#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpy n LEU 404 N 0.00 0.00 0.30 -1.84 7.94 -1.26 0.10 117.00 122.24 1rpy n LEU 404 Ca 0.00 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 1rpy n LEU 404 Cb 0.00 0.00 0.88 0.00 0.53 0.00 0.00 43.42 44.83 1rpy n LEU 404 CO 0.00 0.00 1.08 -1.28 -1.11 0.00 0.00 177.39 176.08 1rpy h SER 405 N 0.00 0.00 1.15 1.96 0.87 -2.03 -1.39 113.55 114.11 1rpy h SER 405 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1rpy h SER 405 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1rpy h SER 405 CO 0.00 0.00 -0.05 0.47 -0.53 0.00 0.00 176.83 176.72 1rpy n ASP 406 N -2.80 0.37 -4.79 6.23 8.00 0.28 -4.86 116.55 118.98 1rpy n ASP 406 Ca -0.02 0.47 -0.38 0.00 0.71 0.00 0.00 54.79 55.57 1rpy n ASP 406 Cb 0.23 -0.54 -0.06 0.00 -0.02 0.00 0.00 41.12 40.73 1rpy n ASP 406 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1rpy s TYR 407 N -3.05 3.72 0.49 1.24 2.02 -0.52 -4.98 117.35 116.27 1rpy s TYR 407 Ca 0.12 1.14 0.30 0.00 -0.37 0.00 0.00 57.07 58.27 1rpy s TYR 407 Cb 0.16 -2.49 1.67 0.00 -0.40 0.00 0.00 41.96 40.91 1rpy s TYR 407 CO 0.57 0.49 2.16 -1.00 -1.57 0.00 0.00 175.55 176.20 1rpy h PRO 408 N 5.14 0.00 -0.02 -1.71 0.13 -1.89 -2.07 132.00 131.58 1rpy h PRO 408 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1rpy h PRO 408 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1rpy h PRO 408 CO 0.66 0.06 0.00 -2.67 -0.23 0.00 0.00 178.00 175.82 1rpy n TRP 409 N -3.63 0.01 -3.59 1.56 4.27 -1.26 -4.78 117.44 110.02 1rpy n TRP 409 Ca -0.02 -0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.22 1rpy n TRP 409 Cb 0.17 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.05 1rpy n TRP 409 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1rpy s PHE 410 N -1.99 3.43 -0.27 -2.67 5.36 -0.78 -1.03 117.98 120.02 1rpy s PHE 410 Ca 0.41 0.50 0.11 0.00 -0.96 0.00 0.00 56.93 56.99 1rpy s PHE 410 Cb 0.21 -2.30 0.47 0.00 -0.34 0.00 0.00 43.02 41.06 1rpy s PHE 410 CO 0.34 0.23 1.18 0.72 -1.46 0.00 0.00 175.22 176.23 1rpy n HIS 411 N 3.64 2.22 0.00 10.12 8.25 0.69 -4.92 115.22 135.23 1rpy n HIS 411 Ca -0.13 -2.12 0.00 0.00 -0.26 0.00 0.00 57.72 55.21 1rpy n HIS 411 Cb 0.52 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 31.32 1rpy n HIS 411 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rpy n GLY 412 N -0.69 0.93 0.00 -1.41 0.00 -1.26 -1.29 105.19 101.47 1rpy n GLY 412 Ca 0.34 0.23 0.08 0.00 0.00 0.00 0.00 46.02 46.67 1rpy n GLY 412 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rpy n THR 413 N 0.00 0.39 -1.59 2.61 -2.24 -1.26 -0.21 114.28 111.99 1rpy n THR 413 Ca 0.00 0.10 -0.61 0.00 -2.27 0.00 0.00 64.05 61.27 1rpy n THR 413 Cb 0.00 -0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 67.30 1rpy n THR 413 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1rpy n LEU 414 N -1.20 0.56 -4.80 3.22 7.94 -0.41 -4.88 117.00 117.43 1rpy n LEU 414 Ca 0.09 1.16 -0.31 0.00 -1.11 0.00 0.00 56.01 55.84 1rpy n LEU 414 Cb 0.10 -0.94 0.06 0.00 0.53 0.00 0.00 43.42 43.18 1rpy n LEU 414 CO 0.11 -1.48 0.71 -0.94 -1.11 0.00 0.00 177.39 174.68 1rpy s SER 415 N 1.04 5.13 0.13 1.96 1.04 -1.26 -4.64 113.70 117.11 1rpy s SER 415 Ca 0.95 1.68 -0.22 0.00 0.48 0.00 0.00 55.95 58.84 1rpy s SER 415 Cb -1.30 -2.50 -0.02 0.00 0.10 0.00 0.00 66.02 62.29 1rpy s SER 415 CO 0.64 -1.61 1.67 -0.09 0.98 0.00 0.00 173.24 174.83 1rpy h ARG 416 N -0.81 -0.17 -0.20 4.02 2.43 -1.92 0.85 114.38 118.59 1rpy h ARG 416 Ca -0.44 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1rpy h ARG 416 Cb 1.22 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 1rpy h ARG 416 CO 0.55 -0.11 0.07 0.28 -1.51 0.00 0.00 179.97 179.25 1rpy h VAL 417 N -0.17 0.96 0.00 0.20 2.07 -2.00 -1.46 116.25 115.85 1rpy h VAL 417 Ca 0.09 -0.06 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 1rpy h VAL 417 Cb 0.31 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1rpy h VAL 417 CO -0.24 0.03 -0.35 0.50 0.02 0.00 0.00 177.57 177.53 1rpy h LYS 418 N 0.17 0.00 -0.32 1.57 3.64 -1.87 -1.94 116.57 117.82 1rpy h LYS 418 Ca 0.09 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.30 1rpy h LYS 418 Cb 0.05 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1rpy h LYS 418 CO -0.08 0.35 -0.46 0.00 -2.27 0.00 0.00 179.45 176.99 1rpy h ALA 419 N 1.65 0.49 -0.36 5.00 0.00 -0.42 -1.43 119.26 124.19 1rpy h ALA 419 Ca -0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1rpy h ALA 419 Cb 0.66 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1rpy h ALA 419 CO 0.05 0.65 0.13 0.00 0.00 0.00 0.00 179.25 180.07 1rpy h ALA 420 N 0.71 0.47 -0.52 0.00 0.00 -0.96 -1.61 119.26 117.35 1rpy h ALA 420 Ca 0.03 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1rpy h ALA 420 Cb 1.07 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1rpy h ALA 420 CO 0.11 0.08 0.28 0.37 0.00 0.00 0.00 179.25 180.09 1rpy h GLN 421 N 0.43 0.52 0.12 0.00 4.15 -1.29 -0.66 115.11 118.38 1rpy h GLN 421 Ca 0.12 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1rpy h GLN 421 Cb 0.21 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1rpy h GLN 421 CO -0.01 0.34 -0.10 1.25 -1.93 0.00 0.00 178.83 178.38 1rpy h LEU 422 N 0.54 -0.27 -0.66 -2.39 6.46 -0.94 -2.18 115.31 115.86 1rpy h LEU 422 Ca 0.23 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 1rpy h LEU 422 Cb 0.12 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.14 1rpy h LEU 422 CO -0.15 -0.16 0.00 -0.37 -0.62 0.00 0.00 178.44 177.14 1rpy h VAL 423 N -0.24 0.00 0.00 1.05 -1.51 -1.11 -3.08 116.25 111.36 1rpy h VAL 423 Ca -0.00 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 1rpy h VAL 423 Cb 0.22 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1rpy h VAL 423 CO -0.02 0.00 -0.53 0.18 -1.23 0.00 0.00 177.57 175.97 1rpy n LEU 424 N -2.77 0.56 -4.67 4.19 4.77 -0.27 -4.58 117.00 114.24 1rpy n LEU 424 Ca 0.03 0.15 -0.42 0.00 -0.03 0.00 0.00 56.01 55.74 1rpy n LEU 424 Cb 0.37 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1rpy n LEU 424 CO 0.28 0.03 1.44 0.00 -1.33 0.00 0.00 177.39 177.81 1rpy s ALA 425 N -3.09 3.62 0.00 -1.18 0.00 -0.84 -0.31 121.76 119.96 1rpy s ALA 425 Ca 0.09 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.16 1rpy s ALA 425 Cb 0.16 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1rpy s ALA 425 CO 0.70 -1.41 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1rpy n GLY 426 N 4.25 0.61 7.00 0.00 0.00 -1.26 -4.68 105.19 111.11 1rpy n GLY 426 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1rpy n GLY 426 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rpy n GLY 427 N -1.22 1.52 0.52 -0.02 0.00 0.58 -2.47 105.19 104.09 1rpy n GLY 427 Ca 0.00 -0.53 0.34 0.00 0.00 0.00 0.00 46.02 45.83 1rpy n GLY 427 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1rpy h PRO 428 N 0.00 0.00 0.00 1.61 0.11 -1.86 0.60 132.00 132.47 1rpy h PRO 428 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1rpy h PRO 428 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 1rpy h PRO 428 CO 0.00 0.00 -0.03 0.00 -0.21 0.00 0.00 178.00 177.76 1rpy h ARG 429 N 0.00 0.00 -0.62 1.05 3.08 -1.88 -2.01 114.38 114.00 1rpy h ARG 429 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.58 1rpy h ARG 429 Cb 2.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.21 1rpy h ARG 429 CO -0.01 0.03 0.00 0.43 -1.07 0.00 0.00 179.97 179.36 1rpy n SER 430 N -3.21 3.17 -4.61 7.04 7.64 0.20 -4.95 113.62 118.90 1rpy n SER 430 Ca -0.01 -2.32 -0.54 0.00 1.01 0.00 0.00 58.87 57.01 1rpy n SER 430 Cb 0.23 -0.48 -0.06 0.00 -1.01 0.00 0.00 64.21 62.89 1rpy n SER 430 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1rpy n HIS 431 N 0.53 1.55 0.00 1.43 -0.00 -0.76 -0.89 115.22 117.08 1rpy n HIS 431 Ca 0.15 0.66 0.00 0.00 -0.00 0.00 0.00 57.72 58.53 1rpy n HIS 431 Cb 0.62 -2.34 0.00 0.00 -0.00 0.00 0.00 29.99 28.28 1rpy n HIS 431 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rpy n GLY 432 N 2.77 3.34 3.77 1.57 0.00 0.36 -4.99 105.19 112.02 1rpy n GLY 432 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1rpy n GLY 432 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rpy s LEU 433 N 0.00 4.35 0.25 0.99 2.96 -0.07 -4.74 118.68 122.43 1rpy s LEU 433 Ca 0.00 2.93 -0.08 0.00 -0.22 0.00 0.00 54.13 56.77 1rpy s LEU 433 Cb 0.00 -3.66 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1rpy s LEU 433 CO 0.00 -0.78 0.39 0.72 -1.32 0.00 0.00 176.35 175.36 1rpy s PHE 434 N -0.99 0.70 -0.09 5.38 -0.12 -1.26 -1.07 117.98 120.52 1rpy s PHE 434 Ca 0.53 -1.00 -0.18 0.00 -0.05 0.00 0.00 56.93 56.23 1rpy s PHE 434 Cb -0.45 -0.05 0.04 0.00 -0.63 0.00 0.00 43.02 41.94 1rpy s PHE 434 CO 0.59 -0.94 0.44 0.08 -0.05 0.00 0.00 175.22 175.34 1rpy s VAL 435 N -3.86 0.02 -0.13 -2.49 1.01 -0.17 -4.98 120.40 109.80 1rpy s VAL 435 Ca 0.28 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 1rpy s VAL 435 Cb 0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 1rpy s VAL 435 CO 0.12 -0.10 -0.06 -0.63 0.00 0.00 0.00 175.10 174.43 1rpy s ILE 436 N -0.57 3.70 0.12 2.22 -1.09 -0.20 -1.02 121.20 124.36 1rpy s ILE 436 Ca -0.07 -0.44 -0.02 0.00 -2.23 0.00 0.00 60.65 57.89 1rpy s ILE 436 Cb -0.03 -2.58 -0.03 0.00 -1.58 0.00 0.00 42.46 38.23 1rpy s ILE 436 CO 0.04 0.53 0.08 0.00 -1.23 0.00 0.00 174.94 174.35 1rpy s ARG 437 N 0.05 0.91 0.21 2.79 1.70 -0.52 -0.22 118.95 123.87 1rpy s ARG 437 Ca -0.01 -1.36 -0.29 0.00 -0.47 0.00 0.00 55.73 53.60 1rpy s ARG 437 Cb -0.14 0.26 -0.08 0.00 -0.57 0.00 0.00 34.95 34.42 1rpy s ARG 437 CO 0.03 -0.26 0.92 -0.65 -1.08 0.00 0.00 175.30 174.26 1rpy s GLN 438 N -4.01 4.79 0.43 3.89 -0.21 0.71 0.34 119.66 125.61 1rpy s GLN 438 Ca 0.20 1.44 -0.24 0.00 0.02 0.00 0.00 55.36 56.78 1rpy s GLN 438 Cb 0.07 -3.30 -0.08 0.00 1.00 0.00 0.00 33.01 30.70 1rpy s GLN 438 CO -0.00 0.47 1.16 0.45 -2.12 0.00 0.00 175.29 175.25 1rpy s SER 439 N -0.97 6.34 -0.00 5.90 0.15 0.01 -4.74 113.70 120.39 1rpy s SER 439 Ca 0.41 2.30 0.20 0.00 0.70 0.00 0.00 55.95 59.57 1rpy s SER 439 Cb -0.25 -2.61 -0.23 0.00 -1.71 0.00 0.00 66.02 61.22 1rpy s SER 439 CO 0.31 -0.80 0.84 -1.84 1.20 0.00 0.00 173.24 172.94 1rpy n GLU 440 N -0.26 0.26 -0.01 5.44 0.28 -1.26 -4.30 120.64 120.79 1rpy n GLU 440 Ca 0.06 -0.02 0.09 0.00 -0.16 0.00 0.00 57.16 57.13 1rpy n GLU 440 Cb 0.48 -1.47 -0.13 0.00 1.43 0.00 0.00 31.44 31.74 1rpy n GLU 440 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1rpy n THR 441 N -1.55 0.00 -3.61 3.84 -2.24 -1.26 -4.71 114.28 104.75 1rpy n THR 441 Ca 0.03 -0.34 -0.28 0.00 -2.27 0.00 0.00 64.05 61.19 1rpy n THR 441 Cb 0.34 0.27 -0.11 0.00 -2.10 0.00 0.00 70.33 68.73 1rpy n THR 441 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1rpy s ARG 442 N -3.12 1.43 0.21 -0.78 0.52 -1.26 -5.03 118.95 110.92 1rpy s ARG 442 Ca -0.04 -2.42 0.07 0.00 -0.52 0.00 0.00 55.73 52.82 1rpy s ARG 442 Cb 0.12 -2.20 0.64 0.00 0.52 0.00 0.00 34.95 34.03 1rpy s ARG 442 CO 0.74 -1.30 0.95 -2.30 0.02 0.00 0.00 175.30 173.40 1rpy n PRO 443 N 2.78 -0.04 0.21 3.54 -0.02 -1.26 -0.93 135.00 139.28 1rpy n PRO 443 Ca 0.22 0.87 0.11 0.00 -2.02 0.00 0.00 63.50 62.67 1rpy n PRO 443 Cb 0.41 -1.47 0.28 0.00 -0.02 0.00 0.00 33.50 32.69 1rpy n PRO 443 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1rpy h GLY 444 N 0.00 0.00 -1.78 -1.23 0.00 -1.96 -3.45 103.07 94.65 1rpy h GLY 444 Ca 0.44 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.27 1rpy h GLY 444 CO -0.52 0.00 -0.24 -1.83 0.00 0.00 0.00 176.54 173.95 1rpy s GLU 445 N -3.31 2.42 0.33 4.80 -1.05 -0.11 -5.01 118.70 116.77 1rpy s GLU 445 Ca 0.04 -1.66 0.10 0.00 -0.15 0.00 0.00 54.97 53.30 1rpy s GLU 445 Cb 0.07 -2.45 -0.05 0.00 -0.44 0.00 0.00 34.13 31.25 1rpy s GLU 445 CO 0.66 -0.55 -0.04 0.00 0.95 0.00 0.00 175.26 176.27 1rpy s VAL 447 N -2.52 1.12 -0.32 0.00 1.01 0.15 -1.57 120.40 118.27 1rpy s VAL 447 Ca 0.33 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 1rpy s VAL 447 Cb -0.01 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1rpy s VAL 447 CO 0.18 0.17 0.19 -0.22 0.00 0.00 0.00 175.10 175.42 1rpy s LEU 448 N -0.72 4.30 -0.20 3.92 2.96 0.81 -1.44 118.68 128.30 1rpy s LEU 448 Ca 0.04 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.41 1rpy s LEU 448 Cb -0.07 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 1rpy s LEU 448 CO 0.00 -0.22 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.88 1rpy s THR 449 N 1.65 3.49 0.14 3.68 2.01 -0.19 0.17 115.64 126.59 1rpy s THR 449 Ca 0.05 -0.47 -0.01 0.00 0.31 0.00 0.00 61.69 61.58 1rpy s THR 449 Cb -0.17 -2.57 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 1rpy s THR 449 CO 0.08 0.44 0.05 0.72 -0.69 0.00 0.00 174.62 175.22 1rpy s PHE 450 N 1.18 0.92 -0.29 4.92 -0.12 -0.25 -1.00 117.98 123.34 1rpy s PHE 450 Ca 0.02 -1.21 -0.15 0.00 -0.05 0.00 0.00 56.93 55.54 1rpy s PHE 450 Cb -0.14 -0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 41.70 1rpy s PHE 450 CO -0.01 -0.48 0.38 1.21 -0.05 0.00 0.00 175.22 176.27 1rpy s ASN 451 N -3.07 6.24 -0.29 1.98 3.84 -0.23 -0.33 114.94 123.08 1rpy s ASN 451 Ca 0.25 0.17 0.03 0.00 0.21 0.00 0.00 52.86 53.51 1rpy s ASN 451 Cb 0.07 -2.21 0.07 0.00 -0.55 0.00 0.00 41.25 38.64 1rpy s ASN 451 CO 0.03 -0.23 -0.05 0.12 -2.79 0.00 0.00 177.10 174.17 1rpy s PHE 452 N 2.08 3.42 -1.56 0.43 5.36 0.40 -0.49 117.98 127.62 1rpy s PHE 452 Ca 0.14 -2.51 -0.13 0.00 -0.96 0.00 0.00 56.93 53.47 1rpy s PHE 452 Cb -0.16 -2.25 0.10 0.00 -0.34 0.00 0.00 43.02 40.36 1rpy s PHE 452 CO 0.11 -0.90 0.82 1.04 -1.46 0.00 0.00 175.22 174.83 1rpy n GLN 453 N 4.39 -4.36 -0.49 10.12 6.02 -1.26 -1.75 117.38 130.05 1rpy n GLN 453 Ca -0.08 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 1rpy n GLN 453 Cb 0.42 -5.21 0.00 0.00 1.02 0.00 0.00 30.24 26.47 1rpy n GLN 453 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rpy n GLY 454 N -1.62 0.75 3.28 1.08 0.00 -1.26 -4.69 105.19 102.74 1rpy n GLY 454 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1rpy n GLY 454 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rpy s LYS 455 N -0.51 1.61 -0.05 1.61 1.02 -0.72 -4.76 119.74 117.93 1rpy s LYS 455 Ca 0.00 -0.97 -0.25 0.00 0.02 0.00 0.00 55.97 54.77 1rpy s LYS 455 Cb 0.00 -1.71 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 1rpy s LYS 455 CO 0.00 0.45 0.76 0.00 -0.92 0.00 0.00 175.35 175.64 1rpy s ALA 456 N -0.75 3.30 0.10 5.17 0.00 -1.26 -0.45 121.76 127.86 1rpy s ALA 456 Ca 0.09 0.23 0.10 0.00 0.00 0.00 0.00 51.96 52.38 1rpy s ALA 456 Cb -0.09 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1rpy s ALA 456 CO 0.01 -0.13 -0.24 0.15 0.00 0.00 0.00 175.76 175.55 1rpy s LYS 457 N 0.83 1.64 -0.16 0.00 -0.14 0.55 -4.97 119.74 117.50 1rpy s LYS 457 Ca 0.41 -1.22 -0.00 0.00 -1.36 0.00 0.00 55.97 53.80 1rpy s LYS 457 Cb -0.18 -1.99 0.03 0.00 -1.68 0.00 0.00 37.83 34.01 1rpy s LYS 457 CO 0.20 0.48 -0.08 -1.01 -0.76 0.00 0.00 175.35 174.18 1rpy s HIS 458 N -1.00 1.84 -0.22 3.18 3.76 -1.26 -1.09 115.29 120.51 1rpy s HIS 458 Ca 0.14 -1.11 -0.03 0.00 -0.15 0.00 0.00 55.06 53.91 1rpy s HIS 458 Cb -0.10 -1.39 -0.01 0.00 1.11 0.00 0.00 32.58 32.19 1rpy s HIS 458 CO 0.06 -0.62 -0.06 -1.17 -0.85 0.00 0.00 174.74 172.10 1rpy s LEU 459 N 1.59 2.82 0.10 0.89 2.96 0.13 -4.94 118.68 122.23 1rpy s LEU 459 Ca 0.02 -0.42 -0.31 0.00 -0.22 0.00 0.00 54.13 53.20 1rpy s LEU 459 Cb -0.14 -1.71 -0.08 0.00 0.50 0.00 0.00 46.19 44.76 1rpy s LEU 459 CO -0.08 -0.02 1.38 0.00 -1.32 0.00 0.00 176.35 176.31 1rpy s ARG 460 N 1.46 4.32 0.66 1.98 1.70 -1.26 -0.13 118.95 127.67 1rpy s ARG 460 Ca 0.06 2.05 0.02 0.00 -0.47 0.00 0.00 55.73 57.38 1rpy s ARG 460 Cb -0.14 -3.28 0.10 0.00 -0.57 0.00 0.00 34.95 31.06 1rpy s ARG 460 CO -0.04 -0.44 0.91 -0.51 -1.08 0.00 0.00 175.30 174.14 1rpy s LEU 461 N 1.22 3.07 0.00 -1.89 1.43 -0.61 -4.91 118.68 116.99 1rpy s LEU 461 Ca 0.64 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 1rpy s LEU 461 Cb -0.36 -2.10 0.00 0.00 0.03 0.00 0.00 46.19 43.76 1rpy s LEU 461 CO 0.30 -1.62 0.00 1.57 0.23 0.00 0.00 176.35 176.83 1rpy n HIS 466 N -2.62 0.00 -1.05 0.29 -0.00 -1.26 -4.48 115.22 106.10 1rpy n HIS 466 Ca 0.14 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.84 1rpy n HIS 466 Cb 0.61 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.59 1rpy n HIS 466 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rpy n GLY 467 N 0.00 0.44 1.93 1.57 0.00 -1.26 -4.88 105.19 102.98 1rpy n GLY 467 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 46.02 45.90 1rpy n GLY 467 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rpy n GLN 468 N -1.49 4.17 -0.28 1.61 6.02 -1.26 -4.55 117.38 121.59 1rpy n GLN 468 Ca -0.02 -3.00 -0.01 0.00 -0.01 0.00 0.00 57.00 53.96 1rpy n GLN 468 Cb 0.24 -2.22 0.19 0.00 1.02 0.00 0.00 30.24 29.47 1rpy n GLN 468 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rpy h HIS 470 N 1.14 0.20 -0.87 0.00 -0.00 -2.00 -1.01 115.15 112.61 1rpy h HIS 470 Ca 0.31 -0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.69 1rpy h HIS 470 Cb -0.11 -0.06 -0.05 0.00 -0.00 0.00 0.00 27.41 27.20 1rpy h HIS 470 CO 0.00 0.32 0.57 0.28 -0.00 0.00 0.00 177.93 179.11 1rpy h VAL 471 N 0.02 1.15 -0.78 5.26 2.07 -1.83 -0.56 116.25 121.59 1rpy h VAL 471 Ca 0.04 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.21 1rpy h VAL 471 Cb 0.22 -0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 29.90 1rpy h VAL 471 CO -0.00 0.20 0.50 -0.61 0.02 0.00 0.00 177.57 177.68 1rpy h GLN 472 N 1.10 0.97 -0.68 1.57 5.75 -0.67 -1.12 115.11 122.02 1rpy h GLN 472 Ca 0.35 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.73 1rpy h GLN 472 Cb 0.01 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.32 1rpy h GLN 472 CO -0.10 0.64 0.20 0.45 -2.65 0.00 0.00 178.83 177.36 1rpy h HIS 473 N 1.00 1.12 -0.73 3.99 3.86 0.20 -1.82 115.15 122.76 1rpy h HIS 473 Ca 0.30 -0.12 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 1rpy h HIS 473 Cb -0.04 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 28.08 1rpy h HIS 473 CO -0.03 0.91 0.33 -0.07 0.86 0.00 0.00 177.93 179.93 1rpy h LEU 474 N 1.01 0.96 0.38 2.43 3.38 -0.51 0.34 115.31 123.29 1rpy h LEU 474 Ca 0.22 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1rpy h LEU 474 Cb 0.33 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1rpy h LEU 474 CO -0.00 0.82 -0.18 -0.25 0.09 0.00 0.00 178.44 178.92 1rpy h TRP 475 N 1.04 -0.47 -0.44 1.13 -0.00 -0.73 -0.67 115.95 115.81 1rpy h TRP 475 Ca 0.25 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.89 59.11 1rpy h TRP 475 Cb 0.14 0.16 -0.02 0.00 -0.00 0.00 0.00 29.16 29.43 1rpy h TRP 475 CO 0.01 -0.26 0.19 0.74 -0.00 0.00 0.00 178.44 179.13 1rpy h PHE 476 N -0.56 0.60 -0.33 2.65 0.04 -1.07 -1.13 116.94 117.15 1rpy h PHE 476 Ca -0.05 -0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.60 1rpy h PHE 476 Cb 0.42 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 1rpy h PHE 476 CO -0.04 0.46 -0.21 0.37 -0.60 0.00 0.00 178.31 178.29 1rpy h GLN 477 N 0.61 0.63 -0.22 1.51 5.75 -0.70 -0.07 115.11 122.63 1rpy h GLN 477 Ca 0.15 -0.23 -0.13 0.00 -0.15 0.00 0.00 58.65 58.29 1rpy h GLN 477 Cb 0.09 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 1rpy h GLN 477 CO -0.02 0.80 -0.42 0.66 -2.65 0.00 0.00 178.83 177.20 1rpy h SER 478 N 0.55 0.56 -0.45 -0.69 4.64 0.00 -0.03 113.55 118.14 1rpy h SER 478 Ca 0.08 -0.26 -0.13 0.00 -0.47 0.00 0.00 61.79 61.02 1rpy h SER 478 Cb 0.67 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1rpy h SER 478 CO 0.05 0.92 -0.23 0.58 -0.87 0.00 0.00 176.83 177.28 1rpy h VAL 479 N 0.43 1.27 -0.60 0.95 2.07 -0.93 -2.84 116.25 116.61 1rpy h VAL 479 Ca 0.03 -1.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.14 1rpy h VAL 479 Cb 0.92 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1rpy h VAL 479 CO 0.08 0.47 0.24 0.15 0.02 0.00 0.00 177.57 178.54 1rpy h PHE 480 N 0.78 0.87 0.00 1.57 3.57 -0.63 -3.03 116.94 120.07 1rpy h PHE 480 Ca 0.10 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1rpy h PHE 480 Cb 0.80 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1rpy h PHE 480 CO 0.06 0.67 0.00 -0.25 -2.23 0.00 0.00 178.31 176.56 1rpy n ASP 481 N -4.32 0.21 0.00 0.41 8.00 -0.06 -4.25 116.55 116.54 1rpy n ASP 481 Ca 0.05 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.36 1rpy n ASP 481 Cb 0.16 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 1rpy n ASP 481 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1rpy n LEU 483 N 1.03 0.00 -0.00 0.64 4.77 -1.15 -4.66 117.00 117.63 1rpy n LEU 483 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1rpy n LEU 483 Cb 0.03 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 1rpy n LEU 483 CO 0.00 0.00 0.50 -0.09 -1.33 0.00 0.00 177.39 176.47 1rpy h ARG 484 N 0.00 -0.04 -0.60 3.23 9.65 -1.91 0.45 114.38 125.16 1rpy h ARG 484 Ca 0.00 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 58.99 1rpy h ARG 484 Cb 0.00 0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 28.51 1rpy h ARG 484 CO 0.00 -0.03 0.15 1.25 2.80 0.00 0.00 179.97 184.14 1rpy h HIS 485 N -0.04 0.24 -0.68 2.20 2.76 -1.96 -0.68 115.15 116.99 1rpy h HIS 485 Ca 0.00 0.03 0.08 0.00 -2.20 0.00 0.00 60.37 58.28 1rpy h HIS 485 Cb 0.05 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 28.95 1rpy h HIS 485 CO -0.46 -0.00 0.45 0.35 -1.30 0.00 0.00 177.93 176.97 1rpy h PHE 486 N 0.29 0.65 -0.59 5.26 3.57 -1.82 0.19 116.94 124.49 1rpy h PHE 486 Ca 0.31 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.83 1rpy h PHE 486 Cb 0.45 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1rpy h PHE 486 CO -0.23 0.33 0.00 0.72 -2.23 0.00 0.00 178.31 176.90 1rpy n HIS 487 N -4.48 1.84 -0.45 0.41 8.25 0.15 -5.08 115.22 115.86 1rpy n HIS 487 Ca 0.10 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.90 1rpy n HIS 487 Cb 0.28 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 30.98 1rpy n HIS 487 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39