#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 0.77 0.58 7.34 -0.21 -1.26 -5.16 119.66 121.72 1wj2 s GLN 400 Ca 0.00 -0.32 0.09 0.00 0.02 0.00 0.00 55.36 55.14 1wj2 s GLN 400 Cb 0.00 -0.05 0.08 0.00 1.00 0.00 0.00 33.01 34.05 1wj2 s GLN 400 CO 0.00 -1.18 0.79 0.95 -2.12 0.00 0.00 175.29 173.73 1wj2 s THR 401 N 1.83 2.21 -0.19 -0.19 -4.23 -1.26 -5.13 115.64 108.69 1wj2 s THR 401 Ca 0.16 -0.96 -0.09 0.00 -1.18 0.00 0.00 61.69 59.61 1wj2 s THR 401 Cb -0.06 -2.25 0.07 0.00 1.34 0.00 0.00 72.50 71.59 1wj2 s THR 401 CO -0.08 0.00 0.44 -0.89 -0.54 0.00 0.00 174.62 173.55 1wj2 s THR 402 N -2.69 -0.18 0.06 3.99 2.01 -1.26 -5.16 115.64 112.41 1wj2 s THR 402 Ca 0.62 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.78 1wj2 s THR 402 Cb -0.06 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.75 1wj2 s THR 402 CO 0.39 0.04 -0.12 -0.44 -0.69 0.00 0.00 174.62 173.80 1wj2 s SER 403 N 1.73 4.25 -0.56 3.53 0.01 -1.26 -5.05 113.70 116.35 1wj2 s SER 403 Ca -0.08 -0.35 -0.26 0.00 1.31 0.00 0.00 55.95 56.57 1wj2 s SER 403 Cb -0.09 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.29 1wj2 s SER 403 CO -0.13 0.23 2.08 -1.61 0.41 0.00 0.00 173.24 174.21 1wj2 s GLU 404 N -1.79 2.43 -0.17 12.44 8.01 -1.26 -4.92 118.70 133.44 1wj2 s GLU 404 Ca 0.18 0.94 -0.29 0.00 0.01 0.00 0.00 54.97 55.81 1wj2 s GLU 404 Cb -0.11 -4.46 -0.03 0.00 -4.31 0.00 0.00 34.13 25.22 1wj2 s GLU 404 CO 0.10 -2.93 1.48 0.14 0.01 0.00 0.00 175.26 174.05 1wj2 s VAL 405 N 10.28 3.90 -0.88 2.63 -7.23 -1.26 -4.91 120.40 122.93 1wj2 s VAL 405 Ca 0.79 1.06 -0.04 0.00 -1.81 0.00 0.00 61.98 61.98 1wj2 s VAL 405 Cb -0.15 -3.79 0.13 0.00 0.56 0.00 0.00 36.38 33.14 1wj2 s VAL 405 CO 0.23 -0.21 2.48 0.47 -0.31 0.00 0.00 175.10 177.76 1wj2 n ASP 406 N 7.44 7.26 -2.29 4.85 8.00 -1.26 -4.66 116.55 135.89 1wj2 n ASP 406 Ca 0.16 -3.28 -0.33 0.00 0.71 0.00 0.00 54.79 52.05 1wj2 n ASP 406 Cb 0.45 -1.26 0.08 0.00 -0.02 0.00 0.00 41.12 40.36 1wj2 n ASP 406 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1wj2 n LEU 407 N 1.01 7.60 -4.67 0.64 -0.00 -1.26 -4.98 117.00 115.34 1wj2 n LEU 407 Ca 0.55 -4.20 -0.42 0.00 -0.00 0.00 0.00 56.01 51.93 1wj2 n LEU 407 Cb 0.38 -0.99 -0.03 0.00 -0.00 0.00 0.00 43.42 42.78 1wj2 n LEU 407 CO 0.50 1.45 1.40 -0.76 -0.00 0.00 0.00 177.39 179.97 1wj2 s LEU 408 N -3.65 4.36 0.02 -1.96 1.02 -1.26 -4.91 118.68 112.30 1wj2 s LEU 408 Ca 0.62 2.41 -0.30 0.00 0.02 0.00 0.00 54.13 56.89 1wj2 s LEU 408 Cb 0.49 -3.54 -0.09 0.00 0.02 0.00 0.00 46.19 43.07 1wj2 s LEU 408 CO -0.01 -0.93 2.00 -0.67 0.02 0.00 0.00 176.35 176.76 1wj2 n ASP 409 N 6.62 4.10 -1.65 2.29 2.03 -1.26 -4.84 116.55 123.84 1wj2 n ASP 409 Ca 0.17 0.84 0.03 0.00 0.52 0.00 0.00 54.79 56.35 1wj2 n ASP 409 Cb 0.42 -1.53 0.03 0.00 -0.72 0.00 0.00 41.12 39.31 1wj2 n ASP 409 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1wj2 n ASP 410 N 7.94 1.10 0.00 1.67 2.03 -1.26 -4.99 116.55 123.04 1wj2 n ASP 410 Ca 0.21 -2.05 0.00 0.00 0.52 0.00 0.00 54.79 53.47 1wj2 n ASP 410 Cb 0.41 -0.33 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 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 0.32 -2.11 3.27 0.27 0.00 -1.26 -5.15 105.19 100.53 1wj2 n GLY 411 Ca 0.07 0.69 -0.19 0.00 0.00 0.00 0.00 46.02 46.59 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 1.53 -0.81 1.61 2.02 -1.26 -4.45 117.35 115.99 1wj2 s TYR 412 Ca 0.00 -0.53 -0.25 0.00 -0.37 0.00 0.00 57.07 55.92 1wj2 s TYR 412 Cb 0.00 -0.79 0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1wj2 s TYR 412 CO 0.00 0.20 1.29 0.50 -1.57 0.00 0.00 175.55 175.97 1wj2 s ARG 413 N -2.71 3.31 0.25 -0.62 3.52 -1.26 -4.90 118.95 116.52 1wj2 s ARG 413 Ca 0.11 -0.60 0.03 0.00 -0.13 0.00 0.00 55.73 55.14 1wj2 s ARG 413 Cb -0.05 -4.53 -0.03 0.00 -1.56 0.00 0.00 34.95 28.78 1wj2 s ARG 413 CO 0.04 -2.12 0.39 -1.58 -0.81 0.00 0.00 175.30 171.23 1wj2 s TRP 414 N 5.23 3.47 0.02 5.12 0.52 -1.26 -1.83 118.94 130.21 1wj2 s TRP 414 Ca 0.36 0.11 -0.04 0.00 0.02 0.00 0.00 56.10 56.55 1wj2 s TRP 414 Cb -0.07 -1.68 -0.01 0.00 -1.15 0.00 0.00 33.47 30.56 1wj2 s TRP 414 CO 0.07 0.38 0.07 0.50 0.02 0.00 0.00 176.95 177.98 1wj2 s ARG 415 N -3.88 0.46 -0.12 4.98 6.06 -0.77 -4.87 118.95 120.81 1wj2 s ARG 415 Ca 0.36 -0.59 -0.15 0.00 -2.50 0.00 0.00 55.73 52.84 1wj2 s ARG 415 Cb -0.10 0.18 -0.05 0.00 0.06 0.00 0.00 34.95 35.05 1wj2 s ARG 415 CO 0.30 -0.10 0.38 0.21 -2.50 0.00 0.00 175.30 173.59 1wj2 s LYS 416 N -1.82 4.21 0.00 5.12 2.20 -1.26 -1.60 119.74 126.59 1wj2 s LYS 416 Ca -0.12 0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.77 1wj2 s LYS 416 Cb -0.06 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 1wj2 s LYS 416 CO -0.01 0.30 0.00 2.48 -0.36 0.00 0.00 175.35 177.75 1wj2 n TYR 417 N 3.28 0.00 -4.19 4.03 4.11 -1.21 -5.05 117.16 118.14 1wj2 n TYR 417 Ca -0.11 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.65 1wj2 n TYR 417 Cb 0.52 0.08 -0.11 0.00 -0.00 0.00 0.00 39.34 39.83 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 -4.34 0.88 -0.29 -7.48 0.00 -1.25 -5.10 107.32 89.74 1wj2 s GLY 418 Ca 0.00 -1.21 -0.15 0.00 0.00 0.00 0.00 44.72 43.37 1wj2 s GLY 418 CO 0.00 -1.28 0.86 -0.86 0.00 0.00 0.00 173.10 171.82 1wj2 s GLN 419 N -2.78 0.46 0.51 2.90 1.03 -1.26 -2.41 119.66 118.11 1wj2 s GLN 419 Ca 0.06 0.95 0.01 0.00 0.04 0.00 0.00 55.36 56.42 1wj2 s GLN 419 Cb -0.03 0.36 -0.01 0.00 0.03 0.00 0.00 33.01 33.36 1wj2 s GLN 419 CO 0.00 -0.12 0.03 -1.59 -2.54 0.00 0.00 175.29 171.07 1wj2 s LYS 420 N 2.03 2.20 -0.04 9.60 -2.85 -1.13 -5.00 119.74 124.56 1wj2 s LYS 420 Ca -0.07 -2.38 0.06 0.00 -1.00 0.00 0.00 55.97 52.58 1wj2 s LYS 420 Cb -0.06 -1.57 -0.01 0.00 -2.06 0.00 0.00 37.83 34.13 1wj2 s LYS 420 CO -0.17 -0.38 -0.21 0.54 0.10 0.00 0.00 175.35 175.22 1wj2 s VAL 421 N -2.87 1.69 0.36 1.79 0.11 -1.26 -1.41 120.40 118.80 1wj2 s VAL 421 Ca 0.07 -0.88 -0.07 0.00 -2.93 0.00 0.00 61.98 58.17 1wj2 s VAL 421 Cb 0.01 -1.43 -0.06 0.00 -1.53 0.00 0.00 36.38 33.38 1wj2 s VAL 421 CO 0.04 0.48 0.67 -0.69 -3.33 0.00 0.00 175.10 172.27 1wj2 s VAL 422 N -0.22 4.91 -0.86 2.04 1.01 -1.26 -4.97 120.40 121.04 1wj2 s VAL 422 Ca 0.01 0.30 -0.15 0.00 0.00 0.00 0.00 61.98 62.14 1wj2 s VAL 422 Cb -0.11 -3.75 0.21 0.00 0.00 0.00 0.00 36.38 32.73 1wj2 s VAL 422 CO 0.01 -0.46 0.85 -0.54 0.00 0.00 0.00 175.10 174.96 1wj2 s LYS 423 N -3.81 3.63 0.00 2.72 -0.14 -1.26 -4.23 119.74 116.65 1wj2 s LYS 423 Ca 0.47 -2.37 0.00 0.00 -1.36 0.00 0.00 55.97 52.71 1wj2 s LYS 423 Cb -0.10 -4.52 0.00 0.00 -1.68 0.00 0.00 37.83 31.52 1wj2 s LYS 423 CO 0.32 -1.38 0.00 0.41 -0.76 0.00 0.00 175.35 173.94 1wj2 n GLY 424 N 4.19 1.45 3.56 -3.33 0.00 -1.26 -5.09 105.19 104.71 1wj2 n GLY 424 Ca 0.16 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.44 6.44 0.28 1.61 0.02 -1.26 -4.94 114.94 116.65 1wj2 s ASN 425 Ca 0.00 0.03 0.02 0.00 -1.02 0.00 0.00 52.86 51.90 1wj2 s ASN 425 Cb 0.00 -2.37 0.65 0.00 0.02 0.00 0.00 41.25 39.55 1wj2 s ASN 425 CO 0.00 -0.79 1.75 -0.65 0.02 0.00 0.00 177.10 177.44 1wj2 h PRO 426 N 8.73 0.60 -6.42 -0.60 0.11 -1.95 -3.39 132.00 129.09 1wj2 h PRO 426 Ca -0.25 -0.04 -0.57 0.00 0.11 0.00 0.00 66.00 65.26 1wj2 h PRO 426 Cb 1.09 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 32.02 1wj2 h PRO 426 CO 0.91 0.40 1.02 0.71 -0.21 0.00 0.00 178.00 180.83 1wj2 s TYR 427 N -5.91 2.53 0.00 0.65 2.02 -1.26 -5.01 117.35 110.36 1wj2 s TYR 427 Ca -0.12 0.77 0.00 0.00 -0.37 0.00 0.00 57.07 57.35 1wj2 s TYR 427 Cb 0.24 -4.07 0.00 0.00 -0.40 0.00 0.00 41.96 37.72 1wj2 s TYR 427 CO 0.79 -1.92 0.00 -2.30 -1.57 0.00 0.00 175.55 170.55 1wj2 n PRO 428 N 7.64 -0.67 -5.00 -1.71 -0.02 -1.26 -4.77 135.00 129.21 1wj2 n PRO 428 Ca 0.16 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.35 1wj2 n PRO 428 Cb 0.47 0.00 -0.17 0.00 -0.02 0.00 0.00 33.50 33.78 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 -1.91 2.33 0.12 -0.52 0.52 -0.50 -4.64 118.95 114.35 1wj2 s ARG 429 Ca 0.00 -0.72 0.09 0.00 -0.52 0.00 0.00 55.73 54.57 1wj2 s ARG 429 Cb 0.00 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 1wj2 s ARG 429 CO 0.00 0.21 -0.21 -1.12 0.02 0.00 0.00 175.30 174.20 1wj2 s SER 430 N 0.20 2.65 -0.25 0.23 0.01 -1.20 -2.84 113.70 112.50 1wj2 s SER 430 Ca -0.10 -0.73 -0.04 0.00 1.31 0.00 0.00 55.95 56.38 1wj2 s SER 430 Cb -0.15 -0.15 0.09 0.00 0.21 0.00 0.00 66.02 66.02 1wj2 s SER 430 CO 0.05 0.05 0.12 -0.31 0.41 0.00 0.00 173.24 173.56 1wj2 s TYR 431 N -1.33 0.32 0.63 2.43 2.02 -1.01 -1.76 117.35 118.65 1wj2 s TYR 431 Ca 0.09 -0.72 0.05 0.00 -0.37 0.00 0.00 57.07 56.11 1wj2 s TYR 431 Cb -0.09 -0.86 0.11 0.00 -0.40 0.00 0.00 41.96 40.73 1wj2 s TYR 431 CO 0.05 -0.73 0.86 0.66 -1.57 0.00 0.00 175.55 174.82 1wj2 n TYR 432 N 5.25 -2.62 -3.47 2.71 4.01 -0.77 -3.35 117.16 118.92 1wj2 n TYR 432 Ca -0.06 -1.87 0.00 0.00 -0.16 0.00 0.00 57.90 55.81 1wj2 n TYR 432 Cb 0.44 -0.61 -0.05 0.00 -0.31 0.00 0.00 39.34 38.81 1wj2 n TYR 432 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1wj2 s LYS 433 N -4.75 0.31 -0.51 -0.72 -2.85 -0.63 -2.20 119.74 108.40 1wj2 s LYS 433 Ca 0.61 0.69 -0.27 0.00 -1.00 0.00 0.00 55.97 56.01 1wj2 s LYS 433 Cb -0.04 0.33 -0.04 0.00 -2.06 0.00 0.00 37.83 36.02 1wj2 s LYS 433 CO 0.40 -0.09 2.10 0.00 0.10 0.00 0.00 175.35 177.85 1wj2 s THR 435 N 10.08 5.85 0.32 0.00 -1.32 -0.76 -2.27 115.64 127.54 1wj2 s THR 435 Ca 0.83 -3.28 0.06 0.00 -1.21 0.00 0.00 61.69 58.09 1wj2 s THR 435 Cb -0.17 -4.65 -0.01 0.00 -1.51 0.00 0.00 72.50 66.16 1wj2 s THR 435 CO 0.25 -1.25 0.45 -0.89 -2.21 0.00 0.00 174.62 170.97 1wj2 s THR 436 N -0.79 4.32 0.51 5.08 2.01 0.23 -4.97 115.64 122.03 1wj2 s THR 436 Ca 0.32 -0.99 0.24 0.00 0.31 0.00 0.00 61.69 61.57 1wj2 s THR 436 Cb -0.09 -3.50 0.40 0.00 0.01 0.00 0.00 72.50 69.31 1wj2 s THR 436 CO -0.07 -0.19 1.97 -0.65 -0.69 0.00 0.00 174.62 174.99 1wj2 h PRO 437 N 0.94 0.08 -0.43 4.92 0.11 -2.00 -2.87 132.00 132.75 1wj2 h PRO 437 Ca -0.47 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.36 1wj2 h PRO 437 Cb 1.25 -0.02 -0.40 0.00 0.11 0.00 0.00 31.00 31.95 1wj2 h PRO 437 CO 0.54 0.05 -1.06 0.41 -0.21 0.00 0.00 178.00 177.73 1wj2 n GLY 438 N -1.63 2.43 3.64 -0.55 0.00 -1.26 -5.06 105.19 102.76 1wj2 n GLY 438 Ca 0.11 -1.27 -0.07 0.00 0.00 0.00 0.00 46.02 44.79 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 3.91 4.04 3.79 0.00 0.00 -1.24 -0.60 105.19 115.08 1wj2 n GLY 440 Ca -0.19 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.36 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 -2.49 4.38 -0.14 1.61 1.01 -0.96 -4.88 120.40 118.92 1wj2 s VAL 441 Ca 0.40 1.62 0.02 0.00 0.00 0.00 0.00 61.98 64.03 1wj2 s VAL 441 Cb 0.24 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.59 1wj2 s VAL 441 CO -0.09 0.36 -0.21 -0.13 0.00 0.00 0.00 175.10 175.03 1wj2 s ARG 442 N -1.55 2.98 -0.07 2.72 0.52 -0.04 0.13 118.95 123.64 1wj2 s ARG 442 Ca 0.41 -0.84 0.04 0.00 -0.52 0.00 0.00 55.73 54.82 1wj2 s ARG 442 Cb -0.21 -2.43 -0.00 0.00 0.52 0.00 0.00 34.95 32.84 1wj2 s ARG 442 CO 0.25 -0.04 -0.20 -1.59 0.02 0.00 0.00 175.30 173.73 1wj2 s LYS 443 N 0.88 2.33 -0.19 3.54 -2.85 -0.93 0.25 119.74 122.76 1wj2 s LYS 443 Ca -0.06 -0.73 -0.08 0.00 -1.00 0.00 0.00 55.97 54.11 1wj2 s LYS 443 Cb -0.15 -1.89 -0.04 0.00 -2.06 0.00 0.00 37.83 33.68 1wj2 s LYS 443 CO -0.03 0.22 0.08 -1.01 0.10 0.00 0.00 175.35 174.71 1wj2 s HIS 444 N 0.18 3.28 -0.43 1.78 3.76 -0.88 -1.85 115.29 121.13 1wj2 s HIS 444 Ca -0.10 0.11 -0.13 0.00 -0.15 0.00 0.00 55.06 54.79 1wj2 s HIS 444 Cb -0.15 -2.11 0.06 0.00 1.11 0.00 0.00 32.58 31.49 1wj2 s HIS 444 CO 0.05 0.15 0.30 0.08 -0.85 0.00 0.00 174.74 174.47 1wj2 s VAL 445 N 0.46 4.84 -0.24 -0.90 1.01 -0.72 -1.77 120.40 123.08 1wj2 s VAL 445 Ca 0.04 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1wj2 s VAL 445 Cb -0.12 -3.83 0.04 0.00 0.00 0.00 0.00 36.38 32.46 1wj2 s VAL 445 CO 0.00 -0.44 -0.11 -1.61 0.00 0.00 0.00 175.10 172.95 1wj2 s GLU 446 N 1.57 2.66 -0.54 2.72 8.01 -0.77 -3.25 118.70 129.10 1wj2 s GLU 446 Ca 0.03 -1.08 -0.19 0.00 0.01 0.00 0.00 54.97 53.75 1wj2 s GLU 446 Cb -0.22 -2.87 0.07 0.00 -4.31 0.00 0.00 34.13 26.81 1wj2 s GLU 446 CO 0.06 -0.42 0.65 1.03 0.01 0.00 0.00 175.26 176.59 1wj2 s ARG 447 N 1.24 3.09 -0.28 1.61 0.52 -1.26 -1.90 118.95 121.97 1wj2 s ARG 447 Ca -0.02 -1.04 -0.28 0.00 -0.52 0.00 0.00 55.73 53.87 1wj2 s ARG 447 Cb -0.17 -4.16 -0.03 0.00 0.52 0.00 0.00 34.95 31.11 1wj2 s ARG 447 CO -0.06 -1.33 1.92 0.00 0.02 0.00 0.00 175.30 175.85 1wj2 s ALA 448 N 2.64 2.87 -0.15 2.13 0.00 0.12 -4.84 121.76 124.53 1wj2 s ALA 448 Ca 0.14 0.47 -0.22 0.00 0.00 0.00 0.00 51.96 52.35 1wj2 s ALA 448 Cb -0.21 -4.02 -0.24 0.00 0.00 0.00 0.00 23.12 18.66 1wj2 s ALA 448 CO 0.10 -2.61 0.49 0.00 0.00 0.00 0.00 175.76 173.74 1wj2 h ALA 449 N 13.37 0.16 -0.42 0.00 0.00 -1.94 -3.10 119.26 127.32 1wj2 h ALA 449 Ca -0.36 -0.97 0.09 0.00 0.00 0.00 0.00 54.91 53.67 1wj2 h ALA 449 Cb 1.19 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 1wj2 h ALA 449 CO 1.00 0.54 0.29 1.79 0.00 0.00 0.00 179.25 182.88 1wj2 h THR 450 N -0.77 0.88 -4.05 0.00 1.35 -1.93 -3.43 112.91 104.96 1wj2 h THR 450 Ca -0.23 -0.06 -0.50 0.00 -0.55 0.00 0.00 66.41 65.07 1wj2 h THR 450 Cb 1.37 0.68 0.04 0.00 -1.73 0.00 0.00 68.15 68.51 1wj2 h THR 450 CO -0.06 0.03 0.30 -1.81 -0.25 0.00 0.00 175.52 173.73 1wj2 s ASP 451 N -6.45 6.35 -0.52 5.36 1.11 -1.26 -4.92 116.67 116.35 1wj2 s ASP 451 Ca -0.06 1.29 -0.21 0.00 0.18 0.00 0.00 52.55 53.75 1wj2 s ASP 451 Cb 0.19 -2.40 -0.20 0.00 1.07 0.00 0.00 42.92 41.58 1wj2 s ASP 451 CO 0.72 -0.68 1.79 -0.81 1.18 0.00 0.00 175.17 177.37 1wj2 n PRO 452 N -2.21 1.04 -2.60 8.23 -0.04 -1.26 -4.26 135.00 133.90 1wj2 n PRO 452 Ca 0.04 -1.46 -0.04 0.00 -0.04 0.00 0.00 63.50 62.00 1wj2 n PRO 452 Cb 0.54 -2.68 0.01 0.00 -0.04 0.00 0.00 33.50 31.33 1wj2 n PRO 452 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1wj2 n LYS 453 N 6.80 -2.34 -4.91 0.54 4.76 -1.26 -5.05 118.16 116.70 1wj2 n LYS 453 Ca 0.45 2.07 -0.27 0.00 -2.87 0.00 0.00 58.31 57.68 1wj2 n LYS 453 Cb 0.35 -4.92 -0.16 0.00 -1.84 0.00 0.00 35.03 28.46 1wj2 n LYS 453 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wj2 s ALA 454 N -2.02 1.63 -0.40 7.82 0.00 -1.17 -5.03 121.76 122.59 1wj2 s ALA 454 Ca 0.14 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.37 1wj2 s ALA 454 Cb -0.04 -0.53 0.12 0.00 0.00 0.00 0.00 23.12 22.67 1wj2 s ALA 454 CO 0.65 0.30 0.16 0.08 0.00 0.00 0.00 175.76 176.95 1wj2 s VAL 455 N -0.01 1.90 -0.13 0.00 1.01 -1.26 0.16 120.40 122.08 1wj2 s VAL 455 Ca -0.03 -2.47 -0.13 0.00 0.00 0.00 0.00 61.98 59.35 1wj2 s VAL 455 Cb -0.12 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 1wj2 s VAL 455 CO 0.02 -0.73 0.28 0.54 0.00 0.00 0.00 175.10 175.21 1wj2 s VAL 456 N 0.60 5.29 -0.12 2.92 0.11 -0.80 -5.00 120.40 123.41 1wj2 s VAL 456 Ca 0.14 0.53 0.01 0.00 -2.93 0.00 0.00 61.98 59.73 1wj2 s VAL 456 Cb -0.22 -3.60 0.02 0.00 -1.53 0.00 0.00 36.38 31.05 1wj2 s VAL 456 CO -0.07 0.46 -0.14 -0.89 -3.33 0.00 0.00 175.10 171.13 1wj2 s THR 457 N -0.06 1.44 -0.78 5.04 2.01 -1.26 -1.85 115.64 120.18 1wj2 s THR 457 Ca 0.17 -0.58 -0.18 0.00 0.31 0.00 0.00 61.69 61.41 1wj2 s THR 457 Cb -0.13 -1.34 0.14 0.00 0.01 0.00 0.00 72.50 71.18 1wj2 s THR 457 CO 0.05 0.43 0.89 -0.89 -0.69 0.00 0.00 174.62 174.42 1wj2 s THR 458 N 1.21 4.94 -0.82 -0.82 2.01 -0.73 -4.90 115.64 116.53 1wj2 s THR 458 Ca -0.02 -1.52 -0.26 0.00 0.31 0.00 0.00 61.69 60.20 1wj2 s THR 458 Cb -0.14 -4.60 0.03 0.00 0.01 0.00 0.00 72.50 67.80 1wj2 s THR 458 CO -0.05 -1.27 1.36 -0.31 -0.69 0.00 0.00 174.62 173.67 1wj2 s TYR 459 N 2.17 2.33 -0.34 4.92 2.02 -1.26 -2.08 117.35 125.11 1wj2 s TYR 459 Ca 0.21 -0.25 -0.17 0.00 -0.37 0.00 0.00 57.07 56.50 1wj2 s TYR 459 Cb -0.13 -4.62 -0.01 0.00 -0.40 0.00 0.00 41.96 36.80 1wj2 s TYR 459 CO -0.03 -2.04 0.45 -1.21 -1.57 0.00 0.00 175.55 171.15 1wj2 s GLU 460 N 5.58 3.62 0.00 -0.62 2.02 0.14 -4.94 118.70 124.50 1wj2 s GLU 460 Ca 0.40 -0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.14 1wj2 s GLU 460 Cb -0.06 -3.80 0.00 0.00 0.10 0.00 0.00 34.13 30.37 1wj2 s GLU 460 CO 0.08 -0.58 0.00 0.41 0.02 0.00 0.00 175.26 175.19 1wj2 n GLY 461 N 4.84 -0.76 3.12 -1.39 0.00 -1.26 -0.86 105.19 108.88 1wj2 n GLY 461 Ca -0.07 -2.19 -0.12 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.06 0.45 -0.38 1.61 1.02 -1.26 -4.97 119.74 116.14 1wj2 s LYS 462 Ca 0.00 -0.20 -0.26 0.00 0.02 0.00 0.00 55.97 55.53 1wj2 s LYS 462 Cb 0.00 0.19 0.02 0.00 -0.52 0.00 0.00 37.83 37.52 1wj2 s LYS 462 CO 0.00 -0.10 0.95 -1.01 -0.92 0.00 0.00 175.35 174.27 1wj2 s HIS 463 N -1.00 3.06 -0.51 3.18 3.76 -1.26 -4.73 115.29 117.79 1wj2 s HIS 463 Ca -0.11 0.78 0.01 0.00 -0.15 0.00 0.00 55.06 55.59 1wj2 s HIS 463 Cb -0.06 -3.71 0.51 0.00 1.11 0.00 0.00 32.58 30.43 1wj2 s HIS 463 CO 0.02 -0.86 1.94 0.09 -0.85 0.00 0.00 174.74 175.08 1wj2 n ASN 464 N 6.86 5.65 -3.78 1.40 3.02 -1.26 -4.90 115.26 122.25 1wj2 n ASN 464 Ca 0.08 -3.57 -0.13 0.00 -0.03 0.00 0.00 54.58 50.93 1wj2 n ASN 464 Cb 0.48 -0.90 -0.10 0.00 -0.61 0.00 0.00 39.78 38.64 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 -3.26 -0.25 0.68 3.10 -3.43 -1.26 -4.95 115.29 105.92 1wj2 s HIS 465 Ca 0.56 0.56 -0.16 0.00 -0.80 0.00 0.00 55.06 55.22 1wj2 s HIS 465 Cb 0.45 0.09 0.01 0.00 -1.43 0.00 0.00 32.58 31.71 1wj2 s HIS 465 CO 0.04 -0.24 1.18 -0.51 -2.00 0.00 0.00 174.74 173.22 1wj2 s ASP 466 N -0.41 4.63 0.14 7.38 1.11 -1.26 -4.92 116.67 123.34 1wj2 s ASP 466 Ca -0.05 2.27 -0.31 0.00 0.18 0.00 0.00 52.55 54.64 1wj2 s ASP 466 Cb -0.03 -2.58 -0.10 0.00 1.07 0.00 0.00 42.92 41.27 1wj2 s ASP 466 CO 0.02 -1.97 1.70 -0.76 1.18 0.00 0.00 175.17 175.34 1wj2 s LEU 467 N -4.85 4.38 1.14 1.23 1.43 -1.26 -4.97 118.68 115.77 1wj2 s LEU 467 Ca 0.73 2.69 -0.16 0.00 -1.03 0.00 0.00 54.13 56.36 1wj2 s LEU 467 Cb -0.27 -3.58 0.23 0.00 0.03 0.00 0.00 46.19 42.59 1wj2 s LEU 467 CO 0.42 -0.93 0.47 -2.65 0.23 0.00 0.00 176.35 173.89 1wj2 n PRO 468 N 4.85 -2.91 0.00 1.29 -0.02 -1.26 -5.19 135.00 131.75 1wj2 n PRO 468 Ca 0.16 -0.86 0.15 0.00 -2.02 0.00 0.00 63.50 60.93 1wj2 n PRO 468 Cb 0.38 -1.62 0.67 0.00 -0.02 0.00 0.00 33.50 32.91 1wj2 n PRO 468 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48