#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 4.00 0.56 5.55 -0.21 -1.26 -4.80 119.66 123.51 1wj2 s GLN 400 Ca 0.00 -2.27 0.24 0.00 0.02 0.00 0.00 55.36 53.36 1wj2 s GLN 400 Cb 0.00 -5.23 1.58 0.00 1.00 0.00 0.00 33.01 30.36 1wj2 s GLN 400 CO 0.00 -1.96 2.19 1.15 -2.12 0.00 0.00 175.29 174.55 1wj2 h THR 401 N 5.14 0.71 -3.14 -0.19 2.02 -2.09 -3.42 112.91 111.94 1wj2 h THR 401 Ca 0.35 0.00 -0.53 0.00 0.77 0.00 0.00 66.41 67.00 1wj2 h THR 401 Cb 0.89 0.97 0.02 0.00 -1.74 0.00 0.00 68.15 68.29 1wj2 h THR 401 CO 1.32 0.00 0.68 0.42 0.37 0.00 0.00 175.52 178.31 1wj2 s THR 402 N -4.81 3.38 0.17 3.16 -4.23 -1.26 -5.00 115.64 107.04 1wj2 s THR 402 Ca -0.05 1.03 -0.23 0.00 -1.18 0.00 0.00 61.69 61.26 1wj2 s THR 402 Cb 0.16 -3.66 -0.08 0.00 1.34 0.00 0.00 72.50 70.26 1wj2 s THR 402 CO 0.60 0.10 0.74 -0.44 -0.54 0.00 0.00 174.62 175.09 1wj2 s SER 403 N 0.87 7.27 -0.25 3.99 0.01 -1.26 -5.02 113.70 119.31 1wj2 s SER 403 Ca 0.61 1.55 -0.29 0.00 1.31 0.00 0.00 55.95 59.14 1wj2 s SER 403 Cb -0.36 -2.47 0.01 0.00 0.21 0.00 0.00 66.02 63.41 1wj2 s SER 403 CO 0.32 0.17 1.10 -0.70 0.41 0.00 0.00 173.24 174.54 1wj2 s GLU 404 N -1.37 4.18 -0.23 12.44 2.12 -1.26 -5.01 118.70 129.56 1wj2 s GLU 404 Ca 0.37 1.32 -0.21 0.00 0.36 0.00 0.00 54.97 56.81 1wj2 s GLU 404 Cb -0.21 -3.70 -0.02 0.00 0.26 0.00 0.00 34.13 30.46 1wj2 s GLU 404 CO 0.24 -0.75 0.66 0.08 -0.54 0.00 0.00 175.26 174.94 1wj2 s VAL 405 N 3.46 4.98 0.54 3.70 1.01 -1.26 -5.06 120.40 127.77 1wj2 s VAL 405 Ca 0.47 1.21 0.08 0.00 0.00 0.00 0.00 61.98 63.74 1wj2 s VAL 405 Cb -0.15 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.33 1wj2 s VAL 405 CO 0.11 0.04 0.63 -1.81 0.00 0.00 0.00 175.10 174.08 1wj2 s ASP 406 N 1.37 5.00 -1.17 3.32 1.11 -1.26 -5.02 116.67 120.02 1wj2 s ASP 406 Ca 0.28 -0.93 -0.20 0.00 0.18 0.00 0.00 52.55 51.88 1wj2 s ASP 406 Cb -0.16 0.21 0.06 0.00 1.07 0.00 0.00 42.92 44.10 1wj2 s ASP 406 CO 0.09 -1.19 1.62 -0.76 1.18 0.00 0.00 175.17 176.11 1wj2 s LEU 407 N -4.49 3.67 -0.34 1.23 1.43 -1.26 -4.95 118.68 113.96 1wj2 s LEU 407 Ca 0.52 -1.98 -0.13 0.00 -1.03 0.00 0.00 54.13 51.51 1wj2 s LEU 407 Cb -0.05 -2.58 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 1wj2 s LEU 407 CO 0.33 -1.38 0.27 -0.22 0.23 0.00 0.00 176.35 175.58 1wj2 s LEU 408 N 4.76 4.54 -0.14 1.79 0.20 -1.26 -5.03 118.68 123.54 1wj2 s LEU 408 Ca 0.51 -0.41 -0.29 0.00 0.69 0.00 0.00 54.13 54.63 1wj2 s LEU 408 Cb 0.02 -2.18 -0.06 0.00 -0.43 0.00 0.00 46.19 43.54 1wj2 s LEU 408 CO 0.00 -0.26 2.05 -0.62 -0.29 0.00 0.00 176.35 177.22 1wj2 s ASP 409 N 1.72 5.92 -0.16 3.68 -1.08 -1.26 -4.83 116.67 120.66 1wj2 s ASP 409 Ca 0.07 2.10 0.16 0.00 -0.52 0.00 0.00 52.55 54.36 1wj2 s ASP 409 Cb -0.17 -2.52 0.43 0.00 -1.46 0.00 0.00 42.92 39.20 1wj2 s ASP 409 CO 0.11 -1.56 1.20 -0.67 0.52 0.00 0.00 175.17 174.76 1wj2 n ASP 410 N 9.85 1.74 0.00 -0.34 2.03 -1.26 -4.89 116.55 123.68 1wj2 n ASP 410 Ca 0.25 -3.25 0.00 0.00 0.52 0.00 0.00 54.79 52.31 1wj2 n ASP 410 Cb 0.44 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1wj2 n ASP 410 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wj2 n GLY 411 N -0.58 1.32 3.36 0.27 0.00 -1.26 -5.12 105.19 103.17 1wj2 n GLY 411 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1wj2 n GLY 411 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wj2 s TYR 412 N -0.02 -0.34 -0.46 1.61 2.02 -1.26 -4.16 117.35 114.74 1wj2 s TYR 412 Ca 0.00 0.27 -0.20 0.00 -0.37 0.00 0.00 57.07 56.77 1wj2 s TYR 412 Cb 0.00 0.30 0.03 0.00 -0.40 0.00 0.00 41.96 41.90 1wj2 s TYR 412 CO 0.00 -0.65 0.60 0.50 -1.57 0.00 0.00 175.55 174.44 1wj2 s ARG 413 N -2.81 3.19 0.38 -0.62 6.06 -1.26 -4.71 118.95 119.18 1wj2 s ARG 413 Ca -0.03 -0.62 0.08 0.00 -2.50 0.00 0.00 55.73 52.65 1wj2 s ARG 413 Cb -0.00 -4.00 -0.03 0.00 0.06 0.00 0.00 34.95 30.98 1wj2 s ARG 413 CO -0.05 -1.06 0.30 -1.58 -2.50 0.00 0.00 175.30 170.42 1wj2 s TRP 414 N 2.64 2.78 -0.20 5.12 0.52 -1.26 -1.87 118.94 126.66 1wj2 s TRP 414 Ca 0.18 -0.41 -0.13 0.00 0.02 0.00 0.00 56.10 55.76 1wj2 s TRP 414 Cb -0.16 -1.95 0.06 0.00 -1.15 0.00 0.00 33.47 30.27 1wj2 s TRP 414 CO 0.16 0.07 0.50 0.50 0.02 0.00 0.00 176.95 178.20 1wj2 s ARG 415 N -4.03 0.51 0.29 4.98 6.06 -0.50 -4.79 118.95 121.47 1wj2 s ARG 415 Ca 0.44 0.90 -0.29 0.00 -2.50 0.00 0.00 55.73 54.27 1wj2 s ARG 415 Cb -0.04 0.07 -0.10 0.00 0.06 0.00 0.00 34.95 34.95 1wj2 s ARG 415 CO 0.26 -0.14 1.17 0.21 -2.50 0.00 0.00 175.30 174.30 1wj2 s LYS 416 N 1.28 4.54 0.00 5.12 2.20 -1.26 -1.79 119.74 129.83 1wj2 s LYS 416 Ca -0.08 1.94 0.00 0.00 -0.36 0.00 0.00 55.97 57.47 1wj2 s LYS 416 Cb -0.07 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 1wj2 s LYS 416 CO -0.13 0.07 0.00 2.48 -0.36 0.00 0.00 175.35 177.42 1wj2 n TYR 417 N 1.13 0.00 -4.16 4.03 4.11 -1.23 -4.98 117.16 116.07 1wj2 n TYR 417 Ca -0.01 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.73 1wj2 n TYR 417 Cb 0.44 0.11 -0.11 0.00 -0.00 0.00 0.00 39.34 39.78 1wj2 n TYR 417 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 1wj2 s GLY 418 N -4.39 0.81 -0.01 -7.48 0.00 -1.26 -5.11 107.32 89.88 1wj2 s GLY 418 Ca 0.00 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.72 1wj2 s GLY 418 CO 0.00 -1.07 -0.08 -0.86 0.00 0.00 0.00 173.10 171.08 1wj2 s GLN 419 N -2.05 0.74 0.19 2.90 -2.07 -1.26 -2.90 119.66 115.21 1wj2 s GLN 419 Ca -0.01 -0.29 0.08 0.00 -1.82 0.00 0.00 55.36 53.32 1wj2 s GLN 419 Cb -0.08 -0.72 -0.04 0.00 -1.09 0.00 0.00 33.01 31.08 1wj2 s GLN 419 CO 0.01 0.16 -0.17 0.15 -1.32 0.00 0.00 175.29 174.12 1wj2 s LYS 420 N -0.08 1.32 0.17 9.60 1.02 -1.21 -5.05 119.74 125.51 1wj2 s LYS 420 Ca 0.01 -1.49 0.05 0.00 0.02 0.00 0.00 55.97 54.56 1wj2 s LYS 420 Cb -0.05 -1.28 -0.04 0.00 -0.52 0.00 0.00 37.83 35.95 1wj2 s LYS 420 CO -0.00 0.24 0.19 0.54 -0.92 0.00 0.00 175.35 175.40 1wj2 s VAL 421 N -2.40 4.71 -0.05 3.17 0.11 -1.26 -2.13 120.40 122.55 1wj2 s VAL 421 Ca 0.19 -1.02 0.04 0.00 -2.93 0.00 0.00 61.98 58.26 1wj2 s VAL 421 Cb -0.04 -3.43 -0.00 0.00 -1.53 0.00 0.00 36.38 31.38 1wj2 s VAL 421 CO 0.07 -0.14 -0.16 -0.69 -3.33 0.00 0.00 175.10 170.85 1wj2 s VAL 422 N -1.80 1.37 -0.49 2.04 1.01 -1.26 -4.85 120.40 116.41 1wj2 s VAL 422 Ca 0.32 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.38 1wj2 s VAL 422 Cb -0.10 -1.19 0.03 0.00 0.00 0.00 0.00 36.38 35.13 1wj2 s VAL 422 CO 0.25 0.40 0.92 -0.75 0.00 0.00 0.00 175.10 175.92 1wj2 s LYS 423 N 0.15 3.45 0.00 2.72 2.36 -1.26 -3.62 119.74 123.53 1wj2 s LYS 423 Ca -0.06 -0.01 0.00 0.00 -2.55 0.00 0.00 55.97 53.35 1wj2 s LYS 423 Cb -0.12 -3.97 0.00 0.00 -1.05 0.00 0.00 37.83 32.69 1wj2 s LYS 423 CO 0.03 -1.31 0.00 0.41 1.55 0.00 0.00 175.35 176.03 1wj2 n GLY 424 N 5.01 1.42 2.76 5.54 0.00 -1.26 -5.10 105.19 113.55 1wj2 n GLY 424 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 0.75 0.46 1.61 -0.87 -1.24 -4.90 114.94 108.75 1wj2 s ASN 425 Ca 0.00 0.00 0.30 0.00 -1.57 0.00 0.00 52.86 51.59 1wj2 s ASN 425 Cb 0.00 -0.21 1.09 0.00 -0.02 0.00 0.00 41.25 42.11 1wj2 s ASN 425 CO 0.00 -0.16 1.86 1.55 -2.57 0.00 0.00 177.10 177.78 1wj2 h PRO 426 N 7.76 0.00 -4.10 -0.60 0.13 -1.95 -3.39 132.00 129.85 1wj2 h PRO 426 Ca -0.31 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.11 1wj2 h PRO 426 Cb 1.13 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.93 1wj2 h PRO 426 CO 0.35 0.00 -0.38 0.71 -0.23 0.00 0.00 178.00 178.45 1wj2 s TYR 427 N -3.49 3.49 0.87 1.56 2.02 -1.26 -5.09 117.35 115.46 1wj2 s TYR 427 Ca 0.03 -2.28 -0.14 0.00 -0.37 0.00 0.00 57.07 54.31 1wj2 s TYR 427 Cb 0.09 -3.37 -0.01 0.00 -0.40 0.00 0.00 41.96 38.27 1wj2 s TYR 427 CO 0.54 -0.94 0.34 -2.30 -1.57 0.00 0.00 175.55 171.62 1wj2 n PRO 428 N 4.33 -0.06 -2.72 -1.71 -0.02 -1.26 -4.71 135.00 128.84 1wj2 n PRO 428 Ca 0.00 0.02 -0.36 0.00 -2.02 0.00 0.00 63.50 61.14 1wj2 n PRO 428 Cb 0.41 -1.77 -0.06 0.00 -0.02 0.00 0.00 33.50 32.06 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 -3.18 4.42 -0.06 -0.52 0.52 -0.91 -4.88 118.95 114.35 1wj2 s ARG 429 Ca 0.58 1.36 -0.01 0.00 -0.52 0.00 0.00 55.73 57.14 1wj2 s ARG 429 Cb -0.26 -2.65 0.03 0.00 0.52 0.00 0.00 34.95 32.59 1wj2 s ARG 429 CO 0.66 0.12 -0.01 -1.12 0.02 0.00 0.00 175.30 174.97 1wj2 s SER 430 N -1.67 1.26 -0.09 0.23 0.01 -1.11 -3.35 113.70 108.99 1wj2 s SER 430 Ca 0.54 -0.09 -0.02 0.00 1.31 0.00 0.00 55.95 57.69 1wj2 s SER 430 Cb -0.18 -0.41 -0.03 0.00 0.21 0.00 0.00 66.02 65.60 1wj2 s SER 430 CO 0.24 -0.15 0.01 -0.31 0.41 0.00 0.00 173.24 173.44 1wj2 s TYR 431 N 1.58 3.19 0.35 2.43 2.02 -1.14 -1.48 117.35 124.29 1wj2 s TYR 431 Ca -0.01 0.21 0.03 0.00 -0.37 0.00 0.00 57.07 56.93 1wj2 s TYR 431 Cb -0.13 -1.80 -0.01 0.00 -0.40 0.00 0.00 41.96 39.62 1wj2 s TYR 431 CO -0.03 0.48 0.10 0.66 -1.57 0.00 0.00 175.55 175.19 1wj2 n TYR 432 N 2.15 0.24 -3.59 2.71 4.02 -0.87 -3.46 117.16 118.35 1wj2 n TYR 432 Ca -0.19 -2.13 -0.02 0.00 -0.01 0.00 0.00 57.90 55.55 1wj2 n TYR 432 Cb 0.54 -0.04 -0.05 0.00 -0.02 0.00 0.00 39.34 39.76 1wj2 n TYR 432 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 176.86 174.26 1wj2 s LYS 433 N -3.30 0.48 -0.66 -0.72 -2.85 -0.74 -1.94 119.74 110.01 1wj2 s LYS 433 Ca 0.14 0.98 -0.26 0.00 -1.00 0.00 0.00 55.97 55.84 1wj2 s LYS 433 Cb 0.01 0.35 -0.06 0.00 -2.06 0.00 0.00 37.83 36.07 1wj2 s LYS 433 CO 0.10 -0.13 2.17 0.00 0.10 0.00 0.00 175.35 177.59 1wj2 n THR 435 N 7.90 4.78 -3.32 0.00 5.66 -0.78 -2.75 114.28 125.77 1wj2 n THR 435 Ca 0.34 -5.10 -0.18 0.00 -3.05 0.00 0.00 64.05 56.06 1wj2 n THR 435 Cb 0.50 -2.25 0.00 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 -0.98 3.71 -0.84 1.09 2.01 -0.98 -4.94 115.64 114.71 1wj2 s THR 436 Ca 0.36 -1.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.15 1wj2 s THR 436 Cb 0.07 -3.27 -0.20 0.00 0.01 0.00 0.00 72.50 69.11 1wj2 s THR 436 CO 0.05 -0.10 2.27 -2.65 -0.69 0.00 0.00 174.62 173.49 1wj2 n PRO 437 N -1.71 0.35 0.00 4.92 -0.02 -1.26 -0.93 135.00 136.35 1wj2 n PRO 437 Ca 0.03 -0.67 0.00 0.00 -2.02 0.00 0.00 63.50 60.84 1wj2 n PRO 437 Cb 0.58 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 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 6.33 3.26 3.70 -1.23 0.00 -1.26 -4.96 105.19 111.03 1wj2 n GLY 438 Ca 0.50 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.11 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 3.05 4.36 3.91 0.00 0.00 -1.25 -2.32 105.19 112.95 1wj2 n GLY 440 Ca 0.04 -2.20 -0.27 0.00 0.00 0.00 0.00 46.02 43.59 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 -2.97 4.98 0.00 1.61 1.01 -1.11 -4.92 120.40 118.99 1wj2 s VAL 441 Ca 0.42 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.45 1wj2 s VAL 441 Cb 0.27 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 1wj2 s VAL 441 CO -0.10 -0.63 -0.11 -0.13 0.00 0.00 0.00 175.10 174.14 1wj2 s ARG 442 N -4.29 0.83 0.11 2.72 1.81 -1.03 -0.32 118.95 118.79 1wj2 s ARG 442 Ca 0.45 -0.43 0.01 0.00 -1.72 0.00 0.00 55.73 54.03 1wj2 s ARG 442 Cb -0.10 -0.80 -0.04 0.00 -0.45 0.00 0.00 34.95 33.55 1wj2 s ARG 442 CO 0.38 0.22 -0.03 -1.59 -0.68 0.00 0.00 175.30 173.60 1wj2 s LYS 443 N -0.41 0.88 -0.14 3.54 -2.85 -0.82 -0.53 119.74 119.42 1wj2 s LYS 443 Ca 0.03 -1.38 -0.00 0.00 -1.00 0.00 0.00 55.97 53.62 1wj2 s LYS 443 Cb -0.05 -0.10 0.03 0.00 -2.06 0.00 0.00 37.83 35.65 1wj2 s LYS 443 CO -0.00 -0.09 -0.10 -1.01 0.10 0.00 0.00 175.35 174.25 1wj2 s HIS 444 N -3.73 1.80 -0.38 1.78 3.76 -0.24 -2.05 115.29 116.22 1wj2 s HIS 444 Ca 0.16 -0.99 -0.13 0.00 -0.15 0.00 0.00 55.06 53.95 1wj2 s HIS 444 Cb 0.06 -1.39 0.01 0.00 1.11 0.00 0.00 32.58 32.37 1wj2 s HIS 444 CO -0.03 -0.59 0.25 0.08 -0.85 0.00 0.00 174.74 173.60 1wj2 s VAL 445 N 1.61 5.05 0.09 -0.90 1.01 -0.55 -2.16 120.40 124.54 1wj2 s VAL 445 Ca 0.04 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 61.50 1wj2 s VAL 445 Cb -0.13 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1wj2 s VAL 445 CO -0.09 -0.20 -0.19 -1.61 0.00 0.00 0.00 175.10 173.01 1wj2 s GLU 446 N 1.65 1.08 -0.27 2.72 2.02 -0.46 -2.73 118.70 122.72 1wj2 s GLU 446 Ca 0.04 -1.09 0.02 0.00 0.02 0.00 0.00 54.97 53.97 1wj2 s GLU 446 Cb -0.19 -1.28 0.07 0.00 0.10 0.00 0.00 34.13 32.84 1wj2 s GLU 446 CO 0.09 0.30 -0.04 1.03 0.02 0.00 0.00 175.26 176.66 1wj2 s ARG 447 N -1.78 1.69 -0.02 1.61 0.52 -1.26 -1.38 118.95 118.33 1wj2 s ARG 447 Ca 0.05 -1.28 -0.30 0.00 -0.52 0.00 0.00 55.73 53.68 1wj2 s ARG 447 Cb -0.10 -2.75 -0.08 0.00 0.52 0.00 0.00 34.95 32.54 1wj2 s ARG 447 CO 0.04 -0.69 2.02 0.00 0.02 0.00 0.00 175.30 176.68 1wj2 s ALA 448 N 1.23 3.39 -0.15 2.13 0.00 0.35 -4.88 121.76 123.83 1wj2 s ALA 448 Ca -0.02 1.20 -0.27 0.00 0.00 0.00 0.00 51.96 52.86 1wj2 s ALA 448 Cb -0.19 -3.90 -0.25 0.00 0.00 0.00 0.00 23.12 18.78 1wj2 s ALA 448 CO -0.08 -1.85 0.68 0.00 0.00 0.00 0.00 175.76 174.51 1wj2 h ALA 449 N 11.60 0.04 -0.67 0.00 0.00 -1.92 -3.12 119.26 125.19 1wj2 h ALA 449 Ca -0.48 -0.64 0.13 0.00 0.00 0.00 0.00 54.91 53.92 1wj2 h ALA 449 Cb 1.24 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1wj2 h ALA 449 CO 0.95 0.16 0.45 1.79 0.00 0.00 0.00 179.25 182.59 1wj2 h THR 450 N -0.95 0.82 -4.01 0.00 1.35 -1.90 -3.42 112.91 104.80 1wj2 h THR 450 Ca -0.07 -0.12 -0.50 0.00 -0.55 0.00 0.00 66.41 65.17 1wj2 h THR 450 Cb 1.10 0.43 0.04 0.00 -1.73 0.00 0.00 68.15 67.99 1wj2 h THR 450 CO -0.03 0.07 0.28 -1.81 -0.25 0.00 0.00 175.52 173.78 1wj2 s ASP 451 N -6.09 6.34 -0.54 5.36 1.11 -1.25 -4.92 116.67 116.68 1wj2 s ASP 451 Ca -0.07 1.26 -0.15 0.00 0.18 0.00 0.00 52.55 53.76 1wj2 s ASP 451 Cb 0.20 -2.39 -0.14 0.00 1.07 0.00 0.00 42.92 41.66 1wj2 s ASP 451 CO 0.76 -0.67 1.76 -0.81 1.18 0.00 0.00 175.17 177.38 1wj2 n PRO 452 N -2.22 1.15 -2.55 8.23 -0.04 -1.26 -4.24 135.00 134.07 1wj2 n PRO 452 Ca 0.04 -1.35 -0.05 0.00 -0.04 0.00 0.00 63.50 62.10 1wj2 n PRO 452 Cb 0.54 -2.55 0.01 0.00 -0.04 0.00 0.00 33.50 31.46 1wj2 n PRO 452 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1wj2 n LYS 453 N 6.02 -1.70 -4.40 0.54 4.81 -1.26 -5.03 118.16 117.14 1wj2 n LYS 453 Ca 0.39 1.67 -0.34 0.00 -0.87 0.00 0.00 58.31 59.16 1wj2 n LYS 453 Cb 0.26 -4.70 -0.11 0.00 0.02 0.00 0.00 35.03 30.50 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 -2.33 3.11 -0.55 3.14 0.00 -1.18 -4.99 121.76 118.96 1wj2 s ALA 454 Ca 0.16 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 51.26 1wj2 s ALA 454 Cb -0.05 -1.52 0.14 0.00 0.00 0.00 0.00 23.12 21.70 1wj2 s ALA 454 CO 0.58 0.37 0.38 0.08 0.00 0.00 0.00 175.76 177.17 1wj2 s VAL 455 N -0.16 3.81 -0.21 0.00 1.01 -1.26 -0.49 120.40 123.10 1wj2 s VAL 455 Ca 0.04 -2.48 -0.14 0.00 0.00 0.00 0.00 61.98 59.40 1wj2 s VAL 455 Cb -0.13 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1wj2 s VAL 455 CO 0.02 -0.82 0.30 0.54 0.00 0.00 0.00 175.10 175.14 1wj2 s VAL 456 N 0.52 5.27 -0.08 2.92 0.11 -0.48 -5.00 120.40 123.66 1wj2 s VAL 456 Ca 0.13 0.49 0.00 0.00 -2.93 0.00 0.00 61.98 59.67 1wj2 s VAL 456 Cb -0.21 -3.63 0.02 0.00 -1.53 0.00 0.00 36.38 31.03 1wj2 s VAL 456 CO -0.04 0.30 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.08 1wj2 s THR 457 N 1.16 0.79 0.04 5.04 2.01 -1.26 -1.35 115.64 122.07 1wj2 s THR 457 Ca 0.14 -0.18 0.04 0.00 0.31 0.00 0.00 61.69 62.00 1wj2 s THR 457 Cb -0.14 -0.83 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 1wj2 s THR 457 CO 0.06 0.31 -0.03 -0.89 -0.69 0.00 0.00 174.62 173.39 1wj2 s THR 458 N 1.47 3.88 0.38 -0.82 2.01 -0.92 -4.95 115.64 116.70 1wj2 s THR 458 Ca -0.01 -0.85 0.08 0.00 0.31 0.00 0.00 61.69 61.22 1wj2 s THR 458 Cb -0.13 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 1wj2 s THR 458 CO -0.04 0.27 0.21 -0.31 -0.69 0.00 0.00 174.62 174.05 1wj2 s TYR 459 N -1.15 2.68 -0.38 4.92 1.51 -1.26 -1.08 117.35 122.59 1wj2 s TYR 459 Ca 0.21 -0.47 0.07 0.00 -1.01 0.00 0.00 57.07 55.87 1wj2 s TYR 459 Cb -0.11 -1.86 0.18 0.00 -0.11 0.00 0.00 41.96 40.05 1wj2 s TYR 459 CO 0.13 0.19 0.57 -1.21 -1.11 0.00 0.00 175.55 174.12 1wj2 s GLU 460 N -3.93 0.74 0.00 -0.62 2.02 0.31 -4.93 118.70 112.29 1wj2 s GLU 460 Ca 0.41 -0.23 0.00 0.00 0.02 0.00 0.00 54.97 55.17 1wj2 s GLU 460 Cb -0.01 -0.03 0.00 0.00 0.10 0.00 0.00 34.13 34.19 1wj2 s GLU 460 CO 0.24 -1.17 0.00 0.41 0.02 0.00 0.00 175.26 174.76 1wj2 n GLY 461 N 4.57 0.82 2.84 -1.39 0.00 -1.26 -2.45 105.19 108.32 1wj2 n GLY 461 Ca 0.10 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.50 0.03 0.03 1.61 1.02 -1.26 -5.03 119.74 114.63 1wj2 s LYS 462 Ca 0.00 0.06 -0.30 0.00 0.02 0.00 0.00 55.97 55.74 1wj2 s LYS 462 Cb 0.00 -0.13 -0.05 0.00 -0.52 0.00 0.00 37.83 37.13 1wj2 s LYS 462 CO 0.00 -0.06 1.18 -1.01 -0.92 0.00 0.00 175.35 174.55 1wj2 s HIS 463 N 0.40 3.39 -0.24 3.18 3.76 -1.26 -4.84 115.29 119.68 1wj2 s HIS 463 Ca -0.03 1.31 0.10 0.00 -0.15 0.00 0.00 55.06 56.28 1wj2 s HIS 463 Cb -0.05 -3.40 0.45 0.00 1.11 0.00 0.00 32.58 30.69 1wj2 s HIS 463 CO -0.01 -1.20 1.31 0.27 -0.85 0.00 0.00 174.74 174.26 1wj2 n ASN 464 N 4.24 2.00 -0.40 1.40 6.94 -1.26 -4.55 115.26 123.64 1wj2 n ASN 464 Ca 0.09 -3.87 0.00 0.00 -0.02 0.00 0.00 54.58 50.78 1wj2 n ASN 464 Cb 0.47 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.32 1wj2 n ASN 464 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wj2 n HIS 465 N -1.12 0.00 -1.56 -2.53 1.44 -1.26 -4.93 115.22 105.26 1wj2 n HIS 465 Ca 0.24 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 56.08 1wj2 n HIS 465 Cb 0.82 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.90 1wj2 n HIS 465 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1wj2 n ASP 466 N 0.00 -6.09 -4.56 4.39 8.00 -1.26 -4.58 116.55 112.45 1wj2 n ASP 466 Ca 0.00 0.96 -0.42 0.00 0.71 0.00 0.00 54.79 56.04 1wj2 n ASP 466 Cb 0.64 -2.80 -0.07 0.00 -0.02 0.00 0.00 41.12 38.87 1wj2 n ASP 466 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1wj2 s LEU 467 N 0.00 4.31 0.00 0.64 1.43 -1.26 -5.03 118.68 118.77 1wj2 s LEU 467 Ca 0.00 0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1wj2 s LEU 467 Cb 0.00 -2.70 0.01 0.00 0.03 0.00 0.00 46.19 43.53 1wj2 s LEU 467 CO 0.00 -0.56 0.05 -0.81 0.23 0.00 0.00 176.35 175.26 1wj2 n PRO 468 N 5.94 -0.56 0.00 1.29 -0.04 -1.26 -5.11 135.00 135.26 1wj2 n PRO 468 Ca -0.03 -0.08 0.04 0.00 -0.04 0.00 0.00 63.50 63.39 1wj2 n PRO 468 Cb 0.49 -0.06 0.03 0.00 -0.04 0.00 0.00 33.50 33.91 1wj2 n PRO 468 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46