#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kpb s LEU 389 N 0.00 3.79 0.25 -4.42 1.02 -1.26 -0.87 118.68 117.19 3kpb s LEU 389 Ca 0.00 0.91 -0.03 0.00 0.02 0.00 0.00 54.13 55.03 3kpb s LEU 389 Cb 0.00 -3.82 0.52 0.00 0.02 0.00 0.00 46.19 42.91 3kpb s LEU 389 CO 0.00 -0.44 1.68 0.58 0.02 0.00 0.00 176.35 178.19 3kpb h VAL 390 N 0.71 0.49 -0.09 -1.59 2.07 -0.83 -0.43 116.25 116.57 3kpb h VAL 390 Ca -0.47 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 66.98 3kpb h VAL 390 Cb 1.20 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3kpb h VAL 390 CO 0.63 0.05 0.13 0.07 0.02 0.00 0.00 177.57 178.47 3kpb h LYS 391 N 0.29 0.00 0.00 1.57 2.10 -1.43 -1.06 116.57 118.04 3kpb h LYS 391 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 3kpb h LYS 391 Cb 0.79 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 3kpb h LYS 391 CO -0.53 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.67 3kpb n ASP 392 N -3.65 0.74 -0.15 7.07 8.00 -0.17 -3.81 116.55 124.58 3kpb n ASP 392 Ca -0.01 0.59 0.03 0.00 0.71 0.00 0.00 54.79 56.12 3kpb n ASP 392 Cb 0.23 -0.78 -0.00 0.00 -0.02 0.00 0.00 41.12 40.54 3kpb n ASP 392 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3kpb n ILE 393 N -2.21 0.00 -2.22 0.53 -5.35 -0.41 -4.99 119.36 104.70 3kpb n ILE 393 Ca 0.05 -0.42 -0.42 0.00 -0.27 0.00 0.00 62.75 61.69 3kpb n ILE 393 Cb 0.39 1.08 -0.03 0.00 -1.74 0.00 0.00 39.64 39.33 3kpb n ILE 393 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3kpb s LEU 394 N -1.47 4.37 0.00 7.28 1.43 -1.14 -4.91 118.68 124.25 3kpb s LEU 394 Ca 0.06 2.26 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 3kpb s LEU 394 Cb 0.06 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.69 3kpb s LEU 394 CO 0.18 -0.62 0.71 -1.54 0.23 0.00 0.00 176.35 175.31 3kpb n SER 395 N 4.02 1.29 -3.63 2.29 3.41 -1.26 -5.06 113.62 114.68 3kpb n SER 395 Ca 0.11 -1.50 -0.10 0.00 -0.26 0.00 0.00 58.87 57.11 3kpb n SER 395 Cb 0.43 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 3kpb n SER 395 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3kpb s LYS 396 N -0.50 1.36 0.86 4.33 -2.85 -1.26 -5.17 119.74 116.51 3kpb s LYS 396 Ca 0.00 -0.72 -0.11 0.00 -1.00 0.00 0.00 55.97 54.13 3kpb s LYS 396 Cb 0.00 0.55 0.11 0.00 -2.06 0.00 0.00 37.83 36.43 3kpb s LYS 396 CO 0.00 -0.59 1.09 -1.25 0.10 0.00 0.00 175.35 174.70 3kpb s PRO 397 N -3.83 1.58 0.68 1.78 0.04 -1.26 -4.90 135.00 129.10 3kpb s PRO 397 Ca 0.06 1.00 -0.16 0.00 0.04 0.00 0.00 61.00 61.94 3kpb s PRO 397 Cb -0.01 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.71 3kpb s PRO 397 CO -0.06 -2.07 1.18 -1.25 0.04 0.00 0.00 177.00 174.84 3kpb s PRO 398 N -4.89 2.48 -0.14 0.56 0.04 -1.26 -4.91 135.00 126.89 3kpb s PRO 398 Ca 0.63 1.67 -0.00 0.00 0.04 0.00 0.00 61.00 63.34 3kpb s PRO 398 Cb -0.18 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.51 3kpb s PRO 398 CO 0.57 -1.55 -0.07 0.42 0.04 0.00 0.00 177.00 176.40 3kpb s ILE 399 N -2.00 1.12 0.25 0.56 1.01 -1.26 -5.01 121.20 115.86 3kpb s ILE 399 Ca 0.73 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.93 3kpb s ILE 399 Cb -0.27 -1.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 3kpb s ILE 399 CO 0.42 0.29 0.11 0.42 0.00 0.00 0.00 174.94 176.17 3kpb s THR 400 N 1.66 0.41 0.03 2.92 -4.23 -1.26 -4.19 115.64 110.98 3kpb s THR 400 Ca 0.03 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.50 3kpb s THR 400 Cb -0.14 -2.60 -0.02 0.00 1.34 0.00 0.00 72.50 71.09 3kpb s THR 400 CO -0.08 0.00 0.06 0.00 -0.54 0.00 0.00 174.62 174.06 3kpb s ALA 401 N -3.83 0.03 0.47 3.99 0.00 -0.96 -5.01 121.76 116.44 3kpb s ALA 401 Ca 0.38 -0.62 -0.15 0.00 0.00 0.00 0.00 51.96 51.57 3kpb s ALA 401 Cb 0.07 0.23 -0.08 0.00 0.00 0.00 0.00 23.12 23.35 3kpb s ALA 401 CO 0.14 -0.29 0.91 -1.01 0.00 0.00 0.00 175.76 175.50 3kpb s HIS 402 N -2.53 3.45 0.12 0.00 3.76 -1.26 -0.93 115.29 117.88 3kpb s HIS 402 Ca -0.06 1.34 0.34 0.00 -0.15 0.00 0.00 55.06 56.53 3kpb s HIS 402 Cb -0.02 -2.68 1.47 0.00 1.11 0.00 0.00 32.58 32.46 3kpb s HIS 402 CO -0.04 -0.26 2.01 0.66 -0.85 0.00 0.00 174.74 176.25 3kpb h SER 403 N 1.13 0.00 -0.03 1.40 4.64 -1.92 -2.99 113.55 115.78 3kpb h SER 403 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3kpb h SER 403 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3kpb h SER 403 CO 0.62 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.12 3kpb n ASN 404 N -3.00 1.17 -4.80 4.97 2.04 -1.26 -1.22 115.26 113.15 3kpb n ASN 404 Ca 0.00 -1.42 -0.33 0.00 -0.44 0.00 0.00 54.58 52.40 3kpb n ASN 404 Cb 0.26 -0.01 0.00 0.00 -2.53 0.00 0.00 39.78 37.51 3kpb n ASN 404 CO 0.00 0.00 0.00 0.27 -0.44 0.00 0.00 177.26 177.09 3kpb s ILE 405 N -1.98 3.83 0.75 1.53 -4.36 -1.13 -4.79 121.20 115.05 3kpb s ILE 405 Ca 0.39 0.90 -0.11 0.00 -0.26 0.00 0.00 60.65 61.58 3kpb s ILE 405 Cb 0.21 -3.40 0.04 0.00 1.25 0.00 0.00 42.46 40.56 3kpb s ILE 405 CO 0.33 -0.48 1.08 -0.94 0.24 0.00 0.00 174.94 175.18 3kpb s SER 406 N -2.69 4.73 0.22 4.36 1.04 -1.26 -1.48 113.70 118.62 3kpb s SER 406 Ca 0.64 1.79 -0.07 0.00 0.48 0.00 0.00 55.95 58.78 3kpb s SER 406 Cb -0.16 -2.52 0.30 0.00 0.10 0.00 0.00 66.02 63.75 3kpb s SER 406 CO 0.35 -1.88 1.81 0.40 0.98 0.00 0.00 173.24 174.90 3kpb h ILE 407 N -0.98 0.95 -0.64 -1.02 1.08 -1.81 -1.64 117.51 113.46 3kpb h ILE 407 Ca -0.44 -0.26 -0.01 0.00 -0.39 0.00 0.00 64.86 63.77 3kpb h ILE 407 Cb 1.23 0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.09 3kpb h ILE 407 CO 0.53 0.14 0.38 -0.03 -0.69 0.00 0.00 178.15 178.47 3kpb h MET 408 N 0.74 0.88 -0.54 2.37 4.05 -1.92 -0.58 114.93 119.92 3kpb h MET 408 Ca 0.34 -0.08 -0.08 0.00 -0.28 0.00 0.00 59.70 59.60 3kpb h MET 408 Cb 0.25 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 30.84 3kpb h MET 408 CO -0.21 0.64 0.03 0.93 0.23 0.00 0.00 176.91 178.53 3kpb h GLU 409 N 0.87 0.90 -0.44 0.39 4.39 -1.80 -0.95 114.58 117.94 3kpb h GLU 409 Ca 0.23 -0.24 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 3kpb h GLU 409 Cb -0.01 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 3kpb h GLU 409 CO -0.04 0.88 0.08 0.00 -1.16 0.00 0.00 179.01 178.76 3kpb h ALA 410 N 1.19 0.58 -0.91 3.43 0.00 -1.05 -2.68 119.26 119.82 3kpb h ALA 410 Ca 0.16 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3kpb h ALA 410 Cb 0.46 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 3kpb h ALA 410 CO 0.02 0.30 0.59 0.00 0.00 0.00 0.00 179.25 180.15 3kpb h ALA 411 N 0.95 1.22 -0.80 0.00 0.00 -0.80 -1.66 119.26 118.16 3kpb h ALA 411 Ca 0.13 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3kpb h ALA 411 Cb 0.36 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3kpb h ALA 411 CO 0.01 0.42 0.53 0.87 0.00 0.00 0.00 179.25 181.08 3kpb h LYS 412 N 1.12 1.00 -0.38 0.00 1.57 -0.97 -1.93 116.57 116.98 3kpb h LYS 412 Ca 0.37 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 59.04 3kpb h LYS 412 Cb 0.05 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 3kpb h LYS 412 CO -0.13 0.66 0.05 0.82 -0.57 0.00 0.00 179.45 180.28 3kpb h ILE 413 N 1.03 1.24 -0.36 1.86 2.04 -0.99 -0.47 117.51 121.86 3kpb h ILE 413 Ca 0.31 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.31 3kpb h ILE 413 Cb -0.03 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 3kpb h ILE 413 CO -0.08 0.30 0.19 -0.07 0.00 0.00 0.00 178.15 178.49 3kpb h LEU 414 N 0.48 0.30 -0.23 1.44 3.38 -0.98 -2.56 115.31 117.13 3kpb h LEU 414 Ca 0.11 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 3kpb h LEU 414 Cb 0.38 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3kpb h LEU 414 CO 0.01 0.22 -0.28 0.40 0.09 0.00 0.00 178.44 178.87 3kpb h ILE 415 N 0.39 1.32 -0.92 1.22 1.08 -1.26 -0.48 117.51 118.86 3kpb h ILE 415 Ca 0.15 -1.47 0.04 0.00 -0.39 0.00 0.00 64.86 63.19 3kpb h ILE 415 Cb 0.03 1.73 -0.06 0.00 -3.07 0.00 0.00 36.82 35.45 3kpb h ILE 415 CO -0.09 0.46 0.59 0.50 -0.69 0.00 0.00 178.15 178.93 3kpb h LYS 416 N 0.30 1.09 -0.05 2.37 3.64 -1.01 -2.78 116.57 120.14 3kpb h LYS 416 Ca 0.03 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3kpb h LYS 416 Cb 0.86 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3kpb h LYS 416 CO 0.07 0.72 0.00 0.72 -2.27 0.00 0.00 179.45 178.69 3kpb n HIS 417 N -4.52 0.03 -3.71 1.91 8.25 -0.97 -4.98 115.22 111.22 3kpb n HIS 417 Ca 0.12 -0.02 -0.21 0.00 -0.26 0.00 0.00 57.72 57.35 3kpb n HIS 417 Cb 0.12 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.26 3kpb n HIS 417 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3kpb n ASN 418 N 1.31 -1.12 -4.32 0.41 4.05 -0.28 -5.00 115.26 110.31 3kpb n ASN 418 Ca 0.14 -0.83 -0.24 0.00 0.45 0.00 0.00 54.58 54.09 3kpb n ASN 418 Cb 0.58 -4.01 -0.12 0.00 1.23 0.00 0.00 39.78 37.46 3kpb n ASN 418 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 3kpb s ILE 419 N -3.68 1.85 -0.84 -1.44 -4.36 -0.68 -5.04 121.20 107.00 3kpb s ILE 419 Ca 0.00 -1.67 0.08 0.00 -0.26 0.00 0.00 60.65 58.81 3kpb s ILE 419 Cb -0.00 -1.70 0.18 0.00 1.25 0.00 0.00 42.46 42.19 3kpb s ILE 419 CO 0.82 -0.09 1.06 -3.20 0.24 0.00 0.00 174.94 173.77 3kpb n ASN 420 N 0.87 2.39 -3.86 4.36 5.15 -1.26 -4.65 115.26 118.26 3kpb n ASN 420 Ca -0.18 -1.79 -0.22 0.00 -0.60 0.00 0.00 54.58 51.79 3kpb n ASN 420 Cb 0.54 -0.12 -0.17 0.00 -0.53 0.00 0.00 39.78 39.50 3kpb n ASN 420 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 3kpb s HIS 421 N -0.91 0.87 -0.31 1.20 3.76 -1.26 -3.97 115.29 114.68 3kpb s HIS 421 Ca 0.15 -0.29 0.01 0.00 -0.15 0.00 0.00 55.06 54.78 3kpb s HIS 421 Cb 0.09 -0.82 0.09 0.00 1.11 0.00 0.00 32.58 33.05 3kpb s HIS 421 CO 0.12 -0.29 0.07 -1.17 -0.85 0.00 0.00 174.74 172.61 3kpb s LEU 422 N 1.38 2.91 0.31 0.89 2.96 0.07 -4.99 118.68 122.20 3kpb s LEU 422 Ca -0.03 -1.71 -0.29 0.00 -0.22 0.00 0.00 54.13 51.88 3kpb s LEU 422 Cb -0.13 -1.09 -0.11 0.00 0.50 0.00 0.00 46.19 45.36 3kpb s LEU 422 CO -0.03 -0.39 1.47 -2.84 -1.32 0.00 0.00 176.35 173.24 3kpb s PRO 423 N 1.41 4.21 -0.14 0.98 0.02 -1.26 -1.52 135.00 138.70 3kpb s PRO 423 Ca 0.08 2.42 -0.05 0.00 0.02 0.00 0.00 61.00 63.47 3kpb s PRO 423 Cb -0.18 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 3kpb s PRO 423 CO -0.18 -0.46 0.05 0.42 -0.33 0.00 0.00 177.00 176.50 3kpb s ILE 424 N -0.48 4.74 0.19 2.83 -1.09 0.79 -2.27 121.20 125.91 3kpb s ILE 424 Ca 0.57 -0.07 0.07 0.00 -2.23 0.00 0.00 60.65 58.99 3kpb s ILE 424 Cb -0.44 -3.07 -0.05 0.00 -1.58 0.00 0.00 42.46 37.32 3kpb s ILE 424 CO 0.51 0.54 -0.12 0.68 -1.23 0.00 0.00 174.94 175.32 3kpb s VAL 425 N -0.29 1.55 0.18 2.92 -7.23 -0.11 -0.42 120.40 117.00 3kpb s VAL 425 Ca 0.08 -2.16 -0.00 0.00 -1.81 0.00 0.00 61.98 58.09 3kpb s VAL 425 Cb -0.12 -2.02 0.04 0.00 0.56 0.00 0.00 36.38 34.83 3kpb s VAL 425 CO 0.02 -0.61 0.24 -0.90 -0.31 0.00 0.00 175.10 173.54 3kpb n ASP 426 N -0.34 0.33 0.32 4.85 5.68 -0.46 -3.19 116.55 123.73 3kpb n ASP 426 Ca -0.08 -1.28 0.21 0.00 -0.50 0.00 0.00 54.79 53.13 3kpb n ASP 426 Cb 0.61 -0.16 1.02 0.00 -1.14 0.00 0.00 41.12 41.45 3kpb n ASP 426 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3kpb h GLU 427 N 0.00 0.00 -0.00 0.11 9.09 -2.00 0.91 114.58 122.68 3kpb h GLU 427 Ca -0.08 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.33 3kpb h GLU 427 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 3kpb h GLU 427 CO 0.09 0.00 -0.26 0.72 0.05 0.00 0.00 179.01 179.61 3kpb n HIS 428 N -3.10 0.00 -0.69 2.06 8.25 -1.26 -4.93 115.22 115.54 3kpb n HIS 428 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 3kpb n HIS 428 Cb 0.16 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.07 3kpb n HIS 428 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kpb n GLY 429 N 1.38 0.69 3.73 -1.41 0.00 0.31 -4.97 105.19 104.92 3kpb n GLY 429 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3kpb n GLY 429 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kpb s LYS 430 N -0.31 4.52 0.12 1.61 2.20 -1.26 -3.98 119.74 122.64 3kpb s LYS 430 Ca 0.00 1.78 -0.31 0.00 -0.36 0.00 0.00 55.97 57.08 3kpb s LYS 430 Cb 0.00 -3.29 -0.10 0.00 -1.51 0.00 0.00 37.83 32.93 3kpb s LYS 430 CO 0.00 -0.07 1.81 -1.17 -0.36 0.00 0.00 175.35 175.56 3kpb s LEU 431 N 0.06 4.39 0.00 5.43 2.96 -0.19 -1.36 118.68 129.98 3kpb s LEU 431 Ca 0.53 2.73 0.00 0.00 -0.22 0.00 0.00 54.13 57.17 3kpb s LEU 431 Cb -0.30 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.82 3kpb s LEU 431 CO 0.34 -0.99 0.00 1.33 -1.32 0.00 0.00 176.35 175.71 3kpb n VAL 432 N 4.72 0.00 -2.02 1.68 0.24 0.44 -4.92 118.33 118.47 3kpb n VAL 432 Ca 0.17 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 3kpb n VAL 432 Cb 0.38 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.62 3kpb n VAL 432 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kpb n GLY 433 N 1.21 -1.23 3.21 7.63 0.00 -1.05 -4.59 105.19 110.37 3kpb n GLY 433 Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 3kpb n GLY 433 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kpb s ILE 434 N -2.66 0.04 0.10 -0.61 2.07 -0.35 -0.15 121.20 119.65 3kpb s ILE 434 Ca 0.00 -0.35 0.05 0.00 -1.41 0.00 0.00 60.65 58.94 3kpb s ILE 434 Cb 0.00 -0.54 -0.03 0.00 0.13 0.00 0.00 42.46 42.01 3kpb s ILE 434 CO 0.00 -0.19 -0.14 0.27 -1.91 0.00 0.00 174.94 172.97 3kpb s ILE 435 N -0.87 1.22 0.45 2.00 -5.25 -0.58 -1.75 121.20 116.42 3kpb s ILE 435 Ca -0.10 -1.57 0.03 0.00 -0.99 0.00 0.00 60.65 58.02 3kpb s ILE 435 Cb -0.05 -1.37 -0.03 0.00 2.95 0.00 0.00 42.46 43.97 3kpb s ILE 435 CO 0.03 -0.37 0.06 0.42 -1.79 0.00 0.00 174.94 173.29 3kpb s THR 436 N -1.88 1.01 0.47 8.37 -4.23 -1.26 -0.75 115.64 117.36 3kpb s THR 436 Ca 0.05 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.79 3kpb s THR 436 Cb -0.06 -2.36 0.27 0.00 1.34 0.00 0.00 72.50 71.69 3kpb s THR 436 CO 0.02 0.00 2.09 0.77 -0.54 0.00 0.00 174.62 176.97 3kpb h SER 437 N 1.62 0.00 -0.61 3.99 4.64 -1.92 -1.32 113.55 119.95 3kpb h SER 437 Ca -0.40 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.93 3kpb h SER 437 Cb 1.29 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 3kpb h SER 437 CO 0.67 0.11 0.40 -0.25 -0.87 0.00 0.00 176.83 176.89 3kpb h TRP 438 N 0.00 0.75 -0.33 4.77 2.91 -1.96 -1.56 115.95 120.53 3kpb h TRP 438 Ca -0.00 0.02 -0.06 0.00 1.13 0.00 0.00 58.89 59.97 3kpb h TRP 438 Cb 0.24 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 28.62 3kpb h TRP 438 CO 0.00 0.46 -0.07 -0.44 -1.03 0.00 0.00 178.44 177.35 3kpb h ASP 439 N 0.80 0.52 -0.32 2.65 3.32 -1.65 -0.13 116.42 121.61 3kpb h ASP 439 Ca 0.23 -0.12 0.02 0.00 0.02 0.00 0.00 57.03 57.18 3kpb h ASP 439 Cb -0.06 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3kpb h ASP 439 CO -0.07 0.64 0.17 0.40 -1.72 0.00 0.00 179.24 178.66 3kpb h ILE 440 N 0.51 1.01 -0.35 0.35 1.08 -0.97 0.72 117.51 119.86 3kpb h ILE 440 Ca 0.10 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.45 3kpb h ILE 440 Cb 0.44 0.62 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 3kpb h ILE 440 CO 0.02 0.06 0.22 0.00 -0.69 0.00 0.00 178.15 177.77 3kpb h ALA 441 N 1.15 0.45 -0.53 1.87 0.00 -0.82 -1.66 119.26 119.72 3kpb h ALA 441 Ca 0.13 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3kpb h ALA 441 Cb 0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 3kpb h ALA 441 CO -0.08 -0.07 0.26 0.87 0.00 0.00 0.00 179.25 180.23 3kpb h LYS 442 N 0.46 0.48 -0.49 0.00 1.57 -0.76 -1.33 116.57 116.50 3kpb h LYS 442 Ca 0.13 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 3kpb h LYS 442 Cb -0.02 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3kpb h LYS 442 CO -0.03 0.32 0.22 0.00 -0.57 0.00 0.00 179.45 179.39 3kpb h ALA 443 N 1.29 0.63 -0.29 3.86 0.00 -0.63 -1.75 119.26 122.36 3kpb h ALA 443 Ca 0.24 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3kpb h ALA 443 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3kpb h ALA 443 CO -0.18 0.21 0.07 1.25 0.00 0.00 0.00 179.25 180.61 3kpb h LEU 444 N 0.64 0.44 -1.08 0.00 5.85 -1.09 0.68 115.31 120.75 3kpb h LEU 444 Ca 0.17 -0.23 0.10 0.00 0.84 0.00 0.00 57.88 58.76 3kpb h LEU 444 Cb 0.15 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.99 3kpb h LEU 444 CO -0.02 0.56 0.62 0.00 -0.34 0.00 0.00 178.44 179.26 3kpb h ALA 445 N 0.90 1.55 -0.25 1.25 0.00 -1.10 -1.77 119.26 119.84 3kpb h ALA 445 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3kpb h ALA 445 Cb 0.29 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3kpb h ALA 445 CO 0.00 0.24 0.00 1.04 0.00 0.00 0.00 179.25 180.53 3kpb n GLN 446 N -4.56 1.97 -3.78 0.00 6.02 -0.67 -4.95 117.38 111.40 3kpb n GLN 446 Ca 0.17 -1.47 -0.26 0.00 -0.01 0.00 0.00 57.00 55.44 3kpb n GLN 446 Cb 0.31 -1.42 0.04 0.00 1.02 0.00 0.00 30.24 30.19 3kpb n GLN 446 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3kpb n ASN 447 N 0.69 -3.63 -4.80 1.08 5.15 -0.27 -4.98 115.26 108.50 3kpb n ASN 447 Ca 0.17 -0.76 -0.34 0.00 -0.60 0.00 0.00 54.58 53.05 3kpb n ASN 447 Cb 0.41 -4.14 -0.03 0.00 -0.53 0.00 0.00 39.78 35.49 3kpb n ASN 447 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3kpb s LYS 448 N -6.31 3.71 -0.26 1.20 -0.14 0.07 -5.01 119.74 113.00 3kpb s LYS 448 Ca 0.40 1.33 -0.08 0.00 -1.36 0.00 0.00 55.97 56.25 3kpb s LYS 448 Cb -0.20 -2.08 -0.15 0.00 -1.68 0.00 0.00 37.83 33.72 3kpb s LYS 448 CO 0.81 -0.51 -0.23 1.63 -0.76 0.00 0.00 175.35 176.30 3kpb n LYS 449 N -1.18 0.62 -4.44 1.68 4.76 -1.26 -4.77 118.16 113.56 3kpb n LYS 449 Ca 0.09 0.24 -0.22 0.00 -2.87 0.00 0.00 58.31 55.55 3kpb n LYS 449 Cb 0.53 -1.53 -0.10 0.00 -1.84 0.00 0.00 35.03 32.08 3kpb n LYS 449 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3kpb s THR 450 N -2.51 2.11 0.34 -0.18 -1.32 -1.26 -2.58 115.64 110.25 3kpb s THR 450 Ca -0.36 -2.28 0.05 0.00 -1.21 0.00 0.00 61.69 57.89 3kpb s THR 450 Cb 0.12 -2.32 0.30 0.00 -1.51 0.00 0.00 72.50 69.08 3kpb s THR 450 CO 0.56 -0.40 1.91 0.40 -2.21 0.00 0.00 174.62 174.88 3kpb h ILE 451 N 2.30 0.98 -0.68 5.08 1.08 -1.27 -2.08 117.51 122.92 3kpb h ILE 451 Ca -0.40 -0.29 0.16 0.00 -0.39 0.00 0.00 64.86 63.95 3kpb h ILE 451 Cb 1.24 0.07 -0.04 0.00 -3.07 0.00 0.00 36.82 35.03 3kpb h ILE 451 CO 0.64 0.15 0.47 -0.08 -0.69 0.00 0.00 178.15 178.64 3kpb h GLU 452 N 0.84 0.20 0.00 2.37 4.81 -1.45 -0.37 114.58 120.97 3kpb h GLU 452 Ca 0.38 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 3kpb h GLU 452 Cb 0.38 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3kpb h GLU 452 CO -0.15 0.13 0.00 0.93 -0.73 0.00 0.00 179.01 179.19 3kpb h GLU 453 N 0.20 0.00 0.00 1.92 5.08 -1.67 -3.33 114.58 116.78 3kpb h GLU 453 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3kpb h GLU 453 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 3kpb h GLU 453 CO -0.06 0.00 -0.79 1.51 -1.00 0.00 0.00 179.01 178.67 3kpb n ILE 454 N -2.98 0.00 -1.82 3.13 0.13 -0.48 -5.08 119.36 112.26 3kpb n ILE 454 Ca 0.02 -0.08 -0.38 0.00 -1.10 0.00 0.00 62.75 61.21 3kpb n ILE 454 Cb 0.34 0.56 0.04 0.00 -0.84 0.00 0.00 39.64 39.75 3kpb n ILE 454 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3kpb s MET 455 N -1.73 3.06 -0.12 9.51 0.23 -0.27 -4.95 119.30 125.03 3kpb s MET 455 Ca 0.00 2.15 -0.29 0.00 -1.03 0.00 0.00 55.69 56.52 3kpb s MET 455 Cb 0.00 -2.17 -0.01 0.00 -1.53 0.00 0.00 34.83 31.12 3kpb s MET 455 CO 0.00 -1.23 1.00 0.99 -2.03 0.00 0.00 175.02 173.75 3kpb s THR 456 N -1.35 4.79 -0.11 3.16 2.01 -0.72 -4.86 115.64 118.55 3kpb s THR 456 Ca 0.73 2.01 0.21 0.00 0.31 0.00 0.00 61.69 64.96 3kpb s THR 456 Cb -0.39 -4.30 -0.22 0.00 0.01 0.00 0.00 72.50 67.60 3kpb s THR 456 CO 0.44 -0.00 0.61 0.54 -0.69 0.00 0.00 174.62 175.52 3kpb n ARG 457 N 5.09 0.65 -2.80 4.92 1.74 -1.26 -1.21 116.66 123.79 3kpb n ARG 457 Ca 0.09 -0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.69 3kpb n ARG 457 Cb 0.49 -1.63 -0.01 0.00 -1.02 0.00 0.00 32.46 30.28 3kpb n ARG 457 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3kpb s ASN 458 N -5.02 6.82 -0.27 0.55 6.03 -1.26 -4.76 114.94 117.03 3kpb s ASN 458 Ca -0.06 -2.39 -0.04 0.00 -1.03 0.00 0.00 52.86 49.34 3kpb s ASN 458 Cb 0.11 -2.47 0.02 0.00 -3.03 0.00 0.00 41.25 35.88 3kpb s ASN 458 CO 0.86 -1.04 0.01 -0.69 -2.03 0.00 0.00 177.10 174.21 3kpb s VAL 459 N 2.99 3.42 0.22 3.54 1.01 -1.26 -5.07 120.40 125.25 3kpb s VAL 459 Ca 0.43 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 3kpb s VAL 459 Cb -0.01 -2.75 -0.09 0.00 0.00 0.00 0.00 36.38 33.52 3kpb s VAL 459 CO -0.02 0.14 1.31 -0.63 0.00 0.00 0.00 175.10 175.90 3kpb s ILE 460 N 1.41 3.13 0.30 2.22 -1.09 -1.26 -5.04 121.20 120.87 3kpb s ILE 460 Ca 0.01 0.96 0.03 0.00 -2.23 0.00 0.00 60.65 59.42 3kpb s ILE 460 Cb -0.17 -3.61 -0.06 0.00 -1.58 0.00 0.00 42.46 37.04 3kpb s ILE 460 CO -0.01 0.15 0.07 0.42 -1.23 0.00 0.00 174.94 174.35 3kpb s THR 461 N -0.05 0.96 0.17 2.92 -4.23 -1.26 -4.14 115.64 110.02 3kpb s THR 461 Ca 0.56 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.14 3kpb s THR 461 Cb -0.37 -2.73 -0.04 0.00 1.34 0.00 0.00 72.50 70.69 3kpb s THR 461 CO 0.40 -0.01 -0.15 0.00 -0.54 0.00 0.00 174.62 174.33 3kpb s ALA 462 N -3.46 1.82 0.06 3.99 0.00 -0.39 -4.98 121.76 118.81 3kpb s ALA 462 Ca 0.37 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3kpb s ALA 462 Cb 0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 3kpb s ALA 462 CO 0.15 0.10 0.21 -1.58 0.00 0.00 0.00 175.76 174.64 3kpb s HIS 463 N -2.57 3.51 0.57 0.00 2.46 -1.26 -0.50 115.29 117.50 3kpb s HIS 463 Ca 0.17 0.24 0.29 0.00 0.47 0.00 0.00 55.06 56.23 3kpb s HIS 463 Cb -0.03 -1.75 1.47 0.00 -0.13 0.00 0.00 32.58 32.14 3kpb s HIS 463 CO 0.05 0.59 1.91 1.05 -2.47 0.00 0.00 174.74 175.87 3kpb h GLU 464 N 3.03 0.00 -0.43 2.88 4.11 -1.93 -1.35 114.58 120.88 3kpb h GLU 464 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3kpb h GLU 464 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3kpb h GLU 464 CO 0.75 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.58 3kpb n ASP 465 N -3.90 3.46 -4.76 3.06 10.43 -1.26 -1.16 116.55 122.41 3kpb n ASP 465 Ca 0.10 -1.99 -0.39 0.00 2.57 0.00 0.00 54.79 55.09 3kpb n ASP 465 Cb 0.71 -0.28 -0.05 0.00 1.84 0.00 0.00 41.12 43.34 3kpb n ASP 465 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 3kpb s GLU 466 N -1.44 4.65 0.36 -1.24 2.12 -0.51 -4.79 118.70 117.85 3kpb s GLU 466 Ca 0.40 1.55 -0.28 0.00 0.36 0.00 0.00 54.97 57.00 3kpb s GLU 466 Cb 0.23 -3.07 -0.11 0.00 0.26 0.00 0.00 34.13 31.44 3kpb s GLU 466 CO 0.32 0.30 1.49 -2.14 -0.54 0.00 0.00 175.26 174.69 3kpb s PRO 467 N -1.60 4.13 0.30 4.30 0.02 -1.26 -0.57 135.00 140.32 3kpb s PRO 467 Ca 0.46 2.54 0.05 0.00 0.02 0.00 0.00 61.00 64.08 3kpb s PRO 467 Cb -0.26 -2.99 0.71 0.00 0.02 0.00 0.00 34.50 31.99 3kpb s PRO 467 CO 0.33 -0.53 1.78 0.28 -0.33 0.00 0.00 177.00 178.53 3kpb h VAL 468 N 3.06 0.73 -0.12 3.83 2.07 -1.26 -1.18 116.25 123.38 3kpb h VAL 468 Ca -0.50 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 3kpb h VAL 468 Cb 1.23 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 3kpb h VAL 468 CO 0.67 0.14 -0.02 0.44 0.02 0.00 0.00 177.57 178.82 3kpb h ASP 469 N 0.79 0.15 0.36 0.57 3.32 -1.91 -1.55 116.42 118.15 3kpb h ASP 469 Ca 0.57 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.50 3kpb h ASP 469 Cb 0.85 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3kpb h ASP 469 CO -0.37 0.21 -0.46 0.45 -1.72 0.00 0.00 179.24 177.34 3kpb h HIS 470 N 0.16 0.16 -0.40 4.55 3.86 -1.58 -1.40 115.15 120.49 3kpb h HIS 470 Ca 0.04 -0.05 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 3kpb h HIS 470 Cb 0.16 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 3kpb h HIS 470 CO 0.00 0.57 -0.10 0.28 0.86 0.00 0.00 177.93 179.54 3kpb h VAL 471 N 0.11 1.28 -0.88 2.45 2.07 -1.16 -1.87 116.25 118.24 3kpb h VAL 471 Ca 0.01 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 3kpb h VAL 471 Cb 0.86 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 3kpb h VAL 471 CO 0.07 0.40 0.48 0.00 0.02 0.00 0.00 177.57 178.54 3kpb h ALA 472 N 0.84 1.13 -0.59 1.67 0.00 -1.09 -1.66 119.26 119.56 3kpb h ALA 472 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3kpb h ALA 472 Cb 0.63 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3kpb h ALA 472 CO 0.04 0.63 0.32 0.82 0.00 0.00 0.00 179.25 181.06 3kpb h ILE 473 N 1.23 1.20 -0.76 0.00 2.04 -1.16 -2.48 117.51 117.57 3kpb h ILE 473 Ca 0.31 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.67 3kpb h ILE 473 Cb 0.03 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.52 3kpb h ILE 473 CO -0.05 0.21 0.50 0.11 0.00 0.00 0.00 178.15 178.93 3kpb h LYS 474 N 0.80 1.00 -0.77 2.37 1.57 -0.97 -0.63 116.57 119.94 3kpb h LYS 474 Ca 0.21 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3kpb h LYS 474 Cb 0.06 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 3kpb h LYS 474 CO -0.03 0.66 0.50 0.52 -0.57 0.00 0.00 179.45 180.53 3kpb h MET 475 N 1.03 1.01 -0.27 3.15 2.86 -0.97 -0.81 114.93 120.93 3kpb h MET 475 Ca 0.28 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.73 3kpb h MET 475 Cb -0.12 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.31 3kpb h MET 475 CO -0.06 0.68 -0.31 0.77 1.06 0.00 0.00 176.91 179.04 3kpb h SER 476 N 1.04 0.74 -0.63 1.22 0.02 -1.24 -0.99 113.55 113.72 3kpb h SER 476 Ca 0.28 -0.49 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 3kpb h SER 476 Cb -0.11 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.19 3kpb h SER 476 CO -0.06 1.08 0.31 0.50 -1.14 0.00 0.00 176.83 177.51 3kpb h LYS 477 N 0.42 0.90 -0.19 3.45 3.64 -0.78 -3.03 116.57 120.99 3kpb h LYS 477 Ca 0.04 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3kpb h LYS 477 Cb 0.89 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 3kpb h LYS 477 CO 0.07 0.72 0.00 0.66 -2.27 0.00 0.00 179.45 178.63 3kpb n TYR 478 N -4.50 0.23 -3.61 1.91 4.01 -0.34 -5.00 117.16 109.86 3kpb n TYR 478 Ca 0.04 -0.14 -0.24 0.00 -0.16 0.00 0.00 57.90 57.40 3kpb n TYR 478 Cb 0.12 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.19 3kpb n TYR 478 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3kpb n ASN 479 N 1.20 -3.94 -4.33 7.72 5.15 -0.53 -5.02 115.26 115.51 3kpb n ASN 479 Ca 0.14 -0.88 -0.18 0.00 -0.60 0.00 0.00 54.58 53.06 3kpb n ASN 479 Cb 0.53 -3.99 -0.10 0.00 -0.53 0.00 0.00 39.78 35.69 3kpb n ASN 479 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3kpb s ILE 480 N -3.54 1.62 -0.13 -1.44 -4.36 -0.49 -5.05 121.20 107.82 3kpb s ILE 480 Ca 0.29 -2.18 0.01 0.00 -0.26 0.00 0.00 60.65 58.51 3kpb s ILE 480 Cb -0.08 -2.01 0.01 0.00 1.25 0.00 0.00 42.46 41.63 3kpb s ILE 480 CO 0.82 -0.63 0.44 -1.54 0.24 0.00 0.00 174.94 174.27 3kpb n SER 481 N -0.34 0.89 -3.72 4.36 3.41 -1.26 -4.66 113.62 112.30 3kpb n SER 481 Ca -0.08 -0.95 -0.12 0.00 -0.26 0.00 0.00 58.87 57.46 3kpb n SER 481 Cb 0.60 0.20 -0.13 0.00 -0.26 0.00 0.00 64.21 64.63 3kpb n SER 481 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3kpb s GLY 482 N -0.30 -0.19 -0.26 5.00 0.00 -1.26 -0.61 107.32 109.71 3kpb s GLY 482 Ca 0.01 1.13 0.00 0.00 0.00 0.00 0.00 44.72 45.86 3kpb s GLY 482 CO 0.02 1.38 0.01 0.14 0.00 0.00 0.00 173.10 174.65 3kpb s VAL 483 N 1.33 1.36 0.47 1.40 1.01 0.29 -4.96 120.40 121.29 3kpb s VAL 483 Ca -0.09 -1.33 -0.25 0.00 0.00 0.00 0.00 61.98 60.31 3kpb s VAL 483 Cb -0.10 -1.79 -0.08 0.00 0.00 0.00 0.00 36.38 34.41 3kpb s VAL 483 CO -0.10 -0.31 1.42 -2.65 0.00 0.00 0.00 175.10 173.46 3kpb n PRO 484 N 4.70 2.15 -3.79 2.72 -0.02 -1.26 -1.68 135.00 137.82 3kpb n PRO 484 Ca -0.07 0.77 -0.35 0.00 -2.02 0.00 0.00 63.50 61.83 3kpb n PRO 484 Cb 0.44 -2.62 -0.09 0.00 -0.02 0.00 0.00 33.50 31.21 3kpb n PRO 484 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3kpb s VAL 485 N -1.21 5.24 0.23 -1.45 1.01 0.26 -1.26 120.40 123.23 3kpb s VAL 485 Ca 0.63 0.13 0.11 0.00 0.00 0.00 0.00 61.98 62.85 3kpb s VAL 485 Cb -0.44 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 3kpb s VAL 485 CO 0.56 0.43 -0.21 0.68 0.00 0.00 0.00 175.10 176.57 3kpb s VAL 486 N 0.45 2.28 0.03 2.92 -7.23 0.35 -0.56 120.40 118.64 3kpb s VAL 486 Ca 0.07 -2.20 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 3kpb s VAL 486 Cb -0.12 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.67 3kpb s VAL 486 CO -0.01 -0.32 0.04 -0.90 -0.31 0.00 0.00 175.10 173.61 3kpb n ASP 487 N -0.19 0.28 0.24 4.85 5.68 -0.58 -3.67 116.55 123.16 3kpb n ASP 487 Ca -0.09 -1.09 0.16 0.00 -0.50 0.00 0.00 54.79 53.28 3kpb n ASP 487 Cb 0.58 -0.02 0.77 0.00 -1.14 0.00 0.00 41.12 41.32 3kpb n ASP 487 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3kpb h ASP 488 N 0.01 0.00 -0.69 -1.12 3.32 -2.01 -1.06 116.42 114.87 3kpb h ASP 488 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3kpb h ASP 488 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3kpb h ASP 488 CO 0.02 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.32 3kpb n TYR 489 N -2.71 0.99 -1.74 4.55 4.01 -1.26 -4.94 117.16 116.07 3kpb n TYR 489 Ca -0.01 -0.48 -0.17 0.00 -0.16 0.00 0.00 57.90 57.08 3kpb n TYR 489 Cb 0.16 -0.03 -0.06 0.00 -0.31 0.00 0.00 39.34 39.11 3kpb n TYR 489 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3kpb n ARG 490 N 1.49 -1.25 -2.38 -0.72 1.74 -0.40 -4.75 116.66 110.38 3kpb n ARG 490 Ca 0.23 1.03 -0.32 0.00 -0.77 0.00 0.00 57.85 58.02 3kpb n ARG 490 Cb 0.62 -5.33 -0.03 0.00 -1.02 0.00 0.00 32.46 26.70 3kpb n ARG 490 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3kpb s ARG 491 N -3.86 3.85 -0.24 5.56 0.52 -1.26 -1.02 118.95 122.50 3kpb s ARG 491 Ca 0.00 1.04 -0.21 0.00 -0.52 0.00 0.00 55.73 56.04 3kpb s ARG 491 Cb 0.00 -2.12 -0.02 0.00 0.52 0.00 0.00 34.95 33.33 3kpb s ARG 491 CO 0.00 -0.36 0.64 0.08 0.02 0.00 0.00 175.30 175.69 3kpb s VAL 492 N -2.51 4.98 -0.99 3.52 1.01 -1.26 -1.52 120.40 123.63 3kpb s VAL 492 Ca 0.61 1.17 0.16 0.00 0.00 0.00 0.00 61.98 63.92 3kpb s VAL 492 Cb -0.11 -3.95 -0.12 0.00 0.00 0.00 0.00 36.38 32.20 3kpb s VAL 492 CO 0.30 0.04 0.73 1.33 0.00 0.00 0.00 175.10 177.50 3kpb n VAL 493 N 5.08 0.00 -2.70 2.92 0.24 0.27 -4.78 118.33 119.36 3kpb n VAL 493 Ca -0.00 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3kpb n VAL 493 Cb 0.49 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 33.92 3kpb n VAL 493 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kpb n GLY 494 N 1.30 -1.37 3.17 7.63 0.00 -1.20 -3.99 105.19 110.73 3kpb n GLY 494 Ca 0.04 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 3kpb n GLY 494 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kpb s ILE 495 N -2.81 0.03 -0.16 -0.61 2.07 -1.26 -0.58 121.20 117.88 3kpb s ILE 495 Ca 0.00 -0.23 -0.02 0.00 -1.41 0.00 0.00 60.65 58.98 3kpb s ILE 495 Cb 0.00 -0.45 -0.02 0.00 0.13 0.00 0.00 42.46 42.12 3kpb s ILE 495 CO 0.00 -0.13 -0.08 -0.69 -1.91 0.00 0.00 174.94 172.13 3kpb s VAL 496 N -0.48 3.40 0.40 4.00 1.01 -0.68 -4.93 120.40 123.12 3kpb s VAL 496 Ca -0.06 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 61.47 3kpb s VAL 496 Cb -0.04 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 3kpb s VAL 496 CO 0.02 0.49 0.30 0.42 0.00 0.00 0.00 175.10 176.32 3kpb s THR 497 N 0.60 2.67 0.25 3.92 -4.23 -1.26 -0.55 115.64 117.04 3kpb s THR 497 Ca -0.05 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 58.96 3kpb s THR 497 Cb -0.15 -3.01 0.23 0.00 1.34 0.00 0.00 72.50 70.91 3kpb s THR 497 CO 0.03 -0.03 1.82 0.28 -0.54 0.00 0.00 174.62 176.18 3kpb h SER 498 N 1.20 0.76 0.04 3.99 0.02 -1.20 -2.07 113.55 116.29 3kpb h SER 498 Ca -0.42 0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.46 3kpb h SER 498 Cb 1.26 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 3kpb h SER 498 CO 0.61 0.44 -0.35 -0.33 -1.14 0.00 0.00 176.83 176.06 3kpb h GLU 499 N 0.87 0.42 -0.41 3.45 4.39 -1.96 -0.19 114.58 121.16 3kpb h GLU 499 Ca 0.42 -0.19 0.01 0.00 0.34 0.00 0.00 59.36 59.93 3kpb h GLU 499 Cb 0.36 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 3kpb h GLU 499 CO -0.24 0.72 0.27 -0.44 -1.16 0.00 0.00 179.01 178.16 3kpb h ASP 500 N 0.36 0.46 -0.28 1.42 3.32 -1.83 0.07 116.42 119.94 3kpb h ASP 500 Ca 0.04 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3kpb h ASP 500 Cb 0.78 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 3kpb h ASP 500 CO 0.06 0.33 0.07 0.40 -1.72 0.00 0.00 179.24 178.38 3kpb h ILE 501 N 0.54 1.21 -0.46 0.35 1.08 -0.93 -2.58 117.51 116.73 3kpb h ILE 501 Ca 0.15 -0.71 -0.07 0.00 -0.39 0.00 0.00 64.86 63.85 3kpb h ILE 501 Cb -0.06 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.81 3kpb h ILE 501 CO -0.04 0.23 0.01 0.77 -0.69 0.00 0.00 178.15 178.44 3kpb h SER 502 N 0.29 0.71 -0.52 1.72 4.64 -0.89 0.21 113.55 119.71 3kpb h SER 502 Ca 0.09 -0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.20 3kpb h SER 502 Cb 0.28 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 3kpb h SER 502 CO 0.00 0.77 0.14 -0.09 -0.87 0.00 0.00 176.83 176.79 3kpb h ARG 503 N 0.70 0.88 0.20 4.77 2.43 -0.88 0.19 114.38 122.66 3kpb h ARG 503 Ca 0.14 -0.18 -0.29 0.00 -0.81 0.00 0.00 59.98 58.84 3kpb h ARG 503 Cb 0.42 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3kpb h ARG 503 CO 0.02 0.78 -1.32 -0.07 -1.51 0.00 0.00 179.97 177.86 3kpb h LEU 504 N 0.84 0.65 -1.39 3.80 3.38 -1.09 -3.42 115.31 118.08 3kpb h LEU 504 Ca 0.19 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.23 3kpb h LEU 504 Cb 0.30 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3kpb h LEU 504 CO -0.00 1.62 0.00 0.49 0.09 0.00 0.00 178.44 180.64 3kpb n PHE 505 N -3.85 0.00 1.18 1.13 3.72 0.70 -5.11 117.46 115.24 3kpb n PHE 505 Ca -0.18 -0.15 0.09 0.00 -0.05 0.00 0.00 57.45 57.16 3kpb n PHE 505 Cb 0.99 -0.01 0.56 0.00 -0.94 0.00 0.00 39.48 40.08 3kpb n PHE 505 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12