -0.69 -1.39 107.32 105.77 1wel s GLY 474 Ca -0.05 -1.49 -0.07 0.00 0.00 0.00 0.00 44.72 43.11 1wel s GLY 474 CO -0.05 -1.20 0.18 -1.36 0.00 0.00 0.00 173.10 170.68 1wel s PHE 475 N -4.09 -0.16 0.02 1.90 0.08 0.11 -2.08 117.98 113.77 1wel s PHE 475 Ca 0.35 0.37 0.01 0.00 0.12 0.00 0.00 56.93 57.77 1wel s PHE 475 Cb 0.05 0.05 -0.02 0.00 -0.57 0.00 0.00 43.02 42.53 1wel s PHE 475 CO 0.12 -0.15 -0.04 0.08 -0.10 0.00 0.00 175.22 175.13 1wel s VAL 476 N -0.25 0.21 -0.15 -0.44 1.01 -0.86 -1.15 120.40 118.76 1wel s VAL 476 Ca -0.03 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1wel s VAL 476 Cb -0.03 -0.33 0.04 0.00 0.00 0.00 0.00 36.38 36.06 1wel s VAL 476 CO 0.01 -0.43 -0.04 -0.70 0.00 0.00 0.00 175.10 173.93 1wel s GLU 477 N -1.38 1.31 -0.27 2.72 2.12 -1.26 0.23 118.70 122.18 1wel s GLU 477 Ca -0.13 -0.42 -0.24 0.00 0.36 0.00 0.00 54.97 54.53 1wel s GLU 477 Cb -0.09 -1.88 -0.00 0.00 0.26 0.00 0.00 34.13 32.42 1wel s GLU 477 CO -0.01 -0.42 0.80 -0.06 -0.54 0.00 0.00 175.26 175.03 1wel s PHE 478 N 1.69 3.26 0.13 5.30 0.08 -0.60 -3.40 117.98 124.43 1wel s PHE 478 Ca 0.01 0.98 -0.31 0.00 0.12 0.00 0.00 56.93 57.74 1wel s PHE 478 Cb -0.15 -3.11 -0.07 0.00 -0.57 0.00 0.00 43.02 39.12 1wel s PHE 478 CO -0.08 -0.46 1.57 0.00 -0.10 0.00 0.00 175.22 176.15 1wel h ARG 479 N 7.88 -0.47 -7.63 0.44 2.47 -1.85 -3.40 114.38 111.81 1wel h ARG 479 Ca -0.24 0.03 -0.44 0.00 -1.26 0.00 0.00 59.98 58.08 1wel h ARG 479 Cb 1.10 0.11 0.17 0.00 -1.65 0.00 0.00 29.97 29.69 1wel h ARG 479 CO 0.87 -0.31 0.31 -0.80 0.56 0.00 0.00 179.97 180.60 1wel s ASN 480 N -4.91 2.50 -0.25 7.04 0.01 -1.26 -4.91 114.94 113.16 1wel s ASN 480 Ca -0.15 0.50 -0.13 0.00 -0.71 0.00 0.00 52.86 52.36 1wel s ASN 480 Cb 0.09 -0.69 -0.10 0.00 0.41 0.00 0.00 41.25 40.95 1wel s ASN 480 CO 0.63 -3.13 -0.33 1.21 -1.51 0.00 0.00 177.10 173.97 1wel n GLU 481 N -4.08 0.54 -0.24 -0.60 2.13 -1.26 -4.04 120.64 113.08 1wel n GLU 481 Ca 0.13 0.23 0.23 0.00 0.66 0.00 0.00 57.16 58.41 1wel n GLU 481 Cb 0.59 -1.40 0.58 0.00 0.27 0.00 0.00 31.44 31.48 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 -0.92 2.41 0.00 4.31 0.00 -1.97 0.61 119.26 123.71 1wel h ALA 482 Ca -0.59 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 1wel h ALA 482 Cb 1.51 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1wel h ALA 482 CO -0.36 -0.71 -0.39 0.38 0.00 0.00 0.00 179.25 178.17 1wel h ASP 483 N 0.28 0.00 -0.09 0.00 2.03 -1.97 -3.24 116.42 113.43 1wel h ASP 483 Ca 0.48 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.68 1wel h ASP 483 Cb 1.41 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.92 1wel h ASP 483 CO -0.15 0.39 -0.34 0.22 -1.03 0.00 0.00 179.24 178.34 1wel h TYR 484 N 0.00 0.52 -0.95 4.15 3.20 0.06 -3.10 116.97 120.85 1wel h TYR 484 Ca -0.00 -0.22 0.07 0.00 3.14 0.00 0.00 58.73 61.72 1wel h TYR 484 Cb 1.18 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.30 1wel h TYR 484 CO 0.00 0.95 0.60 0.87 -1.64 0.00 0.00 178.16 178.94 1wel h LYS 485 N -0.07 1.03 -0.96 1.82 1.57 -1.41 -1.57 116.57 116.97 1wel h LYS 485 Ca -0.02 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1wel h LYS 485 Cb 0.98 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 33.01 1wel h LYS 485 CO 0.07 0.68 0.60 0.00 -0.57 0.00 0.00 179.45 180.23 1wel h ALA 486 N 1.45 1.24 -0.89 3.86 0.00 -1.58 -2.46 119.26 120.89 1wel h ALA 486 Ca 0.42 -0.09 0.18 0.00 0.00 0.00 0.00 54.91 55.42 1wel h ALA 486 Cb 0.23 -0.39 -0.11 0.00 0.00 0.00 0.00 17.79 17.53 1wel h ALA 486 CO -0.19 0.66 0.45 0.00 0.00 0.00 0.00 179.25 180.17 1wel h ALA 487 N 1.34 1.41 -0.13 0.00 0.00 -1.20 0.24 119.26 120.92 1wel h ALA 487 Ca 0.35 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.29 1wel h ALA 487 Cb -0.09 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1wel h ALA 487 CO -0.07 -0.18 -0.27 -0.07 0.00 0.00 0.00 179.25 178.66 1wel h LEU 488 N 0.56 0.23 0.00 0.00 -0.00 -1.43 -1.94 115.31 112.73 1wel h LEU 488 Ca 0.52 -0.07 0.00 0.00 -0.00 0.00 0.00 57.88 58.33 1wel h LEU 488 Cb 0.85 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 1wel h LEU 488 CO -0.43 0.51 0.00 0.00 -0.00 0.00 0.00 178.44 178.52 1wel n ARG 490 N -1.33 3.76 -3.15 0.00 1.74 -0.73 -5.02 116.66 111.94 1wel n ARG 490 Ca 0.05 -4.23 -0.21 0.00 -0.77 0.00 0.00 57.85 52.69 1wel n ARG 490 Cb 0.10 -2.32 0.01 0.00 -1.02 0.00 0.00 32.46 29.23 1wel n ARG 490 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1wel s HIS 491 N -3.98 3.14 -1.33 -1.55 2.46 -1.19 -4.49 115.29 108.34 1wel s HIS 491 Ca 0.47 0.01 -0.03 0.00 0.47 0.00 0.00 55.06 55.98 1wel s HIS 491 Cb 0.34 -2.23 0.02 0.00 -0.13 0.00 0.00 32.58 30.57 1wel s HIS 491 CO -0.25 -0.27 0.87 1.17 -2.47 0.00 0.00 174.74 173.79 1wel n LYS 492 N -1.92 -5.73 -4.09 2.88 4.81 -1.26 -4.99 118.16 107.86 1wel n LYS 492 Ca 0.02 0.69 -0.23 0.00 -0.87 0.00 0.00 58.31 57.92 1wel n LYS 492 Cb 0.58 -5.46 -0.06 0.00 0.02 0.00 0.00 35.03 30.11 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 -6.00 2.49 -0.19 1.64 -1.52 -1.23 -5.03 119.66 109.83 1wel s GLN 493 Ca 0.18 -1.41 0.01 0.00 -1.95 0.00 0.00 55.36 52.19 1wel s GLN 493 Cb -0.09 -2.28 0.03 0.00 -0.22 0.00 0.00 33.01 30.45 1wel s GLN 493 CO 0.79 0.19 -0.17 0.71 -0.25 0.00 0.00 175.29 176.57 1wel s TYR 494 N -2.35 2.69 -1.14 0.91 1.51 -1.26 -1.90 117.35 115.81 1wel s TYR 494 Ca 0.36 -1.65 -0.24 0.00 -1.01 0.00 0.00 57.07 54.54 1wel s TYR 494 Cb -0.05 -1.83 -0.11 0.00 -0.11 0.00 0.00 41.96 39.86 1wel s TYR 494 CO 0.23 -0.78 1.98 1.41 -1.11 0.00 0.00 175.55 177.28 1wel s MET 495 N 1.31 2.21 0.00 -0.62 1.75 0.22 -4.54 119.30 119.64 1wel s MET 495 Ca 0.02 -0.93 0.00 0.00 -1.25 0.00 0.00 55.69 53.53 1wel s MET 495 Cb -0.14 -5.17 0.00 0.00 2.84 0.00 0.00 34.83 32.36 1wel s MET 495 CO -0.11 -4.27 0.00 0.41 -0.65 0.00 0.00 175.02 170.40 1wel n GLY 496 N 5.96 1.38 0.00 2.11 0.00 -1.26 -2.11 105.19 111.27 1wel n GLY 496 Ca 0.44 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1wel n GLY 496 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wel n ASN 497 N 2.88 0.29 -4.81 1.61 2.85 -1.26 -5.08 115.26 111.73 1wel n ASN 497 Ca 0.00 -0.70 -0.22 0.00 -0.11 0.00 0.00 54.58 53.55 1wel n ASN 497 Cb 0.00 0.19 -0.05 0.00 1.24 0.00 0.00 39.78 41.16 1wel n ASN 497 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1wel s ARG 498 N -0.19 2.49 -0.11 1.20 1.81 -0.90 -5.11 118.95 118.14 1wel s ARG 498 Ca 0.00 -1.53 0.01 0.00 -1.72 0.00 0.00 55.73 52.49 1wel s ARG 498 Cb 0.00 -2.29 -0.02 0.00 -0.45 0.00 0.00 34.95 32.19 1wel s ARG 498 CO 0.00 -0.04 -0.14 0.12 -0.68 0.00 0.00 175.30 174.56 1wel s PHE 499 N -2.44 2.76 0.03 -0.53 5.36 -1.26 0.71 117.98 122.60 1wel s PHE 499 Ca 0.43 -0.57 0.03 0.00 -0.96 0.00 0.00 56.93 55.86 1wel s PHE 499 Cb -0.03 -1.78 -0.02 0.00 -0.34 0.00 0.00 43.02 40.86 1wel s PHE 499 CO 0.25 -0.14 -0.08 0.42 -1.46 0.00 0.00 175.22 174.21 1wel s ILE 500 N 0.10 0.62 -0.06 3.12 1.09 -0.80 -4.41 121.20 120.86 1wel s ILE 500 Ca -0.06 -0.80 -0.01 0.00 -1.10 0.00 0.00 60.65 58.67 1wel s ILE 500 Cb -0.15 -0.61 -0.03 0.00 -1.06 0.00 0.00 42.46 40.61 1wel s ILE 500 CO 0.05 -0.15 0.01 -1.10 -0.10 0.00 0.00 174.94 173.65 1wel s GLN 501 N -1.04 2.97 -0.21 2.79 -0.21 0.95 -3.50 119.66 121.41 1wel s GLN 501 Ca -0.04 -0.44 -0.05 0.00 0.02 0.00 0.00 55.36 54.85 1wel s GLN 501 Cb -0.07 -2.79 -0.02 0.00 1.00 0.00 0.00 33.01 31.13 1wel s GLN 501 CO 0.00 0.69 -0.01 0.08 -2.12 0.00 0.00 175.29 173.93 1wel s VAL 502 N -0.96 3.84 -0.01 1.09 1.01 -1.26 -2.09 120.40 122.02 1wel s VAL 502 Ca 0.15 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1wel s VAL 502 Cb -0.11 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.54 1wel s VAL 502 CO 0.05 0.42 0.01 -1.00 0.00 0.00 0.00 175.10 174.58 1wel s HIS 503 N 1.11 0.04 0.25 5.22 3.76 -0.84 -4.89 115.29 119.94 1wel s HIS 503 Ca 0.02 0.04 -0.30 0.00 -0.15 0.00 0.00 55.06 54.68 1wel s HIS 503 Cb -0.14 -0.11 -0.09 0.00 1.11 0.00 0.00 32.58 33.34 1wel s HIS 503 CO 0.01 -0.04 1.27 -1.25 -0.85 0.00 0.00 174.74 173.88 1wel s PRO 504 N 0.42 4.43 0.00 8.40 0.04 -1.26 -0.29 135.00 146.74 1wel s PRO 504 Ca -0.04 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.05 1wel s PRO 504 Cb -0.05 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.32 1wel s PRO 504 CO -0.01 -0.15 0.01 -1.50 0.04 0.00 0.00 177.00 175.39 1wel s ILE 505 N -0.47 0.05 0.12 0.56 2.07 -1.22 -4.84 121.20 117.46 1wel s ILE 505 Ca 0.52 -0.41 -0.30 0.00 -1.41 0.00 0.00 60.65 59.06 1wel s ILE 505 Cb -0.36 -0.15 -0.06 0.00 0.13 0.00 0.00 42.46 42.01 1wel s ILE 505 CO 0.43 -0.22 1.05 0.42 -1.91 0.00 0.00 174.94 174.71 1wel s THR 506 N -0.66 4.23 0.14 4.00 -4.23 -1.26 -3.80 115.64 114.06 1wel s THR 506 Ca -0.07 1.81 -0.28 0.00 -1.18 0.00 0.00 61.69 61.97 1wel s THR 506 Cb -0.05 -4.15 -0.06 0.00 1.34 0.00 0.00 72.50 69.58 1wel s THR 506 CO -0.00 0.25 1.39 1.17 -0.54 0.00 0.00 174.62 176.89 1wel n LYS 507 N 2.92 -0.39 -0.18 3.99 0.00 -1.26 0.31 118.16 123.55 1wel n LYS 507 Ca 0.04 1.36 -0.05 0.00 0.00 0.00 0.00 58.31 59.66 1wel n LYS 507 Cb 0.48 -2.00 0.01 0.00 0.00 0.00 0.00 35.03 33.52 1wel n LYS 507 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1wel h LYS 508 N 0.00 -0.15 -0.19 1.64 3.64 -1.92 0.19 116.57 119.77 1wel h LYS 508 Ca 0.14 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1wel h LYS 508 Cb 0.36 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1wel h LYS 508 CO -0.84 -0.10 -0.03 0.78 -2.27 0.00 0.00 179.45 176.99 1wel h GLY 509 N -0.15 0.31 0.98 5.01 0.00 -0.92 -2.36 103.07 105.93 1wel h GLY 509 Ca 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1wel h GLY 509 CO -0.63 0.15 0.27 1.98 0.00 0.00 0.00 176.54 178.31 1wel h MET 510 N 0.28 0.69 -0.41 4.80 1.85 0.29 -2.77 114.93 119.66 1wel h MET 510 Ca 0.06 -0.08 -0.12 0.00 -0.61 0.00 0.00 59.70 58.95 1wel h MET 510 Cb 0.25 -0.14 -0.01 0.00 0.43 0.00 0.00 31.60 32.13 1wel h MET 510 CO 0.01 0.54 -0.24 -0.07 -0.40 0.00 0.00 176.91 176.75 1wel h LEU 511 N 0.66 0.86 -0.85 3.39 3.38 -0.97 -3.04 115.31 118.73 1wel h LEU 511 Ca 0.17 -0.32 0.15 0.00 0.09 0.00 0.00 57.88 57.97 1wel h LEU 511 Cb 0.05 -0.24 -0.15 0.00 0.09 0.00 0.00 40.66 40.41 1wel h LEU 511 CO -0.03 1.06 -0.31 -0.33 0.09 0.00 0.00 178.44 178.92 1wel h GLU 512 N 0.73 -0.04 0.23 1.13 4.39 -1.13 0.25 114.58 120.14 1wel h GLU 512 Ca 0.10 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 1wel h GLU 512 Cb 0.77 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 1wel h GLU 512 CO 0.06 -0.03 -0.11 0.87 -1.16 0.00 0.00 179.01 178.65 1wel h LYS 513 N -0.04 -0.29 -0.98 2.33 1.57 -1.56 -2.86 116.57 114.74 1wel h LYS 513 Ca 0.35 0.02 0.28 0.00 -1.87 0.00 0.00 60.65 59.43 1wel h LYS 513 Cb 0.60 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 1wel h LYS 513 CO -0.88 0.03 0.94 0.82 -0.57 0.00 0.00 179.45 179.79 1wel h ILE 514 N -0.66 0.19 0.04 1.86 2.04 -1.10 0.25 117.51 120.13 1wel h ILE 514 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1wel h ILE 514 Cb 0.47 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1wel h ILE 514 CO 0.05 0.00 -0.02 -0.78 0.00 0.00 0.00 178.15 177.40 1wel h ASP 515 N 0.00 -0.04 -0.08 1.72 3.58 -0.78 -2.83 116.42 117.99 1wel h ASP 515 Ca 0.47 -0.66 -0.03 0.00 0.42 0.00 0.00 57.03 57.23 1wel h ASP 515 Cb 2.34 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 43.38 1wel h ASP 515 CO -0.00 0.72 -0.02 0.00 -2.88 0.00 0.00 179.24 177.06 1wel h MET 516 N -0.89 0.26 -0.39 0.28 -0.00 -0.47 -2.37 114.93 111.35 1wel h MET 516 Ca -0.00 -0.04 -0.10 0.00 -0.00 0.00 0.00 59.70 59.56 1wel h MET 516 Cb 0.69 -0.05 -0.01 0.00 -0.00 0.00 0.00 31.60 32.24 1wel h MET 516 CO 0.01 0.30 -0.14 0.82 -0.00 0.00 0.00 176.91 177.90 1wel h ILE 517 N 0.26 1.28 -0.72 -0.10 2.04 -0.88 -3.11 117.51 116.27 1wel h ILE 517 Ca 0.06 -1.24 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 1wel h ILE 517 Cb 0.21 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 1wel h ILE 517 CO 0.01 0.41 0.25 0.03 0.00 0.00 0.00 178.15 178.85 1wel h ARG 518 N 0.58 1.10 0.00 2.37 3.08 -1.19 -1.84 114.38 118.47 1wel h ARG 518 Ca 0.09 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1wel h ARG 518 Cb 0.67 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1wel h ARG 518 CO 0.05 0.93 0.15 0.87 -1.07 0.00 0.00 179.97 180.89 1wel h LYS 519 N 1.05 0.00 0.00 0.04 1.79 -1.37 0.43 116.57 118.51 1wel h LYS 519 Ca 0.24 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.52 1wel h LYS 519 Cb 0.26 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1wel h LYS 519 CO -0.01 0.00 -1.43 0.00 -1.08 0.00 0.00 179.45 176.93 1wel h ARG 520 N 0.00 0.00 0.00 3.15 2.47 -1.37 -3.36 114.38 115.26 1wel h ARG 520 Ca 0.00 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.43 1wel h ARG 520 Cb 0.29 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.56 1wel h ARG 520 CO 0.00 0.33 -1.93 1.28 0.56 0.00 0.00 179.97 180.21 1wel n LEU 521 N -2.92 0.52 -4.73 3.04 4.77 0.11 -4.88 117.00 112.92 1wel n LEU 521 Ca -0.10 0.25 -0.42 0.00 -0.03 0.00 0.00 56.01 55.71 1wel n LEU 521 Cb 0.87 0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 42.20 1wel n LEU 521 CO 0.43 0.38 0.93 0.00 -1.33 0.00 0.00 177.39 177.81 1wel s GLN 522 N -2.63 4.43 -0.37 3.23 -2.07 0.94 -5.01 119.66 118.18 1wel s GLN 522 Ca -0.06 1.92 -0.03 0.00 -1.82 0.00 0.00 55.36 55.36 1wel s GLN 522 Cb 0.08 -3.26 0.08 0.00 -1.09 0.00 0.00 33.01 28.82 1wel s GLN 522 CO 0.83 -0.21 0.13 -1.12 -1.32 0.00 0.00 175.29 173.60 1wel s SER 523 N 0.53 5.15 -0.15 12.60 0.01 -1.26 -4.90 113.70 125.68 1wel s SER 523 Ca 0.57 -1.71 -0.30 0.00 1.31 0.00 0.00 55.95 55.82 1wel s SER 523 Cb -0.33 -1.80 0.12 0.00 0.21 0.00 0.00 66.02 64.22 1wel s SER 523 CO 0.34 -0.44 0.95 -0.83 0.41 0.00 0.00 173.24 173.68 1wel s GLY 524 N 1.60 -0.30 0.25 3.44 0.00 -1.26 -5.02 107.32 106.03 1wel s GLY 524 Ca 0.03 1.98 0.23 0.00 0.00 0.00 0.00 44.72 46.96 1wel s GLY 524 CO -0.03 1.09 1.70 -1.55 0.00 0.00 0.00 173.10 174.31 1wel n PRO 525 N 0.89 0.18 -2.57 2.90 -0.04 -1.26 -4.74 135.00 130.37 1wel n PRO 525 Ca -0.12 0.42 -0.41 0.00 -0.04 0.00 0.00 63.50 63.35 1wel n PRO 525 Cb 0.58 -1.86 -0.04 0.00 -0.04 0.00 0.00 33.50 32.14 1wel n PRO 525 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1wel s SER 526 N -4.18 7.29 0.13 3.54 0.01 -1.26 -4.96 113.70 114.27 1wel s SER 526 Ca 0.04 1.96 -0.21 0.00 1.31 0.00 0.00 55.95 59.06 1wel s SER 526 Cb 0.09 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1wel s SER 526 CO 0.38 -0.24 1.70 -1.28 0.41 0.00 0.00 173.24 174.21 1wel h SER 527 N 5.74 -0.23 0.00 2.44 0.87 -2.05 -3.52 113.55 116.81 1wel h SER 527 Ca -0.43 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1wel h SER 527 Cb 1.21 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1wel h SER 527 CO 0.74 -0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.57