#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wj2 s GLN 400 N 0.00 2.91 0.23 7.34 2.00 -1.26 -5.11 119.66 125.77 1wj2 s GLN 400 Ca 0.00 -0.48 -0.14 0.00 -2.00 0.00 0.00 55.36 52.74 1wj2 s GLN 400 Cb 0.00 -2.74 0.01 0.00 0.80 0.00 0.00 33.01 31.07 1wj2 s GLN 400 CO 0.00 0.68 0.50 0.99 -0.50 0.00 0.00 175.29 176.96 1wj2 s THR 401 N -0.94 0.01 -0.03 -0.34 2.01 -1.26 -5.11 115.64 109.99 1wj2 s THR 401 Ca 0.15 -1.22 -0.01 0.00 0.31 0.00 0.00 61.69 60.92 1wj2 s THR 401 Cb -0.11 -2.01 -0.00 0.00 0.01 0.00 0.00 72.50 70.38 1wj2 s THR 401 CO 0.05 -0.05 -0.02 0.74 -0.69 0.00 0.00 174.62 174.64 1wj2 h THR 402 N 2.24 0.00 -3.30 -0.82 2.02 -2.06 -3.47 112.91 107.52 1wj2 h THR 402 Ca -0.26 -0.28 -0.67 0.00 0.77 0.00 0.00 66.41 65.97 1wj2 h THR 402 Cb 1.25 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.52 1wj2 h THR 402 CO 0.35 0.00 -0.62 -0.94 0.37 0.00 0.00 175.52 174.68 1wj2 s SER 403 N -3.90 5.27 -0.59 4.18 1.04 -1.26 -5.02 113.70 113.42 1wj2 s SER 403 Ca -0.02 0.09 -0.04 0.00 0.48 0.00 0.00 55.95 56.46 1wj2 s SER 403 Cb 0.00 -1.45 0.07 0.00 0.10 0.00 0.00 66.02 64.74 1wj2 s SER 403 CO 0.03 0.33 2.71 1.21 0.98 0.00 0.00 173.24 178.50 1wj2 n GLU 404 N 1.74 2.76 -1.93 4.02 2.13 -1.26 -4.81 120.64 123.29 1wj2 n GLU 404 Ca -0.16 -2.54 -0.41 0.00 0.66 0.00 0.00 57.16 54.71 1wj2 n GLU 404 Cb 0.53 -2.22 -0.00 0.00 0.27 0.00 0.00 31.44 30.02 1wj2 n GLU 404 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1wj2 n VAL 405 N 0.99 4.33 0.02 6.31 0.24 -1.26 -4.56 118.33 124.40 1wj2 n VAL 405 Ca 0.51 -3.73 -0.10 0.00 -2.04 0.00 0.00 64.34 58.97 1wj2 n VAL 405 Cb 0.50 -2.40 -0.14 0.00 -1.47 0.00 0.00 33.84 30.34 1wj2 n VAL 405 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1wj2 h ASP 406 N 5.42 0.09 -1.59 -1.34 5.19 -2.06 -3.42 116.42 118.71 1wj2 h ASP 406 Ca 0.59 -0.14 -0.64 0.00 -0.62 0.00 0.00 57.03 56.21 1wj2 h ASP 406 Cb 0.50 -0.03 -0.13 0.00 0.18 0.00 0.00 39.33 39.85 1wj2 h ASP 406 CO 1.69 1.12 1.32 -0.76 -3.12 0.00 0.00 179.24 179.49 1wj2 s LEU 407 N -6.46 4.14 -0.50 1.55 2.01 -1.26 -4.97 118.68 113.19 1wj2 s LEU 407 Ca -0.05 -1.82 -0.28 0.00 0.01 0.00 0.00 54.13 52.00 1wj2 s LEU 407 Cb 0.08 -2.50 0.03 0.00 0.01 0.00 0.00 46.19 43.81 1wj2 s LEU 407 CO 0.83 -1.29 1.09 -0.22 1.01 0.00 0.00 176.35 177.77 1wj2 s LEU 408 N 3.95 3.71 -1.20 1.79 2.96 -1.26 -4.96 118.68 123.68 1wj2 s LEU 408 Ca 0.42 0.24 -0.20 0.00 -0.22 0.00 0.00 54.13 54.37 1wj2 s LEU 408 Cb -0.01 -3.33 0.06 0.00 0.50 0.00 0.00 46.19 43.40 1wj2 s LEU 408 CO -0.08 -1.26 1.65 -0.62 -1.32 0.00 0.00 176.35 174.72 1wj2 s ASP 409 N 2.56 6.65 -0.07 3.68 -1.08 -1.26 -4.54 116.67 122.61 1wj2 s ASP 409 Ca 0.43 -2.06 -0.03 0.00 -0.52 0.00 0.00 52.55 50.37 1wj2 s ASP 409 Cb -0.08 -2.58 -0.03 0.00 -1.46 0.00 0.00 42.92 38.77 1wj2 s ASP 409 CO 0.28 -1.36 -0.09 -0.67 0.52 0.00 0.00 175.17 173.85 1wj2 n ASP 410 N 8.80 1.02 -0.04 -0.34 -0.08 -1.26 -4.90 116.55 119.75 1wj2 n ASP 410 Ca 0.43 0.07 -0.02 0.00 -1.51 0.00 0.00 54.79 53.77 1wj2 n ASP 410 Cb 0.48 -0.20 -0.01 0.00 2.34 0.00 0.00 41.12 43.73 1wj2 n ASP 410 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1wj2 h GLY 411 N -0.13 0.00 -2.16 0.27 0.00 -1.91 -3.44 103.07 95.70 1wj2 h GLY 411 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.76 1wj2 h GLY 411 CO -0.10 0.00 -0.58 -0.19 0.00 0.00 0.00 176.54 175.67 1wj2 s TYR 412 N -1.62 1.54 -0.60 5.60 2.02 -1.26 -4.37 117.35 118.66 1wj2 s TYR 412 Ca -0.06 -1.32 -0.17 0.00 -0.37 0.00 0.00 57.07 55.15 1wj2 s TYR 412 Cb 0.01 -0.84 0.13 0.00 -0.40 0.00 0.00 41.96 40.86 1wj2 s TYR 412 CO 0.08 -0.48 0.63 1.03 -1.57 0.00 0.00 175.55 175.23 1wj2 s ARG 413 N -3.91 3.09 0.20 -0.62 0.52 -1.26 -4.73 118.95 112.24 1wj2 s ARG 413 Ca 0.37 -1.64 0.05 0.00 -0.52 0.00 0.00 55.73 53.99 1wj2 s ARG 413 Cb 0.06 -4.32 -0.03 0.00 0.52 0.00 0.00 34.95 31.18 1wj2 s ARG 413 CO 0.16 -1.42 0.23 -1.58 0.02 0.00 0.00 175.30 172.71 1wj2 s TRP 414 N 1.92 3.27 -0.14 -0.53 0.52 -1.26 -1.03 118.94 121.69 1wj2 s TRP 414 Ca 0.09 -0.02 -0.09 0.00 0.02 0.00 0.00 56.10 56.10 1wj2 s TRP 414 Cb -0.25 -1.53 0.05 0.00 -1.15 0.00 0.00 33.47 30.60 1wj2 s TRP 414 CO 0.03 0.50 0.35 0.50 0.02 0.00 0.00 176.95 178.35 1wj2 s ARG 415 N -3.53 0.34 0.53 4.98 3.52 -0.84 -4.86 118.95 119.09 1wj2 s ARG 415 Ca 0.33 0.66 -0.19 0.00 -0.13 0.00 0.00 55.73 56.39 1wj2 s ARG 415 Cb -0.09 -0.01 -0.07 0.00 -1.56 0.00 0.00 34.95 33.22 1wj2 s ARG 415 CO 0.26 -0.14 1.08 0.21 -0.81 0.00 0.00 175.30 175.91 1wj2 s LYS 416 N 1.12 3.52 0.00 5.12 2.20 -1.26 -2.29 119.74 128.15 1wj2 s LYS 416 Ca -0.08 1.47 0.00 0.00 -0.36 0.00 0.00 55.97 57.00 1wj2 s LYS 416 Cb -0.08 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.20 1wj2 s LYS 416 CO -0.09 -0.68 0.00 2.48 -0.36 0.00 0.00 175.35 176.70 1wj2 n TYR 417 N -1.25 0.00 -3.71 4.03 0.18 -1.23 -4.98 117.16 110.20 1wj2 n TYR 417 Ca 0.10 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.73 1wj2 n TYR 417 Cb 0.52 0.30 -0.15 0.00 -0.38 0.00 0.00 39.34 39.63 1wj2 n TYR 417 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1wj2 s GLY 418 N -4.33 0.01 0.16 -7.48 0.00 -1.26 -5.12 107.32 89.30 1wj2 s GLY 418 Ca 0.00 0.63 0.05 0.00 0.00 0.00 0.00 44.72 45.40 1wj2 s GLY 418 CO 0.00 1.36 0.15 -0.86 0.00 0.00 0.00 173.10 173.75 1wj2 s GLN 419 N 1.76 2.95 -0.04 2.90 -2.07 -1.26 -3.57 119.66 120.33 1wj2 s GLN 419 Ca -0.03 -0.84 0.03 0.00 -1.82 0.00 0.00 55.36 52.70 1wj2 s GLN 419 Cb -0.12 -2.68 0.00 0.00 -1.09 0.00 0.00 33.01 29.13 1wj2 s GLN 419 CO -0.06 0.49 -0.14 0.15 -1.32 0.00 0.00 175.29 174.41 1wj2 s LYS 420 N -3.11 1.50 0.04 9.60 -0.14 -1.05 -5.02 119.74 121.56 1wj2 s LYS 420 Ca 0.31 -0.47 -0.00 0.00 -1.36 0.00 0.00 55.97 54.45 1wj2 s LYS 420 Cb -0.10 -1.31 -0.04 0.00 -1.68 0.00 0.00 37.83 34.70 1wj2 s LYS 420 CO 0.24 0.16 0.17 0.54 -0.76 0.00 0.00 175.35 175.70 1wj2 s VAL 421 N 0.21 5.21 -0.13 3.17 0.11 -1.26 -1.09 120.40 126.61 1wj2 s VAL 421 Ca -0.06 -0.39 -0.00 0.00 -2.93 0.00 0.00 61.98 58.60 1wj2 s VAL 421 Cb -0.11 -3.49 0.03 0.00 -1.53 0.00 0.00 36.38 31.27 1wj2 s VAL 421 CO 0.02 0.21 -0.09 -0.69 -3.33 0.00 0.00 175.10 171.21 1wj2 s VAL 422 N -1.41 1.23 0.06 2.04 1.01 -1.26 -4.93 120.40 117.14 1wj2 s VAL 422 Ca 0.31 -0.47 -0.31 0.00 0.00 0.00 0.00 61.98 61.52 1wj2 s VAL 422 Cb -0.13 -1.24 -0.06 0.00 0.00 0.00 0.00 36.38 34.95 1wj2 s VAL 422 CO 0.23 0.36 1.29 -0.54 0.00 0.00 0.00 175.10 176.44 1wj2 s LYS 423 N 1.62 4.37 0.00 2.72 3.01 -1.26 -2.87 119.74 127.32 1wj2 s LYS 423 Ca 0.04 1.89 0.00 0.00 -1.01 0.00 0.00 55.97 56.90 1wj2 s LYS 423 Cb -0.13 -3.36 0.00 0.00 -1.01 0.00 0.00 37.83 33.33 1wj2 s LYS 423 CO -0.09 -0.37 0.00 0.41 0.51 0.00 0.00 175.35 175.81 1wj2 n GLY 424 N 3.38 3.06 3.72 -3.33 0.00 -1.26 -5.04 105.19 105.72 1wj2 n GLY 424 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1wj2 n GLY 424 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wj2 s ASN 425 N 0.53 6.71 0.40 1.61 -0.87 -1.14 -4.96 114.94 117.21 1wj2 s ASN 425 Ca 0.00 0.85 0.27 0.00 -1.57 0.00 0.00 52.86 52.41 1wj2 s ASN 425 Cb 0.00 -2.30 0.89 0.00 -0.02 0.00 0.00 41.25 39.81 1wj2 s ASN 425 CO 0.00 -0.03 1.78 1.55 -2.57 0.00 0.00 177.10 177.83 1wj2 h PRO 426 N 6.79 0.00 -3.98 -0.60 0.13 -1.96 -3.40 132.00 128.99 1wj2 h PRO 426 Ca -0.40 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.02 1wj2 h PRO 426 Cb 1.18 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.97 1wj2 h PRO 426 CO 0.75 0.00 -0.39 0.71 -0.23 0.00 0.00 178.00 178.84 1wj2 s TYR 427 N -3.36 3.49 0.53 1.56 2.02 -1.26 -5.09 117.35 115.24 1wj2 s TYR 427 Ca 0.05 -2.45 -0.07 0.00 -0.37 0.00 0.00 57.07 54.23 1wj2 s TYR 427 Cb 0.08 -3.30 0.12 0.00 -0.40 0.00 0.00 41.96 38.47 1wj2 s TYR 427 CO 0.56 -0.91 0.26 -2.30 -1.57 0.00 0.00 175.55 171.59 1wj2 n PRO 428 N 4.06 -1.44 -4.75 -1.71 -0.02 -1.26 -4.61 135.00 125.27 1wj2 n PRO 428 Ca 0.03 -0.44 -0.31 0.00 -2.02 0.00 0.00 63.50 60.76 1wj2 n PRO 428 Cb 0.40 -0.75 -0.13 0.00 -0.02 0.00 0.00 33.50 33.00 1wj2 n PRO 428 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1wj2 s ARG 429 N -2.88 2.08 0.01 -0.52 0.52 -0.25 -4.48 118.95 113.42 1wj2 s ARG 429 Ca 0.20 -0.97 0.02 0.00 -0.52 0.00 0.00 55.73 54.47 1wj2 s ARG 429 Cb -0.04 -2.17 -0.01 0.00 0.52 0.00 0.00 34.95 33.25 1wj2 s ARG 429 CO 0.17 0.55 -0.08 -1.12 0.02 0.00 0.00 175.30 174.84 1wj2 s SER 430 N -1.30 0.93 -0.04 0.23 0.01 -1.03 -2.52 113.70 109.97 1wj2 s SER 430 Ca 0.14 -0.23 0.04 0.00 1.31 0.00 0.00 55.95 57.21 1wj2 s SER 430 Cb -0.10 -0.07 -0.00 0.00 0.21 0.00 0.00 66.02 66.05 1wj2 s SER 430 CO 0.04 0.04 -0.17 -0.31 0.41 0.00 0.00 173.24 173.24 1wj2 s TYR 431 N -0.43 1.73 0.36 2.43 2.02 -1.23 -1.81 117.35 120.42 1wj2 s TYR 431 Ca 0.01 -0.48 0.04 0.00 -0.37 0.00 0.00 57.07 56.26 1wj2 s TYR 431 Cb -0.04 -1.16 -0.03 0.00 -0.40 0.00 0.00 41.96 40.32 1wj2 s TYR 431 CO -0.00 -0.16 0.15 0.71 -1.57 0.00 0.00 175.55 174.68 1wj2 s TYR 432 N -0.01 1.74 -0.25 2.71 1.51 -0.76 -3.55 117.35 118.74 1wj2 s TYR 432 Ca -0.03 -1.33 -0.15 0.00 -1.01 0.00 0.00 57.07 54.55 1wj2 s TYR 432 Cb -0.11 -1.02 0.07 0.00 -0.11 0.00 0.00 41.96 40.79 1wj2 s TYR 432 CO 0.02 -0.41 0.62 -1.59 -1.11 0.00 0.00 175.55 173.07 1wj2 s LYS 433 N -3.72 0.63 -0.76 -0.62 -2.85 -0.97 -0.55 119.74 110.90 1wj2 s LYS 433 Ca 0.30 1.10 -0.26 0.00 -1.00 0.00 0.00 55.97 56.12 1wj2 s LYS 433 Cb 0.04 0.11 -0.07 0.00 -2.06 0.00 0.00 37.83 35.85 1wj2 s LYS 433 CO 0.17 -0.15 2.12 0.00 0.10 0.00 0.00 175.35 177.59 1wj2 n THR 435 N 8.02 4.81 -3.70 0.00 5.66 -0.20 -2.76 114.28 126.11 1wj2 n THR 435 Ca 0.38 -4.83 -0.21 0.00 -3.05 0.00 0.00 64.05 56.33 1wj2 n THR 435 Cb 0.48 -2.21 -0.01 0.00 -1.55 0.00 0.00 70.33 67.04 1wj2 n THR 435 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1wj2 s THR 436 N -0.85 4.86 -0.86 1.09 2.01 -0.98 -4.93 115.64 115.97 1wj2 s THR 436 Ca 0.40 -0.89 -0.20 0.00 0.31 0.00 0.00 61.69 61.31 1wj2 s THR 436 Cb 0.10 -3.72 -0.22 0.00 0.01 0.00 0.00 72.50 68.68 1wj2 s THR 436 CO 0.01 -0.32 2.32 -2.65 -0.69 0.00 0.00 174.62 173.29 1wj2 n PRO 437 N -1.56 0.35 0.00 4.92 -0.02 -1.26 -0.39 135.00 137.04 1wj2 n PRO 437 Ca -0.06 -0.48 0.00 0.00 -2.02 0.00 0.00 63.50 60.94 1wj2 n PRO 437 Cb 0.57 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1wj2 n PRO 437 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wj2 n GLY 438 N 6.28 2.93 3.70 -1.23 0.00 -1.26 -5.01 105.19 110.60 1wj2 n GLY 438 Ca 0.55 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.16 1wj2 n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wj2 n GLY 440 N 3.16 4.49 3.90 0.00 0.00 -1.25 -2.32 105.19 113.17 1wj2 n GLY 440 Ca 0.03 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.48 1wj2 n GLY 440 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wj2 s VAL 441 N -3.11 5.05 -0.05 1.61 1.01 -1.11 -4.94 120.40 118.86 1wj2 s VAL 441 Ca 0.43 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.58 1wj2 s VAL 441 Cb 0.27 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 33.00 1wj2 s VAL 441 CO -0.10 -0.12 -0.12 -0.13 0.00 0.00 0.00 175.10 174.63 1wj2 s ARG 442 N -3.03 1.50 0.17 2.72 0.52 -1.15 0.58 118.95 120.26 1wj2 s ARG 442 Ca 0.44 -0.40 0.09 0.00 -0.52 0.00 0.00 55.73 55.33 1wj2 s ARG 442 Cb -0.11 -1.29 -0.04 0.00 0.52 0.00 0.00 34.95 34.03 1wj2 s ARG 442 CO 0.26 0.07 -0.18 -1.59 0.02 0.00 0.00 175.30 173.88 1wj2 s LYS 443 N 0.48 1.29 -0.23 3.54 -2.85 0.29 -1.73 119.74 120.53 1wj2 s LYS 443 Ca -0.10 -1.43 -0.01 0.00 -1.00 0.00 0.00 55.97 53.43 1wj2 s LYS 443 Cb -0.14 -1.34 0.07 0.00 -2.06 0.00 0.00 37.83 34.36 1wj2 s LYS 443 CO 0.03 0.27 0.02 -1.01 0.10 0.00 0.00 175.35 174.75 1wj2 s HIS 444 N -2.10 1.59 -0.37 1.78 3.76 -0.98 -1.83 115.29 117.14 1wj2 s HIS 444 Ca 0.16 -1.30 -0.16 0.00 -0.15 0.00 0.00 55.06 53.61 1wj2 s HIS 444 Cb -0.05 -1.33 0.00 0.00 1.11 0.00 0.00 32.58 32.31 1wj2 s HIS 444 CO 0.07 -0.71 0.41 0.08 -0.85 0.00 0.00 174.74 173.74 1wj2 s VAL 445 N 1.66 5.11 0.02 -0.90 1.01 -0.75 -2.42 120.40 124.14 1wj2 s VAL 445 Ca -0.01 -0.05 0.05 0.00 0.00 0.00 0.00 61.98 61.97 1wj2 s VAL 445 Cb -0.18 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 1wj2 s VAL 445 CO -0.10 -0.23 -0.15 -1.61 0.00 0.00 0.00 175.10 173.01 1wj2 s GLU 446 N 2.12 1.03 -0.27 2.72 8.01 -0.98 -2.48 118.70 128.86 1wj2 s GLU 446 Ca 0.13 -0.69 0.03 0.00 0.01 0.00 0.00 54.97 54.45 1wj2 s GLU 446 Cb -0.17 -1.04 0.07 0.00 -4.31 0.00 0.00 34.13 28.68 1wj2 s GLU 446 CO 0.13 0.27 -0.08 0.50 0.01 0.00 0.00 175.26 176.09 1wj2 s ARG 447 N -0.88 2.07 0.08 1.61 3.52 -1.26 -2.10 118.95 121.98 1wj2 s ARG 447 Ca 0.03 -1.43 -0.30 0.00 -0.13 0.00 0.00 55.73 53.90 1wj2 s ARG 447 Cb -0.07 -2.93 -0.06 0.00 -1.56 0.00 0.00 34.95 30.33 1wj2 s ARG 447 CO 0.01 -0.64 1.16 0.00 -0.81 0.00 0.00 175.30 175.02 1wj2 s ALA 448 N 1.08 3.37 -0.22 6.12 0.00 0.21 -4.81 121.76 127.50 1wj2 s ALA 448 Ca -0.05 0.82 0.20 0.00 0.00 0.00 0.00 51.96 52.93 1wj2 s ALA 448 Cb -0.20 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.52 1wj2 s ALA 448 CO -0.06 -0.38 1.11 0.00 0.00 0.00 0.00 175.76 176.44 1wj2 h ALA 449 N 6.47 0.64 -1.00 0.00 0.00 -1.93 -3.00 119.26 120.43 1wj2 h ALA 449 Ca -0.42 -0.30 0.19 0.00 0.00 0.00 0.00 54.91 54.39 1wj2 h ALA 449 Cb 1.21 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.97 1wj2 h ALA 449 CO 0.79 0.34 0.61 1.79 0.00 0.00 0.00 179.25 182.78 1wj2 h THR 450 N 0.00 0.70 -2.16 0.00 1.35 -1.97 -3.41 112.91 107.41 1wj2 h THR 450 Ca -0.05 -0.26 -0.46 0.00 -0.55 0.00 0.00 66.41 65.10 1wj2 h THR 450 Cb 1.21 -0.12 -0.01 0.00 -1.73 0.00 0.00 68.15 67.51 1wj2 h THR 450 CO 0.02 0.14 -0.42 -1.81 -0.25 0.00 0.00 175.52 173.19 1wj2 s ASP 451 N -5.41 6.29 0.58 5.36 1.01 -1.26 -4.98 116.67 118.26 1wj2 s ASP 451 Ca -0.11 0.05 0.30 0.00 0.71 0.00 0.00 52.55 53.50 1wj2 s ASP 451 Cb 0.25 -1.81 1.41 0.00 1.01 0.00 0.00 42.92 43.78 1wj2 s ASP 451 CO 0.80 -0.10 1.80 -0.65 0.21 0.00 0.00 175.17 177.23 1wj2 h PRO 452 N 1.15 0.00 -0.10 8.23 0.11 -1.88 -3.35 132.00 136.16 1wj2 h PRO 452 Ca -0.52 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1wj2 h PRO 452 Cb 1.23 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.20 1wj2 h PRO 452 CO 0.60 0.00 -0.08 1.17 -0.21 0.00 0.00 178.00 179.48 1wj2 n LYS 453 N -3.77 0.09 -3.11 1.05 4.81 -1.26 -5.09 118.16 110.89 1wj2 n LYS 453 Ca 0.14 -0.71 -0.43 0.00 -0.87 0.00 0.00 58.31 56.44 1wj2 n LYS 453 Cb 0.91 0.10 -0.07 0.00 0.02 0.00 0.00 35.03 36.00 1wj2 n LYS 453 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1wj2 s ALA 454 N 0.74 3.34 -0.61 3.14 0.00 -1.13 -4.99 121.76 122.25 1wj2 s ALA 454 Ca 0.24 -1.31 -0.00 0.00 0.00 0.00 0.00 51.96 50.89 1wj2 s ALA 454 Cb 0.16 -3.33 0.15 0.00 0.00 0.00 0.00 23.12 20.10 1wj2 s ALA 454 CO -0.10 -1.85 0.40 0.08 0.00 0.00 0.00 175.76 174.29 1wj2 s VAL 455 N 2.83 3.33 -0.19 0.00 1.01 -1.26 0.65 120.40 126.77 1wj2 s VAL 455 Ca 0.22 -3.20 -0.11 0.00 0.00 0.00 0.00 61.98 58.89 1wj2 s VAL 455 Cb -0.15 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1wj2 s VAL 455 CO 0.18 -0.87 0.18 0.54 0.00 0.00 0.00 175.10 175.13 1wj2 s VAL 456 N -0.28 5.38 -0.02 2.92 0.11 -0.89 -5.00 120.40 122.62 1wj2 s VAL 456 Ca 0.18 0.29 0.04 0.00 -2.93 0.00 0.00 61.98 59.57 1wj2 s VAL 456 Cb -0.21 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.11 1wj2 s VAL 456 CO -0.03 0.42 -0.14 -0.89 -3.33 0.00 0.00 175.10 171.13 1wj2 s THR 457 N 0.41 1.15 0.11 5.04 2.01 -1.26 -2.32 115.64 120.78 1wj2 s THR 457 Ca 0.10 -0.61 0.07 0.00 0.31 0.00 0.00 61.69 61.57 1wj2 s THR 457 Cb -0.12 -0.97 -0.04 0.00 0.01 0.00 0.00 72.50 71.38 1wj2 s THR 457 CO -0.00 0.33 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.29 1wj2 s THR 458 N -0.21 3.48 -0.06 -0.82 2.01 -1.01 -4.95 115.64 114.08 1wj2 s THR 458 Ca 0.03 -1.27 -0.01 0.00 0.31 0.00 0.00 61.69 60.75 1wj2 s THR 458 Cb -0.07 -2.65 0.03 0.00 0.01 0.00 0.00 72.50 69.82 1wj2 s THR 458 CO 0.00 0.08 0.01 -0.31 -0.69 0.00 0.00 174.62 173.71 1wj2 s TYR 459 N -1.30 0.49 -0.33 4.92 2.02 -1.26 -2.33 117.35 119.56 1wj2 s TYR 459 Ca 0.23 -0.06 0.03 0.00 -0.37 0.00 0.00 57.07 56.90 1wj2 s TYR 459 Cb -0.11 -0.65 0.09 0.00 -0.40 0.00 0.00 41.96 40.89 1wj2 s TYR 459 CO 0.15 -0.25 0.03 -1.21 -1.57 0.00 0.00 175.55 172.70 1wj2 s GLU 460 N 1.74 1.68 0.00 -0.62 2.02 -0.70 -5.01 118.70 117.80 1wj2 s GLU 460 Ca 0.01 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.23 1wj2 s GLU 460 Cb -0.13 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 30.93 1wj2 s GLU 460 CO -0.04 -0.87 0.00 0.41 0.02 0.00 0.00 175.26 174.78 1wj2 n GLY 461 N 4.31 3.09 3.90 -1.39 0.00 -1.26 -2.92 105.19 110.92 1wj2 n GLY 461 Ca -0.00 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 1wj2 n GLY 461 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wj2 s LYS 462 N -5.23 3.66 0.03 1.61 1.02 -1.26 -4.85 119.74 114.72 1wj2 s LYS 462 Ca 0.00 0.13 -0.25 0.00 0.02 0.00 0.00 55.97 55.87 1wj2 s LYS 462 Cb 0.00 -2.55 -0.05 0.00 -0.52 0.00 0.00 37.83 34.71 1wj2 s LYS 462 CO 0.00 0.10 0.78 -1.01 -0.92 0.00 0.00 175.35 174.30 1wj2 s HIS 463 N -2.23 3.71 -0.22 3.18 3.76 -1.26 -4.90 115.29 117.33 1wj2 s HIS 463 Ca 0.46 1.47 0.12 0.00 -0.15 0.00 0.00 55.06 56.96 1wj2 s HIS 463 Cb -0.10 -2.84 0.44 0.00 1.11 0.00 0.00 32.58 31.18 1wj2 s HIS 463 CO 0.32 0.23 1.20 0.27 -0.85 0.00 0.00 174.74 175.91 1wj2 n ASN 464 N 3.00 2.68 -4.15 1.40 6.94 -1.26 -5.04 115.26 118.82 1wj2 n ASN 464 Ca -0.02 -3.55 -0.11 0.00 -0.02 0.00 0.00 54.58 50.88 1wj2 n ASN 464 Cb 0.50 -0.44 -0.10 0.00 -2.36 0.00 0.00 39.78 37.38 1wj2 n ASN 464 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 1wj2 s HIS 465 N -3.07 0.86 0.73 -2.53 -3.43 -1.26 -4.99 115.29 101.60 1wj2 s HIS 465 Ca 0.41 -0.83 -0.12 0.00 -0.80 0.00 0.00 55.06 53.72 1wj2 s HIS 465 Cb 0.38 -0.50 0.04 0.00 -1.43 0.00 0.00 32.58 31.07 1wj2 s HIS 465 CO -0.04 -0.13 1.10 -0.51 -2.00 0.00 0.00 174.74 173.15 1wj2 s ASP 466 N -2.76 4.69 -0.30 7.38 1.11 -1.26 -4.95 116.67 120.59 1wj2 s ASP 466 Ca 0.08 1.89 -0.29 0.00 0.18 0.00 0.00 52.55 54.41 1wj2 s ASP 466 Cb 0.02 -2.53 -0.01 0.00 1.07 0.00 0.00 42.92 41.47 1wj2 s ASP 466 CO -0.04 -1.91 1.48 -0.76 1.18 0.00 0.00 175.17 175.13 1wj2 s LEU 467 N -5.57 3.78 0.00 1.23 1.43 -1.26 -5.01 118.68 113.29 1wj2 s LEU 467 Ca 0.63 1.27 -0.19 0.00 -1.03 0.00 0.00 54.13 54.81 1wj2 s LEU 467 Cb -0.18 -3.54 0.28 0.00 0.03 0.00 0.00 46.19 42.79 1wj2 s LEU 467 CO 0.51 -1.28 0.98 -0.81 0.23 0.00 0.00 176.35 175.98 1wj2 n PRO 468 N 7.71 -3.10 0.00 1.29 -0.04 -1.26 -5.16 135.00 134.45 1wj2 n PRO 468 Ca 0.17 -1.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.06 1wj2 n PRO 468 Cb 0.46 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1wj2 n PRO 468 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46