#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 3.66 0.36 5.55 -0.21 -1.26 -4.99 119.66 122.77 1wj2 s GLN 400 Ca 0.00 0.00 0.09 0.00 0.02 0.00 0.00 55.36 55.47 1wj2 s GLN 400 Cb 0.00 -2.75 0.68 0.00 1.00 0.00 0.00 33.01 31.94 1wj2 s GLN 400 CO 0.00 0.37 1.84 1.79 -2.12 0.00 0.00 175.29 177.17 1wj2 h THR 401 N 1.84 1.23 -2.92 -0.19 1.35 -2.09 -3.43 112.91 108.69 1wj2 h THR 401 Ca -0.47 -1.05 -0.62 0.00 -0.55 0.00 0.00 66.41 63.72 1wj2 h THR 401 Cb 1.17 1.40 -0.05 0.00 -1.73 0.00 0.00 68.15 68.94 1wj2 h THR 401 CO 0.70 0.32 -0.36 0.42 -0.25 0.00 0.00 175.52 176.35 1wj2 s THR 402 N -4.50 5.27 -0.17 6.82 -4.23 -1.26 -5.07 115.64 112.49 1wj2 s THR 402 Ca -0.05 0.25 -0.25 0.00 -1.18 0.00 0.00 61.69 60.47 1wj2 s THR 402 Cb 0.15 -3.58 -0.02 0.00 1.34 0.00 0.00 72.50 70.39 1wj2 s THR 402 CO 0.74 0.38 0.80 -0.55 -0.54 0.00 0.00 174.62 175.46 1wj2 s SER 403 N -1.63 6.92 -0.31 3.99 0.15 -1.26 -5.01 113.70 116.55 1wj2 s SER 403 Ca 0.27 1.13 -0.29 0.00 0.70 0.00 0.00 55.95 57.76 1wj2 s SER 403 Cb -0.13 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1wj2 s SER 403 CO 0.15 -0.38 1.32 -1.61 1.20 0.00 0.00 173.24 173.92 1wj2 s GLU 404 N 2.11 3.88 -0.75 5.44 2.02 -1.26 -4.96 118.70 125.17 1wj2 s GLU 404 Ca 0.37 1.21 -0.26 0.00 0.02 0.00 0.00 54.97 56.31 1wj2 s GLU 404 Cb -0.16 -3.90 0.04 0.00 0.10 0.00 0.00 34.13 30.21 1wj2 s GLU 404 CO 0.12 -1.17 1.25 0.14 0.02 0.00 0.00 175.26 175.62 1wj2 s VAL 405 N 4.50 3.81 -0.29 2.63 -7.23 -1.26 -4.99 120.40 117.57 1wj2 s VAL 405 Ca 0.57 0.24 -0.25 0.00 -1.81 0.00 0.00 61.98 60.73 1wj2 s VAL 405 Cb -0.16 -4.90 0.00 0.00 0.56 0.00 0.00 36.38 31.88 1wj2 s VAL 405 CO 0.24 -1.82 0.86 -1.81 -0.31 0.00 0.00 175.10 172.26 1wj2 s ASP 406 N 3.80 6.77 -0.47 4.85 1.01 -1.26 -4.98 116.67 126.40 1wj2 s ASP 406 Ca 0.34 0.86 -0.27 0.00 0.71 0.00 0.00 52.55 54.19 1wj2 s ASP 406 Cb -0.09 -2.44 -0.03 0.00 1.01 0.00 0.00 42.92 41.37 1wj2 s ASP 406 CO 0.13 -0.63 1.94 -1.48 0.21 0.00 0.00 175.17 175.34 1wj2 s LEU 407 N 3.05 3.40 -0.97 1.23 2.34 -1.26 -4.90 118.68 121.56 1wj2 s LEU 407 Ca 0.36 0.89 -0.24 0.00 0.06 0.00 0.00 54.13 55.20 1wj2 s LEU 407 Cb -0.14 -2.94 0.00 0.00 -0.56 0.00 0.00 46.19 42.55 1wj2 s LEU 407 CO 0.11 -2.19 1.69 -0.76 -1.06 0.00 0.00 176.35 174.15 1wj2 s LEU 408 N 8.71 3.35 0.63 1.48 1.43 -1.26 -4.97 118.68 128.05 1wj2 s LEU 408 Ca 0.78 -1.12 -0.09 0.00 -1.03 0.00 0.00 54.13 52.68 1wj2 s LEU 408 Cb -0.18 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1wj2 s LEU 408 CO 0.27 -2.09 0.99 -0.62 0.23 0.00 0.00 176.35 175.12 1wj2 s ASP 409 N 6.38 5.63 -0.41 2.29 2.15 -1.26 -5.07 116.67 126.39 1wj2 s ASP 409 Ca 0.57 0.96 0.03 0.00 0.43 0.00 0.00 52.55 54.54 1wj2 s ASP 409 Cb -0.03 -1.90 0.16 0.00 -0.30 0.00 0.00 42.92 40.85 1wj2 s ASP 409 CO -0.05 -1.13 0.30 -1.81 -0.17 0.00 0.00 175.17 172.30 1wj2 s ASP 410 N -4.30 2.26 0.00 -0.34 1.01 -1.26 -4.87 116.67 109.16 1wj2 s ASP 410 Ca 0.55 -2.77 0.00 0.00 0.71 0.00 0.00 52.55 51.04 1wj2 s ASP 410 Cb -0.11 -0.52 0.00 0.00 1.01 0.00 0.00 42.92 43.31 1wj2 s ASP 410 CO 0.49 -0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.25 1wj2 n GLY 411 N 3.26 1.45 3.72 0.21 0.00 -1.26 -4.99 105.19 107.59 1wj2 n GLY 411 Ca 0.22 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 2.74 -0.74 1.61 2.02 -1.26 -3.59 117.35 118.13 1wj2 s TYR 412 Ca 0.00 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.35 1wj2 s TYR 412 Cb 0.00 -1.53 0.19 0.00 -0.40 0.00 0.00 41.96 40.22 1wj2 s TYR 412 CO 0.00 0.41 0.60 1.03 -1.57 0.00 0.00 175.55 176.02 1wj2 s ARG 413 N -3.81 2.92 0.67 -0.62 1.81 -1.26 -4.93 118.95 113.73 1wj2 s ARG 413 Ca 0.36 -2.81 -0.05 0.00 -1.72 0.00 0.00 55.73 51.51 1wj2 s ARG 413 Cb -0.04 -3.88 0.06 0.00 -0.45 0.00 0.00 34.95 30.64 1wj2 s ARG 413 CO 0.22 -1.22 0.97 -1.58 -0.68 0.00 0.00 175.30 173.01 1wj2 s TRP 414 N -0.54 2.88 -0.26 -0.53 0.52 -1.26 -1.94 118.94 117.81 1wj2 s TRP 414 Ca 0.21 0.34 -0.14 0.00 0.02 0.00 0.00 56.10 56.52 1wj2 s TRP 414 Cb -0.15 -3.11 0.08 0.00 -1.15 0.00 0.00 33.47 29.15 1wj2 s TRP 414 CO -0.07 -1.31 0.63 0.50 0.02 0.00 0.00 176.95 176.72 1wj2 s ARG 415 N -5.15 0.63 0.02 4.98 3.52 -0.46 -4.80 118.95 117.69 1wj2 s ARG 415 Ca 0.60 1.17 -0.30 0.00 -0.13 0.00 0.00 55.73 57.06 1wj2 s ARG 415 Cb -0.11 0.18 -0.05 0.00 -1.56 0.00 0.00 34.95 33.41 1wj2 s ARG 415 CO 0.43 -0.16 1.28 0.21 -0.81 0.00 0.00 175.30 176.26 1wj2 s LYS 416 N 1.73 4.35 -0.10 5.12 2.20 -1.26 -1.43 119.74 130.34 1wj2 s LYS 416 Ca -0.09 1.84 0.06 0.00 -0.36 0.00 0.00 55.97 57.41 1wj2 s LYS 416 Cb -0.06 -3.46 -0.10 0.00 -1.51 0.00 0.00 37.83 32.69 1wj2 s LYS 416 CO -0.18 -0.42 -0.01 2.48 -0.36 0.00 0.00 175.35 176.85 1wj2 n TYR 417 N 4.71 0.00 -3.58 4.03 4.11 -1.11 -5.00 117.16 120.32 1wj2 n TYR 417 Ca 0.11 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.90 1wj2 n TYR 417 Cb 0.45 -0.46 -0.03 0.00 -0.00 0.00 0.00 39.34 39.30 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 -4.45 -0.37 -0.07 -7.48 0.00 -1.25 -5.10 107.32 88.60 1wj2 s GLY 418 Ca -0.08 0.13 -0.13 0.00 0.00 0.00 0.00 44.72 44.65 1wj2 s GLY 418 CO 0.35 -0.08 0.31 -0.86 0.00 0.00 0.00 173.10 172.82 1wj2 s GLN 419 N -3.80 0.52 0.43 2.90 1.03 -1.26 -2.32 119.66 117.15 1wj2 s GLN 419 Ca 0.04 0.11 0.04 0.00 0.04 0.00 0.00 55.36 55.59 1wj2 s GLN 419 Cb -0.00 0.24 -0.05 0.00 0.03 0.00 0.00 33.01 33.23 1wj2 s GLN 419 CO -0.09 -0.11 0.04 0.15 -2.54 0.00 0.00 175.29 172.73 1wj2 s LYS 420 N -0.60 1.98 0.10 9.60 -0.14 -1.03 -4.99 119.74 124.66 1wj2 s LYS 420 Ca -0.07 -2.19 0.09 0.00 -1.36 0.00 0.00 55.97 52.44 1wj2 s LYS 420 Cb -0.04 -1.30 -0.04 0.00 -1.68 0.00 0.00 37.83 34.78 1wj2 s LYS 420 CO 0.02 -0.25 -0.22 0.54 -0.76 0.00 0.00 175.35 174.68 1wj2 s VAL 421 N -2.95 1.83 0.17 3.17 0.11 -1.26 0.07 120.40 121.53 1wj2 s VAL 421 Ca 0.23 -1.57 0.05 0.00 -2.93 0.00 0.00 61.98 57.77 1wj2 s VAL 421 Cb 0.06 -1.65 -0.04 0.00 -1.53 0.00 0.00 36.38 33.22 1wj2 s VAL 421 CO 0.12 -0.01 0.12 -0.69 -3.33 0.00 0.00 175.10 171.31 1wj2 s VAL 422 N -1.12 4.38 -0.40 2.04 1.01 -1.26 -4.86 120.40 120.19 1wj2 s VAL 422 Ca 0.08 -1.15 -0.21 0.00 0.00 0.00 0.00 61.98 60.70 1wj2 s VAL 422 Cb -0.10 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 33.05 1wj2 s VAL 422 CO 0.04 -0.13 0.64 -0.54 0.00 0.00 0.00 175.10 175.12 1wj2 s LYS 423 N -3.14 3.47 0.00 2.72 1.02 -1.26 -4.29 119.74 118.26 1wj2 s LYS 423 Ca 0.31 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.12 1wj2 s LYS 423 Cb -0.10 -3.89 0.00 0.00 -0.52 0.00 0.00 37.83 33.33 1wj2 s LYS 423 CO 0.23 -0.89 0.00 0.41 -0.92 0.00 0.00 175.35 174.18 1wj2 n GLY 424 N 4.87 2.85 3.72 -3.33 0.00 -1.26 -5.02 105.19 107.02 1wj2 n GLY 424 Ca -0.01 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 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 0.00 6.71 0.00 1.61 -0.87 -1.26 -4.90 114.94 116.24 1wj2 s ASN 425 Ca 0.00 2.46 0.29 0.00 -1.57 0.00 0.00 52.86 54.05 1wj2 s ASN 425 Cb 0.00 -2.59 1.73 0.00 -0.02 0.00 0.00 41.25 40.37 1wj2 s ASN 425 CO 0.00 -0.73 2.09 -0.81 -2.57 0.00 0.00 177.10 175.07 1wj2 n PRO 426 N 3.94 0.87 -3.70 -0.60 -0.04 -1.26 -4.51 135.00 129.69 1wj2 n PRO 426 Ca 0.12 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.21 1wj2 n PRO 426 Cb 0.41 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 1wj2 n PRO 426 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1wj2 s TYR 427 N -2.06 3.48 0.72 0.54 2.02 -1.26 -5.09 117.35 115.70 1wj2 s TYR 427 Ca 0.42 -2.51 -0.10 0.00 -0.37 0.00 0.00 57.07 54.52 1wj2 s TYR 427 Cb 0.20 -3.27 0.15 0.00 -0.40 0.00 0.00 41.96 38.64 1wj2 s TYR 427 CO 0.35 -0.90 0.35 -2.30 -1.57 0.00 0.00 175.55 171.47 1wj2 n PRO 428 N 3.98 -1.55 -4.17 -1.71 -0.02 -1.26 -4.74 135.00 125.53 1wj2 n PRO 428 Ca 0.04 -0.58 -0.32 0.00 -2.02 0.00 0.00 63.50 60.61 1wj2 n PRO 428 Cb 0.40 -1.03 -0.08 0.00 -0.02 0.00 0.00 33.50 32.77 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 -3.15 2.92 0.01 -0.52 0.52 0.11 -4.69 118.95 114.15 1wj2 s ARG 429 Ca 0.27 -0.57 0.04 0.00 -0.52 0.00 0.00 55.73 54.95 1wj2 s ARG 429 Cb -0.05 -2.76 -0.01 0.00 0.52 0.00 0.00 34.95 32.65 1wj2 s ARG 429 CO 0.22 0.63 -0.12 -1.12 0.02 0.00 0.00 175.30 174.93 1wj2 s SER 430 N -1.75 1.41 -0.08 0.23 0.01 -1.00 -2.47 113.70 110.05 1wj2 s SER 430 Ca 0.22 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.18 1wj2 s SER 430 Cb -0.12 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.01 1wj2 s SER 430 CO 0.13 0.08 -0.06 -0.31 0.41 0.00 0.00 173.24 173.49 1wj2 s TYR 431 N -0.52 1.14 0.27 2.43 2.02 -0.98 -0.32 117.35 121.39 1wj2 s TYR 431 Ca 0.03 -0.45 0.08 0.00 -0.37 0.00 0.00 57.07 56.35 1wj2 s TYR 431 Cb -0.06 -0.97 -0.06 0.00 -0.40 0.00 0.00 41.96 40.48 1wj2 s TYR 431 CO 0.00 -0.34 -0.10 0.71 -1.57 0.00 0.00 175.55 174.25 1wj2 s TYR 432 N 1.31 2.00 -0.13 2.71 1.51 -0.70 -2.77 117.35 121.28 1wj2 s TYR 432 Ca -0.04 -0.60 -0.08 0.00 -1.01 0.00 0.00 57.07 55.34 1wj2 s TYR 432 Cb -0.14 -1.07 0.05 0.00 -0.11 0.00 0.00 41.96 40.70 1wj2 s TYR 432 CO -0.03 0.39 0.32 -1.59 -1.11 0.00 0.00 175.55 173.53 1wj2 s LYS 433 N -3.67 0.30 -0.63 -0.62 -2.85 -0.52 0.01 119.74 111.77 1wj2 s LYS 433 Ca 0.28 0.60 -0.26 0.00 -1.00 0.00 0.00 55.97 55.59 1wj2 s LYS 433 Cb 0.02 -0.03 -0.02 0.00 -2.06 0.00 0.00 37.83 35.74 1wj2 s LYS 433 CO 0.12 -0.14 1.84 0.00 0.10 0.00 0.00 175.35 177.27 1wj2 n THR 435 N 7.19 4.95 -3.93 0.00 5.66 -0.82 -2.63 114.28 124.70 1wj2 n THR 435 Ca 0.20 -5.24 -0.29 0.00 -3.05 0.00 0.00 64.05 55.67 1wj2 n THR 435 Cb 0.52 -2.18 -0.04 0.00 -1.55 0.00 0.00 70.33 67.08 1wj2 n THR 435 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1wj2 s THR 436 N -1.45 5.35 -0.84 1.09 -4.23 -0.87 -4.98 115.64 109.72 1wj2 s THR 436 Ca 0.35 -0.49 -0.21 0.00 -1.18 0.00 0.00 61.69 60.16 1wj2 s THR 436 Cb 0.08 -3.66 -0.20 0.00 1.34 0.00 0.00 72.50 70.06 1wj2 s THR 436 CO 0.05 0.07 2.35 -0.81 -0.54 0.00 0.00 174.62 175.74 1wj2 n PRO 437 N 0.02 0.41 0.00 3.99 -0.04 -1.26 0.03 135.00 138.15 1wj2 n PRO 437 Ca -0.06 -0.49 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 1wj2 n PRO 437 Cb 0.52 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1wj2 n PRO 437 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wj2 n GLY 438 N 6.34 2.11 3.73 0.55 0.00 -1.26 -5.05 105.19 111.61 1wj2 n GLY 438 Ca 0.53 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.20 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 3.47 4.17 3.90 0.00 0.00 -1.25 -2.05 105.19 113.42 1wj2 n GLY 440 Ca -0.15 -2.16 -0.28 0.00 0.00 0.00 0.00 46.02 43.43 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 -2.63 4.91 -0.03 1.61 1.01 -1.08 -4.92 120.40 119.27 1wj2 s VAL 441 Ca 0.41 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.64 1wj2 s VAL 441 Cb 0.25 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.88 1wj2 s VAL 441 CO -0.09 -0.56 0.05 -0.13 0.00 0.00 0.00 175.10 174.38 1wj2 s ARG 442 N -4.05 -0.06 0.20 2.72 0.52 -1.01 -0.26 118.95 117.01 1wj2 s ARG 442 Ca 0.47 0.32 0.11 0.00 -0.52 0.00 0.00 55.73 56.11 1wj2 s ARG 442 Cb -0.10 -0.40 -0.04 0.00 0.52 0.00 0.00 34.95 34.93 1wj2 s ARG 442 CO 0.35 -0.27 -0.22 -1.59 0.02 0.00 0.00 175.30 173.59 1wj2 s LYS 443 N 1.74 1.59 -0.24 3.54 -2.85 0.10 -1.28 119.74 122.35 1wj2 s LYS 443 Ca -0.01 -1.51 0.01 0.00 -1.00 0.00 0.00 55.97 53.47 1wj2 s LYS 443 Cb -0.12 -1.88 0.04 0.00 -2.06 0.00 0.00 37.83 33.81 1wj2 s LYS 443 CO -0.03 0.40 -0.12 -1.01 0.10 0.00 0.00 175.35 174.69 1wj2 s HIS 444 N -1.72 3.09 -0.12 1.78 3.76 -0.65 -1.73 115.29 119.71 1wj2 s HIS 444 Ca 0.22 -1.97 -0.21 0.00 -0.15 0.00 0.00 55.06 52.95 1wj2 s HIS 444 Cb -0.08 -1.96 -0.04 0.00 1.11 0.00 0.00 32.58 31.62 1wj2 s HIS 444 CO 0.11 -0.83 0.61 0.08 -0.85 0.00 0.00 174.74 173.86 1wj2 s VAL 445 N 1.20 5.08 -0.01 -0.90 1.01 0.57 -1.49 120.40 125.86 1wj2 s VAL 445 Ca -0.03 1.23 -0.05 0.00 0.00 0.00 0.00 61.98 63.13 1wj2 s VAL 445 Cb -0.17 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1wj2 s VAL 445 CO -0.07 0.24 0.10 -1.61 0.00 0.00 0.00 175.10 173.76 1wj2 s GLU 446 N 1.03 0.32 -0.13 2.72 2.02 -0.17 -2.39 118.70 122.10 1wj2 s GLU 446 Ca 0.32 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 55.10 1wj2 s GLU 446 Cb -0.16 0.13 0.01 0.00 0.10 0.00 0.00 34.13 34.21 1wj2 s GLU 446 CO 0.14 -0.07 -0.21 1.03 0.02 0.00 0.00 175.26 176.17 1wj2 s ARG 447 N -0.86 2.85 -0.32 1.61 0.52 -1.26 -0.38 118.95 121.11 1wj2 s ARG 447 Ca -0.09 -0.79 -0.29 0.00 -0.52 0.00 0.00 55.73 54.03 1wj2 s ARG 447 Cb -0.06 -2.30 0.01 0.00 0.52 0.00 0.00 34.95 33.13 1wj2 s ARG 447 CO 0.01 -0.01 1.13 0.00 0.02 0.00 0.00 175.30 176.45 1wj2 s ALA 448 N 0.81 3.46 -0.14 2.13 0.00 0.12 -4.91 121.76 123.23 1wj2 s ALA 448 Ca -0.08 -0.03 -0.22 0.00 0.00 0.00 0.00 51.96 51.63 1wj2 s ALA 448 Cb -0.16 -3.71 -0.25 0.00 0.00 0.00 0.00 23.12 19.01 1wj2 s ALA 448 CO -0.01 -1.58 0.54 0.00 0.00 0.00 0.00 175.76 174.72 1wj2 h ALA 449 N 8.40 0.13 -0.77 0.00 0.00 -1.96 -3.11 119.26 121.95 1wj2 h ALA 449 Ca -0.22 -0.93 0.11 0.00 0.00 0.00 0.00 54.91 53.88 1wj2 h ALA 449 Cb 1.07 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 1wj2 h ALA 449 CO 1.04 0.52 0.50 1.79 0.00 0.00 0.00 179.25 183.10 1wj2 h THR 450 N -0.70 0.89 -4.31 0.00 1.35 -1.99 -3.42 112.91 104.72 1wj2 h THR 450 Ca -0.22 -0.21 -0.50 0.00 -0.55 0.00 0.00 66.41 64.93 1wj2 h THR 450 Cb 1.41 0.23 0.05 0.00 -1.73 0.00 0.00 68.15 68.11 1wj2 h THR 450 CO -0.03 0.11 0.41 -1.81 -0.25 0.00 0.00 175.52 173.95 1wj2 s ASP 451 N -6.02 6.34 -0.56 5.36 1.11 -1.26 -4.90 116.67 116.74 1wj2 s ASP 451 Ca -0.09 1.46 -0.16 0.00 0.18 0.00 0.00 52.55 53.94 1wj2 s ASP 451 Cb 0.21 -2.48 -0.15 0.00 1.07 0.00 0.00 42.92 41.57 1wj2 s ASP 451 CO 0.77 -0.79 1.78 -0.81 1.18 0.00 0.00 175.17 177.30 1wj2 n PRO 452 N -2.43 1.17 -2.43 8.23 -0.04 -1.26 -4.28 135.00 133.95 1wj2 n PRO 452 Ca 0.06 -1.40 -0.04 0.00 -0.04 0.00 0.00 63.50 62.09 1wj2 n PRO 452 Cb 0.54 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 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 6.17 -2.01 -4.37 0.54 4.81 -1.26 -5.07 118.16 116.98 1wj2 n LYS 453 Ca 0.41 1.84 -0.24 0.00 -0.87 0.00 0.00 58.31 59.45 1wj2 n LYS 453 Cb 0.28 -4.39 -0.12 0.00 0.02 0.00 0.00 35.03 30.83 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 -1.81 2.21 -0.21 3.14 0.00 -1.17 -5.02 121.76 118.90 1wj2 s ALA 454 Ca 0.12 -1.53 0.01 0.00 0.00 0.00 0.00 51.96 50.55 1wj2 s ALA 454 Cb -0.03 -0.25 0.05 0.00 0.00 0.00 0.00 23.12 22.89 1wj2 s ALA 454 CO 0.56 0.33 -0.08 0.08 0.00 0.00 0.00 175.76 176.64 1wj2 s VAL 455 N -1.81 1.58 -0.27 0.00 1.01 -1.26 -0.70 120.40 118.94 1wj2 s VAL 455 Ca 0.17 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.01 1wj2 s VAL 455 Cb -0.07 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.58 1wj2 s VAL 455 CO 0.08 0.06 0.02 0.54 0.00 0.00 0.00 175.10 175.80 1wj2 s VAL 456 N 1.40 3.58 0.20 2.92 0.11 0.49 -4.97 120.40 124.14 1wj2 s VAL 456 Ca -0.03 -0.77 0.10 0.00 -2.93 0.00 0.00 61.98 58.36 1wj2 s VAL 456 Cb -0.17 -2.82 -0.04 0.00 -1.53 0.00 0.00 36.38 31.82 1wj2 s VAL 456 CO -0.07 0.15 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.75 1wj2 s THR 457 N 1.45 2.18 0.03 5.04 2.01 -1.26 -1.00 115.64 124.08 1wj2 s THR 457 Ca 0.02 -2.07 0.07 0.00 0.31 0.00 0.00 61.69 60.01 1wj2 s THR 457 Cb -0.17 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 1wj2 s THR 457 CO -0.00 -0.25 -0.19 -0.89 -0.69 0.00 0.00 174.62 172.60 1wj2 s THR 458 N -2.00 1.52 -0.25 -0.82 2.01 -0.56 -4.95 115.64 110.60 1wj2 s THR 458 Ca 0.21 -1.09 0.02 0.00 0.31 0.00 0.00 61.69 61.14 1wj2 s THR 458 Cb -0.06 -1.32 0.06 0.00 0.01 0.00 0.00 72.50 71.19 1wj2 s THR 458 CO 0.10 0.20 -0.07 -0.31 -0.69 0.00 0.00 174.62 173.85 1wj2 s TYR 459 N -0.74 2.74 -0.51 4.92 1.51 -1.26 -1.63 117.35 122.37 1wj2 s TYR 459 Ca 0.06 -2.00 -0.06 0.00 -1.01 0.00 0.00 57.07 54.06 1wj2 s TYR 459 Cb -0.08 -1.75 0.13 0.00 -0.11 0.00 0.00 41.96 40.15 1wj2 s TYR 459 CO 0.01 -0.82 0.36 -1.21 -1.11 0.00 0.00 175.55 172.78 1wj2 s GLU 460 N 1.28 2.44 0.00 -0.62 2.02 -0.40 -4.99 118.70 118.42 1wj2 s GLU 460 Ca -0.06 -2.00 0.00 0.00 0.02 0.00 0.00 54.97 52.93 1wj2 s GLU 460 Cb -0.19 -3.82 0.00 0.00 0.10 0.00 0.00 34.13 30.22 1wj2 s GLU 460 CO -0.06 -1.16 0.00 0.41 0.02 0.00 0.00 175.26 174.47 1wj2 n GLY 461 N 4.43 3.65 3.51 -1.39 0.00 -1.26 -2.40 105.19 111.74 1wj2 n GLY 461 Ca -0.01 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 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 -3.68 3.54 0.07 1.61 -0.14 -1.26 -4.91 119.74 114.97 1wj2 s LYS 462 Ca 0.00 -0.52 -0.31 0.00 -1.36 0.00 0.00 55.97 53.78 1wj2 s LYS 462 Cb 0.00 -2.87 -0.09 0.00 -1.68 0.00 0.00 37.83 33.19 1wj2 s LYS 462 CO 0.00 0.31 1.79 -1.01 -0.76 0.00 0.00 175.35 175.68 1wj2 s HIS 463 N 0.17 2.01 -0.48 3.18 3.76 -1.26 -4.88 115.29 117.79 1wj2 s HIS 463 Ca -0.02 -0.00 0.03 0.00 -0.15 0.00 0.00 55.06 54.92 1wj2 s HIS 463 Cb -0.14 -4.11 0.62 0.00 1.11 0.00 0.00 32.58 30.06 1wj2 s HIS 463 CO 0.03 -4.64 1.90 0.09 -0.85 0.00 0.00 174.74 171.27 1wj2 n ASN 464 N 6.22 4.40 -3.78 1.40 3.02 -1.26 -4.92 115.26 120.34 1wj2 n ASN 464 Ca 0.18 -3.66 -0.13 0.00 -0.03 0.00 0.00 54.58 50.94 1wj2 n ASN 464 Cb 0.40 -0.85 -0.09 0.00 -0.61 0.00 0.00 39.78 38.63 1wj2 n ASN 464 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1wj2 s HIS 465 N -3.40 -0.16 0.53 3.10 -3.43 -1.26 -4.89 115.29 105.78 1wj2 s HIS 465 Ca 0.58 0.26 -0.22 0.00 -0.80 0.00 0.00 55.06 54.87 1wj2 s HIS 465 Cb 0.48 0.07 -0.05 0.00 -1.43 0.00 0.00 32.58 31.65 1wj2 s HIS 465 CO 0.08 -0.34 1.36 -0.51 -2.00 0.00 0.00 174.74 173.33 1wj2 s ASP 466 N -1.13 5.39 -0.22 7.38 1.11 -1.26 -4.87 116.67 123.07 1wj2 s ASP 466 Ca -0.12 2.77 -0.28 0.00 0.18 0.00 0.00 52.55 55.10 1wj2 s ASP 466 Cb -0.05 -2.64 -0.05 0.00 1.07 0.00 0.00 42.92 41.25 1wj2 s ASP 466 CO 0.03 -1.49 2.18 -0.76 1.18 0.00 0.00 175.17 176.31 1wj2 s LEU 467 N -3.39 3.48 0.00 1.23 1.02 -1.26 -4.96 118.68 114.80 1wj2 s LEU 467 Ca 0.70 1.87 0.00 0.00 0.02 0.00 0.00 54.13 56.71 1wj2 s LEU 467 Cb -0.40 -3.51 0.00 0.00 0.02 0.00 0.00 46.19 42.29 1wj2 s LEU 467 CO 0.48 -1.91 0.00 -2.65 0.02 0.00 0.00 176.35 172.29 1wj2 n PRO 468 N 8.69 -0.09 0.00 1.29 -0.02 -1.24 -5.10 135.00 138.53 1wj2 n PRO 468 Ca 0.29 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1wj2 n PRO 468 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.93 1wj2 n PRO 468 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48