#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 3.82 0.23 3.22 1.43 -1.26 -1.47 118.68 124.64 3kpb s LEU 389 Ca 0.00 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 3kpb s LEU 389 Cb 0.00 -2.56 0.36 0.00 0.03 0.00 0.00 46.19 44.02 3kpb s LEU 389 CO 0.00 -0.44 1.77 0.58 0.23 0.00 0.00 176.35 178.48 3kpb h VAL 390 N 0.98 0.80 -0.33 -1.59 2.07 -0.76 -0.13 116.25 117.30 3kpb h VAL 390 Ca -0.45 -0.19 0.09 0.00 0.82 0.00 0.00 66.70 66.98 3kpb h VAL 390 Cb 1.26 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3kpb h VAL 390 CO 0.54 0.10 0.29 0.07 0.02 0.00 0.00 177.57 178.59 3kpb h LYS 391 N 0.56 0.00 0.00 1.57 2.10 -1.37 -1.97 116.57 117.46 3kpb h LYS 391 Ca 0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.01 3kpb h LYS 391 Cb 0.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 3kpb h LYS 391 CO -0.30 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 176.71 3kpb h ASP 392 N 0.00 0.00 -0.02 7.07 3.32 -1.29 -2.82 116.42 122.68 3kpb h ASP 392 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3kpb h ASP 392 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3kpb h ASP 392 CO -0.00 0.00 -0.04 2.30 -1.72 0.00 0.00 179.24 179.78 3kpb n ILE 393 N -2.89 0.00 -2.85 0.35 -5.35 -0.74 -4.97 119.36 102.90 3kpb n ILE 393 Ca 0.01 -0.48 -0.38 0.00 -0.27 0.00 0.00 62.75 61.63 3kpb n ILE 393 Cb 0.30 1.39 -0.06 0.00 -1.74 0.00 0.00 39.64 39.54 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 -1.72 4.47 0.00 7.28 1.43 -1.06 -4.96 118.68 124.11 3kpb s LEU 394 Ca 0.22 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 55.10 3kpb s LEU 394 Cb 0.16 -3.73 0.00 0.00 0.03 0.00 0.00 46.19 42.66 3kpb s LEU 394 CO 0.27 0.05 0.04 -1.54 0.23 0.00 0.00 176.35 175.40 3kpb n SER 395 N 1.00 0.07 -3.68 2.29 3.41 -1.26 -5.05 113.62 110.40 3kpb n SER 395 Ca -0.01 -0.57 -0.12 0.00 -0.26 0.00 0.00 58.87 57.91 3kpb n SER 395 Cb 0.49 0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.06 0.91 0.49 4.33 -2.85 -1.26 -5.15 119.74 116.15 3kpb s LYS 396 Ca 0.00 -0.43 -0.23 0.00 -1.00 0.00 0.00 55.97 54.31 3kpb s LYS 396 Cb 0.00 0.40 -0.07 0.00 -2.06 0.00 0.00 37.83 36.11 3kpb s LYS 396 CO 0.00 -0.31 1.24 -1.25 0.10 0.00 0.00 175.35 175.12 3kpb s PRO 397 N -2.63 3.55 0.46 1.78 0.04 -1.26 -4.85 135.00 132.10 3kpb s PRO 397 Ca -0.04 1.94 -0.18 0.00 0.04 0.00 0.00 61.00 62.76 3kpb s PRO 397 Cb -0.00 -2.37 -0.09 0.00 0.04 0.00 0.00 34.50 32.08 3kpb s PRO 397 CO -0.04 -0.77 0.94 -1.25 0.04 0.00 0.00 177.00 175.93 3kpb s PRO 398 N -2.75 4.06 -0.03 0.56 0.04 -1.26 -5.00 135.00 130.61 3kpb s PRO 398 Ca 0.66 0.98 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 3kpb s PRO 398 Cb -0.33 -2.18 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 3kpb s PRO 398 CO 0.40 -0.13 0.96 0.42 0.04 0.00 0.00 177.00 178.69 3kpb s ILE 399 N -2.39 4.86 0.24 0.56 1.01 -1.26 -5.01 121.20 119.21 3kpb s ILE 399 Ca 0.60 2.00 0.01 0.00 0.00 0.00 0.00 60.65 63.26 3kpb s ILE 399 Cb -0.10 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 38.03 3kpb s ILE 399 CO 0.23 0.13 0.08 0.42 0.00 0.00 0.00 174.94 175.79 3kpb s THR 400 N 1.24 0.56 0.17 2.92 -4.23 -1.26 -4.16 115.64 110.88 3kpb s THR 400 Ca 0.50 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.91 3kpb s THR 400 Cb -0.20 -2.53 -0.00 0.00 1.34 0.00 0.00 72.50 71.10 3kpb s THR 400 CO 0.25 -0.09 0.31 0.00 -0.54 0.00 0.00 174.62 174.54 3kpb s ALA 401 N -3.75 -0.10 0.31 3.99 0.00 -0.89 -5.01 121.76 116.31 3kpb s ALA 401 Ca 0.35 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 3kpb s ALA 401 Cb 0.07 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 24.01 3kpb s ALA 401 CO 0.12 -0.67 0.54 -1.01 0.00 0.00 0.00 175.76 174.74 3kpb s HIS 402 N -3.96 3.49 -0.71 0.00 3.76 -1.26 -0.67 115.29 115.94 3kpb s HIS 402 Ca 0.16 0.48 0.25 0.00 -0.15 0.00 0.00 55.06 55.80 3kpb s HIS 402 Cb 0.03 -1.98 0.90 0.00 1.11 0.00 0.00 32.58 32.64 3kpb s HIS 402 CO -0.00 0.16 1.76 -1.13 -0.85 0.00 0.00 174.74 174.68 3kpb n SER 403 N -1.31 0.63 -0.03 1.40 3.41 -1.26 -3.38 113.62 113.08 3kpb n SER 403 Ca -0.03 0.59 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 3kpb n SER 403 Cb 0.55 -0.75 0.68 0.00 -0.26 0.00 0.00 64.21 64.44 3kpb n SER 403 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3kpb n ASN 404 N -2.12 0.14 -4.79 4.04 2.04 -1.26 -1.11 115.26 112.19 3kpb n ASN 404 Ca 0.05 -0.17 -0.33 0.00 -0.44 0.00 0.00 54.58 53.68 3kpb n ASN 404 Cb 0.35 -0.24 0.01 0.00 -2.53 0.00 0.00 39.78 37.38 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 -2.62 3.59 0.80 1.53 -4.36 -1.22 -4.80 121.20 114.12 3kpb s ILE 405 Ca 0.26 0.80 -0.11 0.00 -0.26 0.00 0.00 60.65 61.34 3kpb s ILE 405 Cb 0.20 -3.31 0.07 0.00 1.25 0.00 0.00 42.46 40.67 3kpb s ILE 405 CO 0.48 -0.40 1.09 -0.94 0.24 0.00 0.00 174.94 175.41 3kpb s SER 406 N -2.52 4.37 0.38 4.36 1.04 -1.26 -1.94 113.70 118.12 3kpb s SER 406 Ca 0.66 1.60 0.12 0.00 0.48 0.00 0.00 55.95 58.81 3kpb s SER 406 Cb -0.18 -2.33 0.75 0.00 0.10 0.00 0.00 66.02 64.36 3kpb s SER 406 CO 0.35 -2.09 1.85 0.16 0.98 0.00 0.00 173.24 174.49 3kpb h ILE 407 N -1.17 1.24 -0.12 -1.02 3.07 -1.79 -2.31 117.51 115.43 3kpb h ILE 407 Ca -0.46 -1.16 0.02 0.00 1.55 0.00 0.00 64.86 64.81 3kpb h ILE 407 Cb 1.25 1.60 -0.02 0.00 -0.27 0.00 0.00 36.82 39.38 3kpb h ILE 407 CO 0.55 0.33 0.01 -0.03 -1.05 0.00 0.00 178.15 177.96 3kpb h MET 408 N 0.03 0.05 -0.90 0.16 4.05 -1.92 -0.81 114.93 115.59 3kpb h MET 408 Ca 0.00 -0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 3kpb h MET 408 Cb 0.60 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.34 3kpb h MET 408 CO 0.04 0.03 0.55 0.93 0.23 0.00 0.00 176.91 178.69 3kpb h GLU 409 N 0.05 1.22 -0.48 0.39 5.08 -1.87 -1.46 114.58 117.52 3kpb h GLU 409 Ca 0.05 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 3kpb h GLU 409 Cb 0.06 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 3kpb h GLU 409 CO -0.08 0.86 0.15 0.00 -1.00 0.00 0.00 179.01 178.93 3kpb h ALA 410 N 1.30 0.63 -0.63 3.43 0.00 -1.26 -2.19 119.26 120.54 3kpb h ALA 410 Ca 0.32 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.08 3kpb h ALA 410 Cb -0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 3kpb h ALA 410 CO -0.06 0.29 0.38 0.00 0.00 0.00 0.00 179.25 179.86 3kpb h ALA 411 N 1.01 0.82 -0.94 0.00 0.00 -0.82 -2.17 119.26 117.15 3kpb h ALA 411 Ca 0.16 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.08 3kpb h ALA 411 Cb 0.27 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 3kpb h ALA 411 CO -0.00 0.12 0.62 0.87 0.00 0.00 0.00 179.25 180.85 3kpb h LYS 412 N 0.75 1.17 -0.16 0.00 1.57 -1.11 -1.89 116.57 116.91 3kpb h LYS 412 Ca 0.26 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3kpb h LYS 412 Cb 0.04 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 3kpb h LYS 412 CO -0.11 0.78 0.08 0.82 -0.57 0.00 0.00 179.45 180.44 3kpb h ILE 413 N 1.21 1.12 -0.35 1.86 2.04 -0.86 -0.31 117.51 122.22 3kpb h ILE 413 Ca 0.37 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.93 3kpb h ILE 413 Cb -0.03 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 3kpb h ILE 413 CO -0.10 0.11 0.07 -0.07 0.00 0.00 0.00 178.15 178.16 3kpb h LEU 414 N 0.13 0.01 -0.20 1.44 3.38 -1.03 -2.25 115.31 116.80 3kpb h LEU 414 Ca 0.05 0.06 -0.22 0.00 0.09 0.00 0.00 57.88 57.87 3kpb h LEU 414 Cb 0.11 0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.94 3kpb h LEU 414 CO -0.01 0.04 -0.74 0.40 0.09 0.00 0.00 178.44 178.23 3kpb h ILE 415 N 0.19 1.28 -0.57 1.22 5.03 -1.27 -0.61 117.51 122.78 3kpb h ILE 415 Ca 0.17 -1.94 -0.01 0.00 -0.12 0.00 0.00 64.86 62.96 3kpb h ILE 415 Cb 0.19 1.92 -0.03 0.00 -3.03 0.00 0.00 36.82 35.87 3kpb h ILE 415 CO -0.22 0.62 0.31 0.50 -0.68 0.00 0.00 178.15 178.68 3kpb h LYS 416 N 0.56 0.80 -0.14 2.37 3.64 -0.95 -2.91 116.57 119.94 3kpb h LYS 416 Ca -0.04 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3kpb h LYS 416 Cb 1.36 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 3kpb h LYS 416 CO 0.15 0.61 0.00 0.72 -2.27 0.00 0.00 179.45 178.66 3kpb n HIS 417 N -4.60 0.15 -3.87 1.91 8.25 -0.85 -4.97 115.22 111.24 3kpb n HIS 417 Ca 0.03 -0.08 -0.24 0.00 -0.26 0.00 0.00 57.72 57.17 3kpb n HIS 417 Cb 0.09 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 0.97 -0.78 -4.25 0.41 4.05 -0.32 -5.00 115.26 110.34 3kpb n ASN 418 Ca 0.17 -0.96 -0.23 0.00 0.45 0.00 0.00 54.58 54.01 3kpb n ASN 418 Cb 0.51 -3.35 -0.13 0.00 1.23 0.00 0.00 39.78 38.04 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 -3.86 1.55 -0.69 -1.44 -4.36 -0.68 -5.05 121.20 106.67 3kpb s ILE 419 Ca 0.03 -1.43 0.08 0.00 -0.26 0.00 0.00 60.65 59.07 3kpb s ILE 419 Cb -0.01 -1.41 0.24 0.00 1.25 0.00 0.00 42.46 42.53 3kpb s ILE 419 CO 0.87 -0.07 1.20 -3.20 0.24 0.00 0.00 174.94 173.97 3kpb n ASN 420 N 1.24 2.73 -3.82 4.36 5.15 -1.26 -4.58 115.26 119.08 3kpb n ASN 420 Ca -0.20 -2.03 -0.23 0.00 -0.60 0.00 0.00 54.58 51.52 3kpb n ASN 420 Cb 0.54 -0.19 -0.17 0.00 -0.53 0.00 0.00 39.78 39.43 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 -1.06 0.87 -0.35 1.20 3.76 -1.26 -4.04 115.29 114.41 3kpb s HIS 421 Ca 0.18 -0.30 0.02 0.00 -0.15 0.00 0.00 55.06 54.81 3kpb s HIS 421 Cb 0.10 -0.88 0.11 0.00 1.11 0.00 0.00 32.58 33.01 3kpb s HIS 421 CO 0.12 -0.35 0.12 -1.17 -0.85 0.00 0.00 174.74 172.60 3kpb s LEU 422 N 1.76 3.27 0.30 0.89 2.96 0.20 -4.95 118.68 123.12 3kpb s LEU 422 Ca 0.03 -2.06 -0.30 0.00 -0.22 0.00 0.00 54.13 51.58 3kpb s LEU 422 Cb -0.13 -1.19 -0.11 0.00 0.50 0.00 0.00 46.19 45.26 3kpb s LEU 422 CO -0.05 -0.37 1.60 -2.84 -1.32 0.00 0.00 176.35 173.37 3kpb s PRO 423 N 1.05 4.11 -0.18 0.98 0.02 -1.26 -1.54 135.00 138.18 3kpb s PRO 423 Ca 0.12 2.60 -0.08 0.00 0.02 0.00 0.00 61.00 63.65 3kpb s PRO 423 Cb -0.20 -3.01 -0.04 0.00 0.02 0.00 0.00 34.50 31.27 3kpb s PRO 423 CO -0.14 -0.64 0.10 0.42 -0.33 0.00 0.00 177.00 176.41 3kpb s ILE 424 N -0.10 5.10 0.15 2.83 -1.09 0.09 -2.09 121.20 126.09 3kpb s ILE 424 Ca 0.63 0.08 0.05 0.00 -2.23 0.00 0.00 60.65 59.17 3kpb s ILE 424 Cb -0.48 -3.31 -0.04 0.00 -1.58 0.00 0.00 42.46 37.05 3kpb s ILE 424 CO 0.50 0.46 -0.11 0.68 -1.23 0.00 0.00 174.94 175.24 3kpb s VAL 425 N 0.26 1.21 0.14 2.92 -7.23 0.15 -0.50 120.40 117.35 3kpb s VAL 425 Ca 0.06 -2.04 -0.02 0.00 -1.81 0.00 0.00 61.98 58.17 3kpb s VAL 425 Cb -0.12 -1.83 0.03 0.00 0.56 0.00 0.00 36.38 35.02 3kpb s VAL 425 CO -0.01 -0.72 0.19 -0.90 -0.31 0.00 0.00 175.10 173.36 3kpb n ASP 426 N -0.15 0.09 0.00 4.85 5.68 -0.28 -4.24 116.55 122.50 3kpb n ASP 426 Ca -0.10 -1.11 0.10 0.00 -0.50 0.00 0.00 54.79 53.17 3kpb n ASP 426 Cb 0.60 -0.14 0.46 0.00 -1.14 0.00 0.00 41.12 40.91 3kpb n ASP 426 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3kpb n GLU 427 N -1.39 0.14 -0.05 0.11 0.00 -1.26 -1.36 120.64 116.82 3kpb n GLU 427 Ca 0.03 0.13 0.12 0.00 0.00 0.00 0.00 57.16 57.44 3kpb n GLU 427 Cb 0.09 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 30.32 3kpb n GLU 427 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3kpb n HIS 428 N -1.40 0.13 -1.06 -1.84 8.25 -1.26 -4.94 115.22 113.10 3kpb n HIS 428 Ca 0.07 -0.07 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 3kpb n HIS 428 Cb 0.20 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.30 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 1.30 0.55 3.78 -1.41 0.00 -0.47 -4.92 105.19 104.02 3kpb n GLY 429 Ca 0.17 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 3kpb n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kpb s LYS 430 N -1.38 4.45 0.05 1.61 1.02 -1.26 -1.68 119.74 122.55 3kpb s LYS 430 Ca 0.00 1.02 -0.30 0.00 0.02 0.00 0.00 55.97 56.71 3kpb s LYS 430 Cb 0.00 -3.27 -0.08 0.00 -0.52 0.00 0.00 37.83 33.97 3kpb s LYS 430 CO 0.00 0.56 1.64 -1.17 -0.92 0.00 0.00 175.35 175.45 3kpb s LEU 431 N -1.00 4.36 -0.00 3.17 2.96 -0.34 -1.12 118.68 126.70 3kpb s LEU 431 Ca 0.34 2.43 0.02 0.00 -0.22 0.00 0.00 54.13 56.70 3kpb s LEU 431 Cb -0.22 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 42.89 3kpb s LEU 431 CO 0.24 -0.88 0.07 1.33 -1.32 0.00 0.00 176.35 175.79 3kpb n VAL 432 N 4.82 0.00 -0.94 1.68 0.24 0.34 -4.92 118.33 119.55 3kpb n VAL 432 Ca 0.16 -0.34 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 3kpb n VAL 432 Cb 0.41 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.63 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 1.41 -1.26 2.96 7.63 0.00 -1.10 -4.63 105.19 110.20 3kpb n GLY 433 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.30 0.12 -0.05 -0.61 2.07 -0.38 -0.73 121.20 119.32 3kpb s ILE 434 Ca 0.00 -0.72 0.04 0.00 -1.41 0.00 0.00 60.65 58.56 3kpb s ILE 434 Cb 0.00 -0.24 -0.00 0.00 0.13 0.00 0.00 42.46 42.35 3kpb s ILE 434 CO 0.00 -0.38 -0.19 -0.63 -1.91 0.00 0.00 174.94 171.83 3kpb s ILE 435 N -1.13 1.60 0.44 2.00 -1.09 -0.59 -1.70 121.20 120.74 3kpb s ILE 435 Ca -0.12 -0.80 0.03 0.00 -2.23 0.00 0.00 60.65 57.53 3kpb s ILE 435 Cb -0.08 -1.38 -0.03 0.00 -1.58 0.00 0.00 42.46 39.40 3kpb s ILE 435 CO -0.01 0.46 0.05 0.42 -1.23 0.00 0.00 174.94 174.63 3kpb s THR 436 N 0.08 1.10 0.55 2.92 -4.23 -1.26 -0.63 115.64 114.18 3kpb s THR 436 Ca -0.06 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.68 3kpb s THR 436 Cb -0.13 -2.41 0.33 0.00 1.34 0.00 0.00 72.50 71.64 3kpb s THR 436 CO 0.03 0.00 2.13 0.77 -0.54 0.00 0.00 174.62 177.01 3kpb h SER 437 N 1.63 0.00 -0.59 3.99 4.64 -1.93 -1.25 113.55 120.05 3kpb h SER 437 Ca -0.41 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 60.97 3kpb h SER 437 Cb 1.28 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.32 3kpb h SER 437 CO 0.69 0.00 0.30 -0.25 -0.87 0.00 0.00 176.83 176.70 3kpb h TRP 438 N 0.00 0.55 -0.05 4.77 2.91 -1.95 -1.69 115.95 120.48 3kpb h TRP 438 Ca 0.07 0.02 -0.08 0.00 1.13 0.00 0.00 58.89 60.03 3kpb h TRP 438 Cb 0.30 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 3kpb h TRP 438 CO 0.00 0.25 -0.36 -0.44 -1.03 0.00 0.00 178.44 176.86 3kpb h ASP 439 N 0.56 0.11 -0.32 2.65 3.32 -1.60 0.01 116.42 121.14 3kpb h ASP 439 Ca 0.27 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 3kpb h ASP 439 Cb 0.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3kpb h ASP 439 CO -0.19 0.46 0.11 0.40 -1.72 0.00 0.00 179.24 178.31 3kpb h ILE 440 N 0.09 1.20 -0.79 0.35 1.08 -1.25 0.56 117.51 118.75 3kpb h ILE 440 Ca 0.01 -0.62 -0.03 0.00 -0.39 0.00 0.00 64.86 63.84 3kpb h ILE 440 Cb 0.68 1.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.39 3kpb h ILE 440 CO 0.05 0.21 0.39 0.00 -0.69 0.00 0.00 178.15 178.12 3kpb h ALA 441 N 0.95 1.02 -0.47 1.87 0.00 -0.92 -1.44 119.26 120.27 3kpb h ALA 441 Ca 0.11 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3kpb h ALA 441 Cb 0.22 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3kpb h ALA 441 CO -0.01 0.57 0.14 -0.22 0.00 0.00 0.00 179.25 179.73 3kpb h LYS 442 N 1.12 0.74 -0.73 0.00 3.64 -0.77 -0.55 116.57 120.01 3kpb h LYS 442 Ca 0.27 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3kpb h LYS 442 Cb 0.10 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 3kpb h LYS 442 CO -0.04 0.71 0.41 0.00 -2.27 0.00 0.00 179.45 178.27 3kpb h ALA 443 N 1.00 0.94 -0.35 5.00 0.00 -0.70 -1.75 119.26 123.39 3kpb h ALA 443 Ca 0.15 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3kpb h ALA 443 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3kpb h ALA 443 CO -0.00 0.44 -0.08 1.25 0.00 0.00 0.00 179.25 180.85 3kpb h LEU 444 N 1.01 0.68 -1.44 0.00 5.85 -1.04 0.30 115.31 120.68 3kpb h LEU 444 Ca 0.26 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.63 3kpb h LEU 444 Cb 0.01 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3kpb h LEU 444 CO -0.04 0.88 0.38 0.00 -0.34 0.00 0.00 178.44 179.32 3kpb h ALA 445 N 0.82 1.60 -0.41 1.25 0.00 -0.95 -2.54 119.26 119.02 3kpb h ALA 445 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kpb h ALA 445 Cb 0.59 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3kpb h ALA 445 CO 0.03 0.37 0.00 1.04 0.00 0.00 0.00 179.25 180.69 3kpb n GLN 446 N -4.45 2.48 -4.05 0.00 6.02 -0.67 -4.97 117.38 111.74 3kpb n GLN 446 Ca 0.06 -2.25 -0.28 0.00 -0.01 0.00 0.00 57.00 54.52 3kpb n GLN 446 Cb 0.06 -1.51 -0.03 0.00 1.02 0.00 0.00 30.24 29.77 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 1.44 -0.83 -4.88 1.08 5.15 -0.20 -4.99 115.26 112.02 3kpb n ASN 447 Ca 0.20 -1.03 -0.31 0.00 -0.60 0.00 0.00 54.58 52.83 3kpb n ASN 447 Cb 0.59 -2.85 -0.05 0.00 -0.53 0.00 0.00 39.78 36.95 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 -6.72 3.76 -0.18 1.20 -0.14 -0.08 -5.03 119.74 112.55 3kpb s LYS 448 Ca 0.16 0.22 0.10 0.00 -1.36 0.00 0.00 55.97 55.09 3kpb s LYS 448 Cb -0.09 -2.64 -0.18 0.00 -1.68 0.00 0.00 37.83 33.24 3kpb s LYS 448 CO 0.91 0.28 -0.03 1.63 -0.76 0.00 0.00 175.35 177.38 3kpb n LYS 449 N -0.36 1.02 -4.35 1.68 5.02 -1.26 -4.69 118.16 115.21 3kpb n LYS 449 Ca 0.00 0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 56.13 3kpb n LYS 449 Cb 0.53 -1.43 -0.10 0.00 -0.02 0.00 0.00 35.03 34.01 3kpb n LYS 449 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3kpb s THR 450 N -2.41 1.83 0.23 -0.18 -1.32 -1.26 -2.36 115.64 110.17 3kpb s THR 450 Ca -0.15 -2.13 -0.07 0.00 -1.21 0.00 0.00 61.69 58.13 3kpb s THR 450 Cb 0.06 -2.00 0.19 0.00 -1.51 0.00 0.00 72.50 69.24 3kpb s THR 450 CO 0.61 -0.49 1.82 0.40 -2.21 0.00 0.00 174.62 174.75 3kpb h ILE 451 N 2.76 0.97 -0.94 5.08 1.08 -1.38 -2.21 117.51 122.86 3kpb h ILE 451 Ca -0.39 -0.27 0.27 0.00 -0.39 0.00 0.00 64.86 64.07 3kpb h ILE 451 Cb 1.22 0.10 -0.14 0.00 -3.07 0.00 0.00 36.82 34.93 3kpb h ILE 451 CO 0.58 0.15 0.43 -0.33 -0.69 0.00 0.00 178.15 178.29 3kpb h GLU 452 N 0.80 0.31 0.00 2.37 4.39 -1.41 0.91 114.58 121.95 3kpb h GLU 452 Ca 0.35 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.02 3kpb h GLU 452 Cb 0.24 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3kpb h GLU 452 CO -0.20 0.20 -0.06 0.93 -1.16 0.00 0.00 179.01 178.73 3kpb h GLU 453 N 0.32 0.00 0.00 2.33 5.08 -1.70 -3.35 114.58 117.26 3kpb h GLU 453 Ca 0.64 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.00 3kpb h GLU 453 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 3kpb h GLU 453 CO -0.60 0.06 -0.66 1.51 -1.00 0.00 0.00 179.01 178.31 3kpb n ILE 454 N -3.15 0.00 -1.84 3.13 0.13 -0.46 -5.07 119.36 112.11 3kpb n ILE 454 Ca 0.02 -0.09 -0.39 0.00 -1.10 0.00 0.00 62.75 61.18 3kpb n ILE 454 Cb 0.41 0.55 0.02 0.00 -0.84 0.00 0.00 39.64 39.77 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 -1.51 3.64 -0.17 9.51 0.23 0.19 -4.94 119.30 126.25 3kpb s MET 455 Ca 0.00 2.35 -0.29 0.00 -1.03 0.00 0.00 55.69 56.71 3kpb s MET 455 Cb 0.00 -2.60 -0.02 0.00 -1.53 0.00 0.00 34.83 30.68 3kpb s MET 455 CO 0.00 -0.83 1.35 0.99 -2.03 0.00 0.00 175.02 174.50 3kpb s THR 456 N -1.23 4.12 -0.11 3.16 2.01 -0.69 -4.84 115.64 118.07 3kpb s THR 456 Ca 0.62 1.34 0.16 0.00 0.31 0.00 0.00 61.69 64.12 3kpb s THR 456 Cb -0.42 -3.92 -0.13 0.00 0.01 0.00 0.00 72.50 68.04 3kpb s THR 456 CO 0.54 -0.18 0.90 0.03 -0.69 0.00 0.00 174.62 175.22 3kpb h ARG 457 N 8.70 0.00 -4.63 4.92 3.08 -1.88 -0.99 114.38 123.58 3kpb h ARG 457 Ca -0.29 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.04 3kpb h ARG 457 Cb 1.12 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.96 3kpb h ARG 457 CO 0.98 0.37 0.55 -0.80 -1.07 0.00 0.00 179.97 180.00 3kpb s ASN 458 N -5.95 6.64 -0.18 7.04 0.01 -1.26 -4.71 114.94 116.53 3kpb s ASN 458 Ca -0.02 -2.20 -0.12 0.00 -0.71 0.00 0.00 52.86 49.81 3kpb s ASN 458 Cb 0.08 -2.33 -0.05 0.00 0.41 0.00 0.00 41.25 39.36 3kpb s ASN 458 CO 0.81 -0.91 0.21 -0.69 -1.51 0.00 0.00 177.10 175.00 3kpb s VAL 459 N 1.89 5.36 -0.21 1.60 1.01 -1.26 -5.05 120.40 123.74 3kpb s VAL 459 Ca 0.26 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.31 3kpb s VAL 459 Cb -0.08 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.76 3kpb s VAL 459 CO -0.08 0.42 1.10 -0.63 0.00 0.00 0.00 175.10 175.91 3kpb s ILE 460 N 0.35 4.58 0.35 2.22 1.01 -1.26 -5.03 121.20 123.42 3kpb s ILE 460 Ca 0.12 1.91 0.05 0.00 0.00 0.00 0.00 60.65 62.73 3kpb s ILE 460 Cb -0.12 -4.23 -0.07 0.00 0.01 0.00 0.00 42.46 38.05 3kpb s ILE 460 CO 0.01 -0.17 0.05 0.42 0.00 0.00 0.00 174.94 175.25 3kpb s THR 461 N 3.27 1.38 0.08 2.92 -4.23 -1.26 -4.16 115.64 113.64 3kpb s THR 461 Ca 0.47 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.05 3kpb s THR 461 Cb -0.17 -2.83 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 3kpb s THR 461 CO 0.08 0.00 -0.18 0.00 -0.54 0.00 0.00 174.62 173.98 3kpb s ALA 462 N -3.14 1.57 0.20 3.99 0.00 -0.53 -4.97 121.76 118.88 3kpb s ALA 462 Ca 0.36 -1.11 -0.18 0.00 0.00 0.00 0.00 51.96 51.03 3kpb s ALA 462 Cb 0.09 -0.22 -0.08 0.00 0.00 0.00 0.00 23.12 22.91 3kpb s ALA 462 CO 0.16 0.30 0.68 -1.58 0.00 0.00 0.00 175.76 175.32 3kpb s HIS 463 N -1.09 3.64 0.55 0.00 2.46 -1.26 -1.06 115.29 118.53 3kpb s HIS 463 Ca 0.04 1.31 0.23 0.00 0.47 0.00 0.00 55.06 57.12 3kpb s HIS 463 Cb -0.10 -2.56 1.52 0.00 -0.13 0.00 0.00 32.58 31.31 3kpb s HIS 463 CO 0.03 0.36 2.15 1.05 -2.47 0.00 0.00 174.74 175.87 3kpb h GLU 464 N 3.48 0.00 -0.27 2.88 4.11 -1.36 -0.97 114.58 122.45 3kpb h GLU 464 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3kpb h GLU 464 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3kpb h GLU 464 CO 0.65 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.48 3kpb n ASP 465 N -4.18 2.59 -4.78 3.06 8.00 -1.26 -1.03 116.55 118.94 3kpb n ASP 465 Ca -0.01 -1.87 -0.37 0.00 0.71 0.00 0.00 54.79 53.26 3kpb n ASP 465 Cb 0.19 -0.17 -0.04 0.00 -0.02 0.00 0.00 41.12 41.08 3kpb n ASP 465 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3kpb s GLU 466 N -1.65 4.24 0.15 -1.24 2.02 -0.37 -4.78 118.70 117.07 3kpb s GLU 466 Ca 0.35 1.57 -0.34 0.00 0.02 0.00 0.00 54.97 56.57 3kpb s GLU 466 Cb 0.20 -2.66 -0.15 0.00 0.10 0.00 0.00 34.13 31.62 3kpb s GLU 466 CO 0.29 -0.09 1.41 -2.30 0.02 0.00 0.00 175.26 174.59 3kpb n PRO 467 N 0.15 1.65 0.17 0.39 -0.02 -1.26 -0.53 135.00 135.54 3kpb n PRO 467 Ca 0.04 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.25 3kpb n PRO 467 Cb 0.49 -2.26 0.69 0.00 -0.02 0.00 0.00 33.50 32.39 3kpb n PRO 467 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3kpb h VAL 468 N 3.29 0.83 0.00 -1.45 3.04 -1.50 -1.87 116.25 118.59 3kpb h VAL 468 Ca -0.46 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 3kpb h VAL 468 Cb 1.30 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.47 3kpb h VAL 468 CO 0.80 0.00 0.00 0.44 -1.01 0.00 0.00 177.57 177.80 3kpb h ASP 469 N 0.00 0.00 0.89 3.17 3.32 -1.89 -2.52 116.42 119.39 3kpb h ASP 469 Ca 0.09 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 3kpb h ASP 469 Cb 0.39 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3kpb h ASP 469 CO -0.00 0.00 -0.23 0.45 -1.72 0.00 0.00 179.24 177.74 3kpb h HIS 470 N 0.00 0.00 0.03 4.55 3.86 -1.70 -3.16 115.15 118.73 3kpb h HIS 470 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3kpb h HIS 470 Cb 0.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.70 3kpb h HIS 470 CO 0.00 0.23 -0.01 0.28 0.86 0.00 0.00 177.93 179.28 3kpb h VAL 471 N 0.00 1.04 -0.89 2.45 2.07 -1.64 -1.94 116.25 117.35 3kpb h VAL 471 Ca -0.00 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3kpb h VAL 471 Cb 0.74 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3kpb h VAL 471 CO 0.03 0.06 0.47 0.00 0.02 0.00 0.00 177.57 178.14 3kpb h ALA 472 N 0.83 1.14 -0.46 1.67 0.00 -1.73 -1.07 119.26 119.65 3kpb h ALA 472 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3kpb h ALA 472 Cb 0.12 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3kpb h ALA 472 CO 0.01 0.67 0.27 0.82 0.00 0.00 0.00 179.25 181.01 3kpb h ILE 473 N 1.25 1.15 -0.47 0.00 2.04 -1.52 -0.21 117.51 119.75 3kpb h ILE 473 Ca 0.31 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3kpb h ILE 473 Cb 0.06 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 3kpb h ILE 473 CO -0.05 0.16 0.31 0.11 0.00 0.00 0.00 178.15 178.69 3kpb h LYS 474 N 0.61 0.62 -0.41 2.37 1.57 -0.88 0.13 116.57 120.58 3kpb h LYS 474 Ca 0.16 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.92 3kpb h LYS 474 Cb 0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3kpb h LYS 474 CO -0.03 0.41 0.25 0.52 -0.57 0.00 0.00 179.45 180.03 3kpb h MET 475 N 0.64 0.49 -0.22 3.15 2.86 -0.90 -1.56 114.93 119.39 3kpb h MET 475 Ca 0.17 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 3kpb h MET 475 Cb -0.07 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 3kpb h MET 475 CO -0.04 0.33 0.03 0.77 1.06 0.00 0.00 176.91 179.06 3kpb h SER 476 N 0.51 0.36 -0.74 1.22 0.02 -0.85 -1.92 113.55 112.15 3kpb h SER 476 Ca 0.16 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 3kpb h SER 476 Cb -0.01 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 3kpb h SER 476 CO -0.06 0.53 0.37 0.50 -1.14 0.00 0.00 176.83 177.02 3kpb h LYS 477 N 0.17 1.05 -0.17 3.45 3.64 -0.84 -3.25 116.57 120.63 3kpb h LYS 477 Ca 0.07 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3kpb h LYS 477 Cb 0.33 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3kpb h LYS 477 CO 0.00 0.81 0.00 0.66 -2.27 0.00 0.00 179.45 178.66 3kpb n TYR 478 N -4.42 0.21 -3.70 1.91 4.01 -0.60 -4.99 117.16 109.59 3kpb n TYR 478 Ca 0.06 -0.15 -0.22 0.00 -0.16 0.00 0.00 57.90 57.43 3kpb n TYR 478 Cb 0.12 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.18 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 0.94 -1.60 -4.40 7.72 5.15 -0.76 -5.01 115.26 117.30 3kpb n ASN 479 Ca 0.12 -0.84 -0.22 0.00 -0.60 0.00 0.00 54.58 53.03 3kpb n ASN 479 Cb 0.44 -4.00 -0.11 0.00 -0.53 0.00 0.00 39.78 35.59 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 -3.66 2.10 0.00 -1.44 -4.36 -0.95 -5.06 121.20 107.82 3kpb s ILE 480 Ca 0.05 -2.18 0.00 0.00 -0.26 0.00 0.00 60.65 58.27 3kpb s ILE 480 Cb -0.01 -2.09 0.00 0.00 1.25 0.00 0.00 42.46 41.60 3kpb s ILE 480 CO 0.82 -0.38 0.83 -1.54 0.24 0.00 0.00 174.94 174.90 3kpb n SER 481 N -0.19 1.57 -3.66 4.36 3.41 -1.26 -4.59 113.62 113.26 3kpb n SER 481 Ca -0.09 -1.68 -0.08 0.00 -0.26 0.00 0.00 58.87 56.76 3kpb n SER 481 Cb 0.59 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.45 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 -0.68 -0.52 -0.22 5.00 0.00 -1.26 -0.71 107.32 108.93 3kpb s GLY 482 Ca 0.00 2.09 0.00 0.00 0.00 0.00 0.00 44.72 46.81 3kpb s GLY 482 CO 0.00 2.13 -0.05 -1.34 0.00 0.00 0.00 173.10 173.84 3kpb s VAL 483 N 1.53 1.39 0.44 1.40 -7.23 0.57 -4.99 120.40 113.51 3kpb s VAL 483 Ca -0.10 -1.08 -0.26 0.00 -1.81 0.00 0.00 61.98 58.74 3kpb s VAL 483 Cb -0.06 -1.66 -0.09 0.00 0.56 0.00 0.00 36.38 35.13 3kpb s VAL 483 CO -0.17 -0.07 1.42 -2.84 -0.31 0.00 0.00 175.10 173.13 3kpb s PRO 484 N 1.47 3.76 -0.20 4.82 0.02 -1.26 -1.90 135.00 141.72 3kpb s PRO 484 Ca -0.04 2.40 -0.07 0.00 0.02 0.00 0.00 61.00 63.30 3kpb s PRO 484 Cb -0.18 -2.70 -0.04 0.00 0.02 0.00 0.00 34.50 31.60 3kpb s PRO 484 CO -0.07 -0.75 0.06 0.08 -0.33 0.00 0.00 177.00 176.00 3kpb s VAL 485 N -1.20 4.59 0.31 3.83 1.01 0.65 -1.45 120.40 128.13 3kpb s VAL 485 Ca 0.60 -0.10 0.11 0.00 0.00 0.00 0.00 61.98 62.58 3kpb s VAL 485 Cb -0.43 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 3kpb s VAL 485 CO 0.56 0.43 -0.12 0.68 0.00 0.00 0.00 175.10 176.64 3kpb s VAL 486 N 0.73 2.53 0.00 2.92 -7.23 -0.23 -0.59 120.40 118.53 3kpb s VAL 486 Ca 0.03 -2.24 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 3kpb s VAL 486 Cb -0.13 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.28 3kpb s VAL 486 CO 0.02 -0.31 0.00 -0.90 -0.31 0.00 0.00 175.10 173.60 3kpb n ASP 487 N -0.75 0.00 0.33 4.85 5.68 -0.90 -0.87 116.55 124.88 3kpb n ASP 487 Ca -0.05 -0.92 0.21 0.00 -0.50 0.00 0.00 54.79 53.53 3kpb n ASP 487 Cb 0.61 0.00 1.14 0.00 -1.14 0.00 0.00 41.12 41.74 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 0.00 0.00 -0.16 -1.12 3.32 -2.01 -2.92 116.42 113.53 3kpb h ASP 488 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 3kpb h ASP 488 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3kpb h ASP 488 CO 0.00 0.00 -0.24 -1.22 -1.72 0.00 0.00 179.24 176.06 3kpb n TYR 489 N -3.24 0.49 -0.94 4.55 4.01 -1.26 -4.97 117.16 115.79 3kpb n TYR 489 Ca -0.03 -1.44 0.00 0.00 -0.16 0.00 0.00 57.90 56.27 3kpb n TYR 489 Cb 0.08 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.77 3kpb n TYR 489 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 3kpb n ARG 490 N -1.12 -0.65 -2.23 -0.72 0.63 -1.10 -4.92 116.66 106.55 3kpb n ARG 490 Ca 0.24 0.16 -0.42 0.00 -0.92 0.00 0.00 57.85 56.92 3kpb n ARG 490 Cb 0.83 -3.75 -0.03 0.00 0.45 0.00 0.00 32.46 29.96 3kpb n ARG 490 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 3kpb s ARG 491 N -0.77 4.32 -0.29 -0.14 3.52 -1.26 -1.20 118.95 123.13 3kpb s ARG 491 Ca 0.00 1.98 -0.29 0.00 -0.13 0.00 0.00 55.73 57.29 3kpb s ARG 491 Cb 0.00 -3.41 -0.00 0.00 -1.56 0.00 0.00 34.95 29.98 3kpb s ARG 491 CO 0.00 -0.47 1.34 0.08 -0.81 0.00 0.00 175.30 175.44 3kpb s VAL 492 N 1.69 4.09 -0.52 7.11 1.01 -0.68 -2.13 120.40 130.97 3kpb s VAL 492 Ca 0.63 1.23 0.10 0.00 0.00 0.00 0.00 61.98 63.94 3kpb s VAL 492 Cb -0.33 -4.10 -0.11 0.00 0.00 0.00 0.00 36.38 31.84 3kpb s VAL 492 CO 0.28 -0.45 0.45 1.33 0.00 0.00 0.00 175.10 176.71 3kpb n VAL 493 N 6.23 0.00 -3.94 2.92 0.24 0.25 -4.92 118.33 119.11 3kpb n VAL 493 Ca 0.15 -0.26 0.03 0.00 -2.04 0.00 0.00 64.34 62.21 3kpb n VAL 493 Cb 0.46 1.01 0.01 0.00 -1.47 0.00 0.00 33.84 33.85 3kpb n VAL 493 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3kpb s GLY 494 N -1.95 -0.16 -0.02 7.63 0.00 -1.16 -4.52 107.32 107.13 3kpb s GLY 494 Ca 0.04 0.12 -0.03 0.00 0.00 0.00 0.00 44.72 44.85 3kpb s GLY 494 CO 0.42 4.98 0.08 -1.50 0.00 0.00 0.00 173.10 177.07 3kpb s ILE 495 N -2.06 0.01 -0.10 0.90 2.07 -1.26 -0.25 121.20 120.50 3kpb s ILE 495 Ca 0.28 -0.12 0.03 0.00 -1.41 0.00 0.00 60.65 59.43 3kpb s ILE 495 Cb 0.00 -0.15 -0.01 0.00 0.13 0.00 0.00 42.46 42.43 3kpb s ILE 495 CO -0.01 -0.06 -0.20 -0.69 -1.91 0.00 0.00 174.94 172.06 3kpb s VAL 496 N -0.17 2.41 0.38 4.00 1.01 -0.80 -4.95 120.40 122.29 3kpb s VAL 496 Ca -0.02 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.13 3kpb s VAL 496 Cb -0.02 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 3kpb s VAL 496 CO 0.00 0.55 0.20 0.42 0.00 0.00 0.00 175.10 176.27 3kpb s THR 497 N 0.21 2.74 0.37 3.92 -4.23 -1.26 -0.32 115.64 117.07 3kpb s THR 497 Ca -0.13 -1.62 0.05 0.00 -1.18 0.00 0.00 61.69 58.81 3kpb s THR 497 Cb -0.16 -2.99 0.24 0.00 1.34 0.00 0.00 72.50 70.92 3kpb s THR 497 CO 0.07 -0.09 2.00 0.77 -0.54 0.00 0.00 174.62 176.82 3kpb h SER 498 N 1.41 0.57 -0.43 3.99 4.64 -1.26 -1.67 113.55 120.79 3kpb h SER 498 Ca -0.43 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 60.79 3kpb h SER 498 Cb 1.25 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 3kpb h SER 498 CO 0.64 0.46 0.05 -0.33 -0.87 0.00 0.00 176.83 176.79 3kpb h GLU 499 N 0.65 0.80 -0.42 4.77 3.07 -1.96 0.47 114.58 121.95 3kpb h GLU 499 Ca 0.17 -0.19 -0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3kpb h GLU 499 Cb 0.02 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 3kpb h GLU 499 CO -0.03 0.77 0.25 -0.44 -1.40 0.00 0.00 179.01 178.17 3kpb h ASP 500 N 0.76 0.51 -0.48 1.42 3.32 -1.72 -0.50 116.42 119.73 3kpb h ASP 500 Ca 0.16 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 3kpb h ASP 500 Cb 0.38 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3kpb h ASP 500 CO 0.01 0.42 -0.05 0.40 -1.72 0.00 0.00 179.24 178.31 3kpb h ILE 501 N 0.56 1.27 -0.30 0.35 1.08 -1.18 -2.60 117.51 116.68 3kpb h ILE 501 Ca 0.15 -1.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 3kpb h ILE 501 Cb 0.01 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.78 3kpb h ILE 501 CO -0.03 0.40 0.20 0.28 -0.69 0.00 0.00 178.15 178.31 3kpb h SER 502 N 0.73 0.34 -0.91 1.72 0.02 -0.77 0.50 113.55 115.18 3kpb h SER 502 Ca 0.13 -0.01 0.11 0.00 -0.84 0.00 0.00 61.79 61.19 3kpb h SER 502 Cb 0.58 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.96 3kpb h SER 502 CO 0.03 0.25 0.59 -0.09 -1.14 0.00 0.00 176.83 176.46 3kpb h ARG 503 N 0.40 0.83 0.05 3.45 2.43 -1.01 -1.11 114.38 119.42 3kpb h ARG 503 Ca 0.11 -0.05 -0.30 0.00 -0.81 0.00 0.00 59.98 58.93 3kpb h ARG 503 Cb -0.04 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.29 3kpb h ARG 503 CO -0.03 0.55 -1.66 1.28 -1.51 0.00 0.00 179.97 178.60 3kpb n LEU 504 N -4.55 2.22 0.00 3.80 4.77 -0.92 -4.69 117.00 117.63 3kpb n LEU 504 Ca 0.16 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 3kpb n LEU 504 Cb 0.36 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 3kpb n LEU 504 CO 0.30 0.55 0.41 0.49 -1.33 0.00 0.00 177.39 177.81 3kpb n PHE 505 N -3.99 0.00 -0.86 -1.77 3.72 0.17 -5.10 117.46 109.62 3kpb n PHE 505 Ca -0.33 -0.34 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 3kpb n PHE 505 Cb 0.86 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.36 3kpb n PHE 505 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12