#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kpd s LEU 389 N 0.00 2.36 0.32 -4.42 1.02 -1.26 -2.22 118.68 114.49 3kpd s LEU 389 Ca 0.00 -0.74 0.10 0.00 0.02 0.00 0.00 54.13 53.51 3kpd s LEU 389 Cb 0.00 -0.54 0.96 0.00 0.02 0.00 0.00 46.19 46.63 3kpd s LEU 389 CO 0.00 -0.12 1.67 0.58 0.02 0.00 0.00 176.35 178.50 3kpd h VAL 390 N 3.79 0.34 -0.13 -1.59 2.07 -0.95 -0.99 116.25 118.78 3kpd h VAL 390 Ca -0.40 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 3kpd h VAL 390 Cb 1.19 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3kpd h VAL 390 CO 0.47 0.06 0.07 0.07 0.02 0.00 0.00 177.57 178.26 3kpd h LYS 391 N 0.33 0.17 -0.63 1.57 2.10 -1.55 -2.14 116.57 116.42 3kpd h LYS 391 Ca 0.67 -0.01 0.02 0.00 -2.00 0.00 0.00 60.65 59.33 3kpd h LYS 391 Cb 1.46 -0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 32.72 3kpd h LYS 391 CO -0.60 0.13 0.42 -0.44 -2.00 0.00 0.00 179.45 176.96 3kpd h ASP 392 N 0.18 0.69 0.00 7.07 3.45 -1.48 -3.24 116.42 123.09 3kpd h ASP 392 Ca 0.05 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.49 3kpd h ASP 392 Cb 0.01 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.62 3kpd h ASP 392 CO -0.01 0.49 -1.14 -0.38 -1.57 0.00 0.00 179.24 176.63 3kpd n ILE 393 N -4.45 0.00 -1.46 0.35 2.08 -1.04 -5.05 119.36 109.80 3kpd n ILE 393 Ca 0.07 -0.26 -0.51 0.00 0.56 0.00 0.00 62.75 62.61 3kpd n ILE 393 Cb 0.08 0.55 -0.05 0.00 -0.75 0.00 0.00 39.64 39.47 3kpd n ILE 393 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 3kpd n LEU 394 N -1.66 -0.35 -4.62 1.39 -0.00 -0.83 -4.91 117.00 106.03 3kpd n LEU 394 Ca -0.00 1.14 -0.43 0.00 -0.00 0.00 0.00 56.01 56.72 3kpd n LEU 394 Cb 0.27 -0.99 -0.02 0.00 -0.00 0.00 0.00 43.42 42.67 3kpd n LEU 394 CO 0.25 -2.35 1.15 -0.44 -0.00 0.00 0.00 177.39 176.00 3kpd s SER 395 N -0.53 6.56 0.06 1.96 0.01 -1.06 -4.97 113.70 115.74 3kpd s SER 395 Ca 0.73 0.98 -0.17 0.00 1.31 0.00 0.00 55.95 58.80 3kpd s SER 395 Cb -1.02 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 62.61 3kpd s SER 395 CO 0.56 -1.22 1.28 0.11 0.41 0.00 0.00 173.24 174.39 3kpd h LYS 396 N 9.72 -0.25 -5.58 12.44 1.57 -1.91 -3.35 116.57 129.21 3kpd h LYS 396 Ca -0.26 0.02 -0.65 0.00 -1.87 0.00 0.00 60.65 57.89 3kpd h LYS 396 Cb 1.09 0.06 -0.12 0.00 0.08 0.00 0.00 32.23 33.34 3kpd h LYS 396 CO 1.06 -0.16 -0.54 -1.25 -0.57 0.00 0.00 179.45 177.99 3kpd s PRO 397 N -4.36 3.55 0.39 3.15 0.04 -1.26 -4.75 135.00 131.76 3kpd s PRO 397 Ca -0.08 -0.27 -0.27 0.00 0.04 0.00 0.00 61.00 60.43 3kpd s PRO 397 Cb 0.04 -3.12 -0.09 0.00 0.04 0.00 0.00 34.50 31.37 3kpd s PRO 397 CO 0.31 0.57 1.31 -1.25 0.04 0.00 0.00 177.00 177.97 3kpd s PRO 398 N -0.45 4.05 -0.27 0.56 0.04 -1.26 -4.93 135.00 132.74 3kpd s PRO 398 Ca 0.10 2.17 -0.08 0.00 0.04 0.00 0.00 61.00 63.24 3kpd s PRO 398 Cb -0.12 -2.82 -0.02 0.00 0.04 0.00 0.00 34.50 31.59 3kpd s PRO 398 CO 0.02 -0.43 0.09 0.42 0.04 0.00 0.00 177.00 177.14 3kpd s ILE 399 N -1.24 4.31 0.37 0.56 1.01 -1.26 -5.01 121.20 119.93 3kpd s ILE 399 Ca 0.55 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.91 3kpd s ILE 399 Cb -0.38 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.94 3kpd s ILE 399 CO 0.50 0.23 0.07 0.42 0.00 0.00 0.00 174.94 176.16 3kpd s THR 400 N 1.59 1.08 0.16 2.92 -4.23 -1.26 -3.90 115.64 112.00 3kpd s THR 400 Ca 0.05 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.34 3kpd s THR 400 Cb -0.16 -2.64 0.07 0.00 1.34 0.00 0.00 72.50 71.11 3kpd s THR 400 CO 0.04 0.00 0.59 0.00 -0.54 0.00 0.00 174.62 174.71 3kpd s ALA 401 N -3.21 -1.57 0.44 3.99 0.00 -1.07 -4.98 121.76 115.36 3kpd s ALA 401 Ca 0.31 0.46 -0.05 0.00 0.00 0.00 0.00 51.96 52.69 3kpd s ALA 401 Cb 0.07 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 24.03 3kpd s ALA 401 CO 0.14 -0.77 0.73 -1.01 0.00 0.00 0.00 175.76 174.85 3kpd s HIS 402 N -3.75 3.54 -0.99 0.00 3.76 -1.26 -1.65 115.29 114.93 3kpd s HIS 402 Ca 0.01 0.74 0.23 0.00 -0.15 0.00 0.00 55.06 55.89 3kpd s HIS 402 Cb -0.01 -2.23 0.99 0.00 1.11 0.00 0.00 32.58 32.44 3kpd s HIS 402 CO -0.13 -0.16 1.74 -1.13 -0.85 0.00 0.00 174.74 174.21 3kpd n SER 403 N -2.00 0.02 0.00 1.40 3.41 -1.26 -2.85 113.62 112.34 3kpd n SER 403 Ca -0.00 0.50 0.13 0.00 -0.26 0.00 0.00 58.87 59.24 3kpd n SER 403 Cb 0.55 -0.51 0.77 0.00 -0.26 0.00 0.00 64.21 64.76 3kpd n SER 403 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3kpd n ASN 404 N -1.52 0.00 -4.83 4.04 2.04 -1.26 -4.39 115.26 109.34 3kpd n ASN 404 Ca 0.06 -1.15 -0.31 0.00 -0.44 0.00 0.00 54.58 52.73 3kpd n ASN 404 Cb 0.27 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 37.55 3kpd n ASN 404 CO 0.00 0.00 0.00 0.27 -0.44 0.00 0.00 177.26 177.09 3kpd s ILE 405 N -2.00 4.24 0.41 1.53 -4.36 -1.13 -5.05 121.20 114.84 3kpd s ILE 405 Ca 0.39 0.81 -0.07 0.00 -0.26 0.00 0.00 60.65 61.52 3kpd s ILE 405 Cb 0.18 -3.56 -0.05 0.00 1.25 0.00 0.00 42.46 40.28 3kpd s ILE 405 CO 0.30 -0.87 0.73 -0.94 0.24 0.00 0.00 174.94 174.39 3kpd s SER 406 N -3.68 6.39 0.33 4.36 1.04 -1.26 -4.29 113.70 116.59 3kpd s SER 406 Ca 0.58 0.94 0.08 0.00 0.48 0.00 0.00 55.95 58.03 3kpd s SER 406 Cb -0.13 -2.25 0.81 0.00 0.10 0.00 0.00 66.02 64.55 3kpd s SER 406 CO 0.50 -0.43 1.79 0.40 0.98 0.00 0.00 173.24 176.48 3kpd h ILE 407 N 0.78 0.70 0.06 -1.02 2.04 -1.91 0.36 117.51 118.52 3kpd h ILE 407 Ca -0.47 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 3kpd h ILE 407 Cb 1.20 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 3kpd h ILE 407 CO 0.63 0.13 -0.03 -0.03 0.00 0.00 0.00 178.15 178.85 3kpd h MET 408 N 0.70 -0.07 -0.66 2.37 4.05 -1.95 -0.53 114.93 118.84 3kpd h MET 408 Ca 0.56 0.00 0.09 0.00 -0.28 0.00 0.00 59.70 60.07 3kpd h MET 408 Cb 0.96 0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 31.71 3kpd h MET 408 CO -0.34 0.28 0.31 0.93 0.23 0.00 0.00 176.91 178.32 3kpd h GLU 409 N -0.44 0.53 -0.59 0.39 4.39 -1.69 0.27 114.58 117.45 3kpd h GLU 409 Ca -0.01 -0.03 0.12 0.00 0.34 0.00 0.00 59.36 59.78 3kpd h GLU 409 Cb 0.39 -0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 28.81 3kpd h GLU 409 CO 0.01 0.35 -0.03 0.00 -1.16 0.00 0.00 179.01 178.18 3kpd h ALA 410 N 1.41 0.54 -0.16 3.43 0.00 -0.75 -0.60 119.26 123.13 3kpd h ALA 410 Ca 0.32 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 3kpd h ALA 410 Cb 0.34 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3kpd h ALA 410 CO -0.26 -0.40 0.07 0.00 0.00 0.00 0.00 179.25 178.65 3kpd h ALA 411 N 1.55 0.21 -0.52 0.00 0.00 0.70 -1.21 119.26 120.00 3kpd h ALA 411 Ca 0.30 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.22 3kpd h ALA 411 Cb 0.48 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.12 3kpd h ALA 411 CO -0.53 -0.21 -0.08 0.87 0.00 0.00 0.00 179.25 179.30 3kpd h LYS 412 N 0.11 0.04 -0.36 0.00 1.57 0.12 0.16 116.57 118.20 3kpd h LYS 412 Ca 0.05 -0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.91 3kpd h LYS 412 Cb 0.16 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 3kpd h LYS 412 CO -0.00 0.02 -0.13 0.82 -0.57 0.00 0.00 179.45 179.59 3kpd h ILE 413 N 0.04 0.56 -0.84 1.86 2.04 -0.48 0.18 117.51 120.86 3kpd h ILE 413 Ca 0.25 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.08 3kpd h ILE 413 Cb 0.39 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 3kpd h ILE 413 CO -0.50 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 177.97 3kpd h LEU 414 N -0.05 1.12 0.40 1.44 3.38 0.45 -0.95 115.31 121.09 3kpd h LEU 414 Ca 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3kpd h LEU 414 Cb 0.32 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3kpd h LEU 414 CO -0.40 0.95 -0.19 0.40 0.09 0.00 0.00 178.44 179.29 3kpd h ILE 415 N 1.21 0.00 -0.60 1.22 1.08 -0.56 -1.75 117.51 118.11 3kpd h ILE 415 Ca 0.29 -0.05 0.18 0.00 -0.39 0.00 0.00 64.86 64.88 3kpd h ILE 415 Cb 0.15 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.79 3kpd h ILE 415 CO -0.03 0.00 0.06 1.17 -0.69 0.00 0.00 178.15 178.66 3kpd n LYS 416 N -3.59 -0.05 -0.27 2.37 4.81 0.56 -0.62 118.16 121.38 3kpd n LYS 416 Ca -0.07 0.88 0.09 0.00 -0.87 0.00 0.00 58.31 58.34 3kpd n LYS 416 Cb 0.21 -1.43 0.24 0.00 0.02 0.00 0.00 35.03 34.07 3kpd n LYS 416 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3kpd n HIS 417 N -4.69 0.72 -3.81 5.64 8.25 -0.40 -4.97 115.22 115.96 3kpd n HIS 417 Ca 0.15 -0.49 -0.26 0.00 -0.26 0.00 0.00 57.72 56.86 3kpd n HIS 417 Cb 0.50 -0.01 0.03 0.00 1.12 0.00 0.00 29.99 31.63 3kpd n HIS 417 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3kpd n ASN 418 N 1.09 -3.29 -4.47 0.41 3.02 0.21 -4.98 115.26 107.24 3kpd n ASN 418 Ca 0.18 -0.79 -0.23 0.00 -0.03 0.00 0.00 54.58 53.72 3kpd n ASN 418 Cb 0.53 -4.00 -0.11 0.00 -0.61 0.00 0.00 39.78 35.59 3kpd n ASN 418 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3kpd s ILE 419 N -3.46 1.41 -0.02 2.41 -4.36 -0.70 -5.05 121.20 111.43 3kpd s ILE 419 Ca 0.38 -2.02 0.00 0.00 -0.26 0.00 0.00 60.65 58.75 3kpd s ILE 419 Cb -0.19 -2.76 -0.01 0.00 1.25 0.00 0.00 42.46 40.76 3kpd s ILE 419 CO 0.82 -0.06 0.02 0.59 0.24 0.00 0.00 174.94 176.55 3kpd n ASN 420 N -0.71 0.20 -4.19 4.36 3.02 -1.26 -4.67 115.26 112.00 3kpd n ASN 420 Ca -0.03 -0.49 -0.31 0.00 -0.03 0.00 0.00 54.58 53.72 3kpd n ASN 420 Cb 0.66 1.00 -0.17 0.00 -0.61 0.00 0.00 39.78 40.66 3kpd n ASN 420 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3kpd s HIS 421 N -1.08 2.36 -0.24 3.10 3.76 -1.26 -1.48 115.29 120.45 3kpd s HIS 421 Ca 0.00 -0.92 -0.02 0.00 -0.15 0.00 0.00 55.06 53.97 3kpd s HIS 421 Cb 0.00 -1.59 0.08 0.00 1.11 0.00 0.00 32.58 32.18 3kpd s HIS 421 CO 0.02 -0.37 0.06 -1.17 -0.85 0.00 0.00 174.74 172.43 3kpd s LEU 422 N 0.32 1.44 0.15 0.89 2.96 0.17 -4.95 118.68 119.66 3kpd s LEU 422 Ca -0.16 -1.12 -0.29 0.00 -0.22 0.00 0.00 54.13 52.34 3kpd s LEU 422 Cb -0.17 -0.66 -0.07 0.00 0.50 0.00 0.00 46.19 45.79 3kpd s LEU 422 CO 0.07 -0.35 0.92 -2.84 -1.32 0.00 0.00 176.35 172.84 3kpd s PRO 423 N 1.81 4.73 -0.22 0.98 0.02 -1.25 0.96 135.00 142.03 3kpd s PRO 423 Ca 0.03 1.41 -0.10 0.00 0.02 0.00 0.00 61.00 62.37 3kpd s PRO 423 Cb -0.17 -3.33 -0.05 0.00 0.02 0.00 0.00 34.50 30.97 3kpd s PRO 423 CO -0.16 0.35 0.13 0.42 -0.33 0.00 0.00 177.00 177.40 3kpd s ILE 424 N -0.48 5.19 0.20 2.83 -1.09 0.18 -2.60 121.20 125.42 3kpd s ILE 424 Ca 0.43 0.12 0.10 0.00 -2.23 0.00 0.00 60.65 59.07 3kpd s ILE 424 Cb -0.24 -3.39 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 3kpd s ILE 424 CO 0.30 0.40 -0.20 0.68 -1.23 0.00 0.00 174.94 174.88 3kpd s VAL 425 N 0.74 2.12 0.21 2.92 -7.23 -0.66 -0.28 120.40 118.22 3kpd s VAL 425 Ca 0.07 -2.06 -0.03 0.00 -1.81 0.00 0.00 61.98 58.14 3kpd s VAL 425 Cb -0.13 -2.03 0.05 0.00 0.56 0.00 0.00 36.38 34.83 3kpd s VAL 425 CO 0.02 -0.28 0.29 -0.90 -0.31 0.00 0.00 175.10 173.92 3kpd n ASP 426 N 0.08 0.07 0.33 4.85 5.68 -0.62 -4.23 116.55 122.72 3kpd n ASP 426 Ca -0.11 -1.13 0.22 0.00 -0.50 0.00 0.00 54.79 53.26 3kpd n ASP 426 Cb 0.57 -0.22 1.14 0.00 -1.14 0.00 0.00 41.12 41.47 3kpd n ASP 426 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3kpd h GLU 427 N 0.00 0.00 -0.37 0.11 9.09 -1.99 -1.06 114.58 120.37 3kpd h GLU 427 Ca -0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.32 3kpd h GLU 427 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 3kpd h GLU 427 CO 0.07 0.00 0.00 0.72 0.05 0.00 0.00 179.01 179.85 3kpd n HIS 428 N -3.13 0.76 -0.60 2.06 8.25 -1.26 -4.98 115.22 116.32 3kpd n HIS 428 Ca -0.03 -0.64 0.00 0.00 -0.26 0.00 0.00 57.72 56.80 3kpd n HIS 428 Cb 0.10 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.07 3kpd n HIS 428 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kpd n GLY 429 N 0.29 0.71 3.77 -1.41 0.00 -0.40 -5.00 105.19 103.14 3kpd n GLY 429 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3kpd n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kpd s LYS 430 N -0.40 4.31 -0.06 1.61 -0.14 -1.26 -3.13 119.74 120.67 3kpd s LYS 430 Ca 0.00 1.92 -0.30 0.00 -1.36 0.00 0.00 55.97 56.23 3kpd s LYS 430 Cb 0.00 -2.93 -0.05 0.00 -1.68 0.00 0.00 37.83 33.17 3kpd s LYS 430 CO 0.00 -0.12 1.55 -1.17 -0.76 0.00 0.00 175.35 174.85 3kpd s LEU 431 N -2.01 4.30 -0.05 3.17 2.96 -0.02 -1.58 118.68 125.44 3kpd s LEU 431 Ca 0.51 2.14 0.12 0.00 -0.22 0.00 0.00 54.13 56.68 3kpd s LEU 431 Cb -0.33 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.64 3kpd s LEU 431 CO 0.43 -0.86 0.20 1.33 -1.32 0.00 0.00 176.35 176.13 3kpd n VAL 432 N 5.28 0.26 -2.14 1.68 0.24 0.61 -4.94 118.33 119.33 3kpd n VAL 432 Ca 0.16 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3kpd n VAL 432 Cb 0.43 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.73 3kpd n VAL 432 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kpd n GLY 433 N 1.94 -1.25 2.96 7.63 0.00 -0.86 -4.66 105.19 110.94 3kpd n GLY 433 Ca -0.08 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 3kpd n GLY 433 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kpd s ILE 434 N -2.69 0.21 -0.02 -0.61 2.07 0.47 0.49 121.20 121.11 3kpd s ILE 434 Ca 0.00 -0.55 0.05 0.00 -1.41 0.00 0.00 60.65 58.75 3kpd s ILE 434 Cb 0.00 -0.26 -0.03 0.00 0.13 0.00 0.00 42.46 42.30 3kpd s ILE 434 CO 0.00 -0.22 -0.18 -0.63 -1.91 0.00 0.00 174.94 172.00 3kpd s ILE 435 N -0.77 2.76 0.14 2.00 -1.09 0.27 -1.10 121.20 123.41 3kpd s ILE 435 Ca -0.07 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.47 3kpd s ILE 435 Cb -0.06 -2.07 -0.04 0.00 -1.58 0.00 0.00 42.46 38.71 3kpd s ILE 435 CO -0.00 0.53 -0.08 0.42 -1.23 0.00 0.00 174.94 174.58 3kpd s THR 436 N -0.75 1.02 0.32 2.92 -4.23 -1.26 0.44 115.64 114.10 3kpd s THR 436 Ca 0.12 -2.03 0.16 0.00 -1.18 0.00 0.00 61.69 58.77 3kpd s THR 436 Cb -0.10 -1.85 0.31 0.00 1.34 0.00 0.00 72.50 72.20 3kpd s THR 436 CO 0.01 -0.74 1.38 -1.20 -0.54 0.00 0.00 174.62 173.53 3kpd n SER 437 N -0.17 0.26 -0.27 3.99 7.64 -0.55 0.55 113.62 125.07 3kpd n SER 437 Ca -0.10 1.45 -0.02 0.00 1.01 0.00 0.00 58.87 61.21 3kpd n SER 437 Cb 0.61 -0.69 0.17 0.00 -1.01 0.00 0.00 64.21 63.29 3kpd n SER 437 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 3kpd h TRP 438 N 0.00 1.07 0.00 1.43 2.91 -1.95 0.22 115.95 119.63 3kpd h TRP 438 Ca 0.72 -0.00 -0.08 0.00 1.13 0.00 0.00 58.89 60.65 3kpd h TRP 438 Cb 1.86 -0.35 -0.01 0.00 -0.51 0.00 0.00 29.16 30.15 3kpd h TRP 438 CO -0.06 0.72 -0.40 -0.44 -1.03 0.00 0.00 178.44 177.23 3kpd h ASP 439 N 1.12 0.00 0.74 2.65 3.32 -0.26 0.58 116.42 124.56 3kpd h ASP 439 Ca 0.29 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.15 3kpd h ASP 439 Cb -0.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 3kpd h ASP 439 CO -0.05 0.40 -0.87 0.40 -1.72 0.00 0.00 179.24 177.40 3kpd h ILE 440 N 0.00 1.56 -0.05 0.35 1.08 -0.91 0.39 117.51 119.93 3kpd h ILE 440 Ca -0.00 -2.80 -0.08 0.00 -0.39 0.00 0.00 64.86 61.59 3kpd h ILE 440 Cb 0.98 2.54 -0.01 0.00 -3.07 0.00 0.00 36.82 37.26 3kpd h ILE 440 CO 0.05 0.81 -0.33 0.00 -0.69 0.00 0.00 178.15 177.99 3kpd h ALA 441 N 1.06 1.36 0.13 1.87 0.00 0.36 -3.05 119.26 120.99 3kpd h ALA 441 Ca -0.03 -0.32 -0.30 0.00 0.00 0.00 0.00 54.91 54.26 3kpd h ALA 441 Cb 1.52 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 19.27 3kpd h ALA 441 CO 0.12 0.46 -1.27 -0.22 0.00 0.00 0.00 179.25 178.35 3kpd h LYS 442 N 0.09 0.61 -0.28 0.00 3.64 -0.48 -2.33 116.57 117.82 3kpd h LYS 442 Ca 0.01 -0.83 0.05 0.00 -1.27 0.00 0.00 60.65 58.61 3kpd h LYS 442 Cb 0.63 0.28 -0.08 0.00 -0.41 0.00 0.00 32.23 32.65 3kpd h LYS 442 CO 0.05 1.38 -0.45 0.00 -2.27 0.00 0.00 179.45 178.15 3kpd h ALA 443 N 0.29 -0.58 -0.03 5.00 0.00 -0.86 0.47 119.26 123.55 3kpd h ALA 443 Ca -0.19 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.74 3kpd h ALA 443 Cb 1.94 0.90 -0.02 0.00 0.00 0.00 0.00 17.79 20.61 3kpd h ALA 443 CO 0.24 -0.93 -0.19 1.25 0.00 0.00 0.00 179.25 179.61 3kpd h LEU 444 N -0.42 -0.61 -2.44 0.00 6.46 -1.54 0.11 115.31 116.87 3kpd h LEU 444 Ca 0.10 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.95 3kpd h LEU 444 Cb 0.61 0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.78 3kpd h LEU 444 CO -0.50 -0.18 0.15 0.00 -0.62 0.00 0.00 178.44 177.29 3kpd h ALA 445 N -1.06 1.43 0.00 1.25 0.00 -0.77 -0.08 119.26 120.04 3kpd h ALA 445 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3kpd h ALA 445 Cb 0.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3kpd h ALA 445 CO -0.15 -0.18 -0.05 1.04 0.00 0.00 0.00 179.25 179.91 3kpd n GLN 446 N -3.40 1.63 -3.48 0.00 6.02 0.08 -5.02 117.38 113.21 3kpd n GLN 446 Ca -0.01 -1.90 -0.19 0.00 -0.01 0.00 0.00 57.00 54.89 3kpd n GLN 446 Cb 0.23 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.34 3kpd n GLN 446 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3kpd n ASN 447 N -0.87 -3.37 -4.68 1.08 5.15 0.29 -4.95 115.26 107.91 3kpd n ASN 447 Ca 0.08 -0.72 -0.34 0.00 -0.60 0.00 0.00 54.58 53.00 3kpd n ASN 447 Cb 0.51 -1.13 -0.09 0.00 -0.53 0.00 0.00 39.78 38.53 3kpd n ASN 447 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3kpd s LYS 448 N -4.34 2.87 -0.14 1.20 -0.14 -0.65 -5.04 119.74 113.50 3kpd s LYS 448 Ca 0.03 -0.52 0.18 0.00 -1.36 0.00 0.00 55.97 54.29 3kpd s LYS 448 Cb -0.02 -2.72 -0.25 0.00 -1.68 0.00 0.00 37.83 33.16 3kpd s LYS 448 CO 0.65 0.66 0.24 1.17 -0.76 0.00 0.00 175.35 177.30 3kpd n LYS 449 N 1.69 0.68 -4.26 1.68 4.81 -1.26 -4.75 118.16 116.74 3kpd n LYS 449 Ca -0.16 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.12 3kpd n LYS 449 Cb 0.53 -1.56 -0.10 0.00 0.02 0.00 0.00 35.03 33.91 3kpd n LYS 449 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3kpd s THR 450 N -2.69 1.30 0.21 3.15 -4.23 -1.26 -4.66 115.64 107.46 3kpd s THR 450 Ca -0.09 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.33 3kpd s THR 450 Cb 0.08 -1.79 0.15 0.00 1.34 0.00 0.00 72.50 72.27 3kpd s THR 450 CO 0.84 -0.64 1.76 0.40 -0.54 0.00 0.00 174.62 176.45 3kpd h ILE 451 N 2.93 0.83 -0.93 2.99 1.08 -1.84 -2.92 117.51 119.65 3kpd h ILE 451 Ca -0.38 -0.17 0.15 0.00 -0.39 0.00 0.00 64.86 64.07 3kpd h ILE 451 Cb 1.20 0.29 -0.08 0.00 -3.07 0.00 0.00 36.82 35.16 3kpd h ILE 451 CO 0.60 0.09 0.59 -0.33 -0.69 0.00 0.00 178.15 178.41 3kpd h GLU 452 N 0.50 0.72 -0.63 2.37 4.39 -1.90 0.39 114.58 120.42 3kpd h GLU 452 Ca 0.31 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.97 3kpd h GLU 452 Cb 0.33 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3kpd h GLU 452 CO -0.27 0.48 0.00 -0.85 -1.16 0.00 0.00 179.01 177.21 3kpd n GLU 453 N -4.59 3.11 0.00 2.33 0.28 -1.11 -4.10 120.64 116.55 3kpd n GLU 453 Ca 0.18 -2.07 0.00 0.00 -0.16 0.00 0.00 57.16 55.12 3kpd n GLU 453 Cb 0.47 -1.78 0.00 0.00 1.43 0.00 0.00 31.44 31.56 3kpd n GLU 453 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 3kpd n ILE 454 N 0.68 0.00 -2.57 3.84 0.13 0.84 -4.97 119.36 117.32 3kpd n ILE 454 Ca 0.19 0.00 -0.35 0.00 -1.10 0.00 0.00 62.75 61.49 3kpd n ILE 454 Cb 0.72 0.08 -0.04 0.00 -0.84 0.00 0.00 39.64 39.55 3kpd n ILE 454 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3kpd s MET 455 N -0.71 3.98 -0.10 9.51 0.23 0.99 -4.93 119.30 128.27 3kpd s MET 455 Ca 0.00 1.40 -0.27 0.00 -1.03 0.00 0.00 55.69 55.79 3kpd s MET 455 Cb 0.00 -2.28 -0.02 0.00 -1.53 0.00 0.00 34.83 31.00 3kpd s MET 455 CO 0.00 -0.28 0.86 0.99 -2.03 0.00 0.00 175.02 174.56 3kpd s THR 456 N -1.87 4.90 -0.06 3.16 2.01 -0.26 -4.90 115.64 118.62 3kpd s THR 456 Ca 0.63 1.75 0.20 0.00 0.31 0.00 0.00 61.69 64.58 3kpd s THR 456 Cb -0.18 -4.18 -0.31 0.00 0.01 0.00 0.00 72.50 67.84 3kpd s THR 456 CO 0.22 0.10 0.39 0.54 -0.69 0.00 0.00 174.62 175.18 3kpd n ARG 457 N 4.61 0.67 -3.42 4.92 1.74 -1.26 -0.40 116.66 123.51 3kpd n ARG 457 Ca 0.04 -0.16 -0.44 0.00 -0.77 0.00 0.00 57.85 56.53 3kpd n ARG 457 Cb 0.50 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.38 3kpd n ARG 457 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3kpd s ASN 458 N -4.56 5.98 -0.19 0.55 0.01 -1.26 -4.58 114.94 110.89 3kpd s ASN 458 Ca -0.08 -1.88 -0.07 0.00 -0.71 0.00 0.00 52.86 50.12 3kpd s ASN 458 Cb 0.12 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.62 3kpd s ASN 458 CO 0.85 -0.77 0.06 -0.69 -1.51 0.00 0.00 177.10 175.03 3kpd s VAL 459 N 1.44 4.68 0.05 1.60 1.01 -1.26 -5.05 120.40 122.87 3kpd s VAL 459 Ca 0.05 -0.07 -0.31 0.00 0.00 0.00 0.00 61.98 61.65 3kpd s VAL 459 Cb -0.28 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.92 3kpd s VAL 459 CO 0.01 0.45 1.42 -0.63 0.00 0.00 0.00 175.10 176.35 3kpd s ILE 460 N 0.50 3.50 0.41 2.22 1.09 -1.26 -5.02 121.20 122.64 3kpd s ILE 460 Ca 0.03 0.97 0.07 0.00 -1.10 0.00 0.00 60.65 60.63 3kpd s ILE 460 Cb -0.13 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.59 3kpd s ILE 460 CO 0.01 0.02 0.17 0.42 -0.10 0.00 0.00 174.94 175.46 3kpd s THR 461 N 1.99 2.32 0.05 2.92 -4.23 -1.26 -4.05 115.64 113.38 3kpd s THR 461 Ca 0.65 -1.72 0.04 0.00 -1.18 0.00 0.00 61.69 59.48 3kpd s THR 461 Cb -0.34 -2.99 -0.03 0.00 1.34 0.00 0.00 72.50 70.48 3kpd s THR 461 CO 0.28 -0.01 -0.11 0.00 -0.54 0.00 0.00 174.62 174.24 3kpd s ALA 462 N -2.60 0.86 0.13 3.99 0.00 0.25 -4.94 121.76 119.45 3kpd s ALA 462 Ca 0.40 -0.87 -0.07 0.00 0.00 0.00 0.00 51.96 51.43 3kpd s ALA 462 Cb 0.04 -0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.07 3kpd s ALA 462 CO 0.22 0.07 0.39 -1.58 0.00 0.00 0.00 175.76 174.87 3kpd s HIS 463 N -1.31 3.51 0.07 0.00 2.46 -1.26 -1.65 115.29 117.11 3kpd s HIS 463 Ca -0.06 0.66 0.31 0.00 0.47 0.00 0.00 55.06 56.44 3kpd s HIS 463 Cb -0.10 -2.08 1.20 0.00 -0.13 0.00 0.00 32.58 31.48 3kpd s HIS 463 CO 0.01 0.45 1.93 1.05 -2.47 0.00 0.00 174.74 175.71 3kpd h GLU 464 N 3.12 0.00 -0.00 2.88 4.11 -1.94 -0.94 114.58 121.80 3kpd h GLU 464 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3kpd h GLU 464 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3kpd h GLU 464 CO 0.70 0.05 -0.19 -0.25 0.07 0.00 0.00 179.01 179.39 3kpd n ASP 465 N -3.16 0.53 -4.77 3.06 8.00 -1.26 -1.50 116.55 117.45 3kpd n ASP 465 Ca 0.01 -0.46 -0.40 0.00 0.71 0.00 0.00 54.79 54.65 3kpd n ASP 465 Cb 0.35 -0.03 -0.01 0.00 -0.02 0.00 0.00 41.12 41.41 3kpd n ASP 465 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3kpd s GLU 466 N -2.62 4.12 0.42 -1.24 2.12 -0.36 -4.78 118.70 116.37 3kpd s GLU 466 Ca 0.23 2.23 -0.21 0.00 0.36 0.00 0.00 54.97 57.58 3kpd s GLU 466 Cb 0.19 -2.89 -0.11 0.00 0.26 0.00 0.00 34.13 31.58 3kpd s GLU 466 CO 0.53 -0.39 0.95 -1.25 -0.54 0.00 0.00 175.26 174.55 3kpd s PRO 467 N -2.06 4.25 0.08 4.30 0.04 -1.26 -0.94 135.00 139.40 3kpd s PRO 467 Ca 0.53 1.13 -0.31 0.00 0.04 0.00 0.00 61.00 62.39 3kpd s PRO 467 Cb -0.40 -2.21 -0.16 0.00 0.04 0.00 0.00 34.50 31.77 3kpd s PRO 467 CO 0.52 -0.01 1.63 0.28 0.04 0.00 0.00 177.00 179.46 3kpd h VAL 468 N 1.94 0.39 -0.85 -0.36 2.07 -1.74 -2.84 116.25 114.86 3kpd h VAL 468 Ca -0.49 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.21 3kpd h VAL 468 Cb 1.18 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 3kpd h VAL 468 CO 0.61 0.00 0.56 -2.24 0.02 0.00 0.00 177.57 176.53 3kpd h ASP 469 N -0.74 0.43 -0.29 0.57 2.03 -1.94 -0.36 116.42 116.13 3kpd h ASP 469 Ca -0.05 0.04 -0.00 0.00 -0.73 0.00 0.00 57.03 56.28 3kpd h ASP 469 Cb 0.60 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.04 3kpd h ASP 469 CO 0.05 0.20 0.17 0.45 -1.03 0.00 0.00 179.24 179.08 3kpd h HIS 470 N 0.45 0.38 -0.57 4.15 3.86 -1.91 -0.48 115.15 121.03 3kpd h HIS 470 Ca 0.43 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.72 3kpd h HIS 470 Cb 1.01 -0.12 -0.06 0.00 1.06 0.00 0.00 27.41 29.29 3kpd h HIS 470 CO -0.00 0.29 0.23 0.28 0.86 0.00 0.00 177.93 179.59 3kpd h VAL 471 N 0.36 0.82 -0.54 2.45 2.07 -1.04 0.31 116.25 120.69 3kpd h VAL 471 Ca 0.10 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3kpd h VAL 471 Cb 0.02 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 3kpd h VAL 471 CO -0.02 0.08 0.36 0.00 0.02 0.00 0.00 177.57 178.01 3kpd h ALA 472 N 1.37 0.69 -0.03 1.67 0.00 -0.92 0.18 119.26 122.23 3kpd h ALA 472 Ca 0.28 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3kpd h ALA 472 Cb 0.30 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3kpd h ALA 472 CO -0.26 0.13 0.02 0.82 0.00 0.00 0.00 179.25 179.95 3kpd h ILE 473 N 0.74 1.05 -0.35 0.00 2.04 -0.32 -2.02 117.51 118.65 3kpd h ILE 473 Ca 0.20 -0.13 0.07 0.00 1.00 0.00 0.00 64.86 66.00 3kpd h ILE 473 Cb -0.08 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3kpd h ILE 473 CO -0.04 0.04 -0.07 0.11 0.00 0.00 0.00 178.15 178.18 3kpd h LYS 474 N -0.01 0.01 -0.09 2.37 1.57 -0.03 -1.93 116.57 118.47 3kpd h LYS 474 Ca 0.01 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3kpd h LYS 474 Cb 0.05 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3kpd h LYS 474 CO -0.00 0.01 0.05 0.52 -0.57 0.00 0.00 179.45 179.46 3kpd h MET 475 N 0.01 0.10 -0.14 3.15 2.86 -0.42 -1.79 114.93 118.70 3kpd h MET 475 Ca 0.17 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.76 3kpd h MET 475 Cb 0.25 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3kpd h MET 475 CO -0.35 0.07 -0.10 0.66 1.06 0.00 0.00 176.91 178.25 3kpd h SER 476 N 0.10 0.19 -0.01 1.22 4.64 -1.24 0.14 113.55 118.59 3kpd h SER 476 Ca 0.03 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3kpd h SER 476 Cb -0.00 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 3kpd h SER 476 CO -0.02 0.32 -0.06 0.50 -0.87 0.00 0.00 176.83 176.71 3kpd h LYS 477 N 0.20 -0.09 -0.05 4.77 3.64 -0.52 -2.93 116.57 121.59 3kpd h LYS 477 Ca 0.04 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3kpd h LYS 477 Cb 0.31 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 3kpd h LYS 477 CO 0.02 -0.06 0.00 0.66 -2.27 0.00 0.00 179.45 177.80 3kpd n TYR 478 N -5.17 0.05 -3.11 1.91 4.01 -0.98 -4.95 117.16 108.92 3kpd n TYR 478 Ca -0.06 -0.02 -0.14 0.00 -0.16 0.00 0.00 57.90 57.52 3kpd n TYR 478 Cb 0.10 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.19 3kpd n TYR 478 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3kpd n ASN 479 N 0.59 -3.29 -4.22 7.72 5.15 0.37 -5.00 115.26 116.58 3kpd n ASN 479 Ca 0.17 -0.41 -0.27 0.00 -0.60 0.00 0.00 54.58 53.47 3kpd n ASN 479 Cb 0.44 -3.71 -0.06 0.00 -0.53 0.00 0.00 39.78 35.92 3kpd n ASN 479 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 3kpd n ILE 480 N -3.63 0.00 0.00 -1.44 -5.35 -0.57 -5.02 119.36 103.35 3kpd n ILE 480 Ca -0.12 -1.99 0.00 0.00 -0.27 0.00 0.00 62.75 60.38 3kpd n ILE 480 Cb 0.59 0.39 0.00 0.00 -1.74 0.00 0.00 39.64 38.88 3kpd n ILE 480 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3kpd n SER 481 N -1.26 0.17 -4.15 7.28 3.41 -1.26 -4.54 113.62 113.26 3kpd n SER 481 Ca -0.17 -0.05 -0.16 0.00 -0.26 0.00 0.00 58.87 58.22 3kpd n SER 481 Cb 0.53 0.14 -0.11 0.00 -0.26 0.00 0.00 64.21 64.51 3kpd n SER 481 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3kpd s GLY 482 N -0.18 0.80 -0.04 5.00 0.00 -1.26 -0.95 107.32 110.69 3kpd s GLY 482 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 44.72 43.69 3kpd s GLY 482 CO 0.00 -1.07 0.07 -1.34 0.00 0.00 0.00 173.10 170.77 3kpd s VAL 483 N -1.67 -0.09 0.48 1.40 -7.23 0.31 -4.98 120.40 108.63 3kpd s VAL 483 Ca -0.01 0.27 -0.23 0.00 -1.81 0.00 0.00 61.98 60.20 3kpd s VAL 483 Cb -0.08 -0.15 -0.08 0.00 0.56 0.00 0.00 36.38 36.63 3kpd s VAL 483 CO 0.01 0.11 1.23 -2.65 -0.31 0.00 0.00 175.10 173.49 3kpd n PRO 484 N 4.55 1.67 -3.61 4.82 -0.02 -1.26 -1.28 135.00 139.88 3kpd n PRO 484 Ca -0.20 0.61 -0.39 0.00 -2.02 0.00 0.00 63.50 61.50 3kpd n PRO 484 Cb 0.50 -2.37 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 3kpd n PRO 484 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3kpd s VAL 485 N -1.27 4.98 -0.02 -1.45 1.01 0.39 -0.58 120.40 123.44 3kpd s VAL 485 Ca 0.66 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.47 3kpd s VAL 485 Cb -0.48 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 3kpd s VAL 485 CO 0.54 0.11 -0.05 0.68 0.00 0.00 0.00 175.10 176.39 3kpd s VAL 486 N 1.69 3.83 0.00 2.92 -7.23 -0.66 -0.60 120.40 120.35 3kpd s VAL 486 Ca 0.06 -0.62 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 3kpd s VAL 486 Cb -0.17 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.13 3kpd s VAL 486 CO 0.09 0.46 0.00 -0.90 -0.31 0.00 0.00 175.10 174.43 3kpd n ASP 487 N 1.73 0.00 0.13 4.85 5.75 0.12 -4.55 116.55 124.58 3kpd n ASP 487 Ca -0.16 -0.87 0.12 0.00 -0.01 0.00 0.00 54.79 53.87 3kpd n ASP 487 Cb 0.53 0.00 0.50 0.00 -1.03 0.00 0.00 41.12 41.12 3kpd n ASP 487 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3kpd n ASP 488 N -2.60 0.65 -1.34 -1.12 8.00 -1.26 -1.47 116.55 117.41 3kpd n ASP 488 Ca 0.00 0.68 0.11 0.00 0.71 0.00 0.00 54.79 56.29 3kpd n ASP 488 Cb 0.00 -0.81 0.32 0.00 -0.02 0.00 0.00 41.12 40.61 3kpd n ASP 488 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3kpd n TYR 489 N -2.23 0.99 -3.45 1.24 4.01 -1.26 -4.92 117.16 111.54 3kpd n TYR 489 Ca 0.02 -0.49 -0.25 0.00 -0.16 0.00 0.00 57.90 57.02 3kpd n TYR 489 Cb 0.20 -0.02 0.05 0.00 -0.31 0.00 0.00 39.34 39.26 3kpd n TYR 489 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3kpd n ARG 490 N 1.56 -6.00 -3.64 -0.72 1.74 -0.54 -4.87 116.66 104.20 3kpd n ARG 490 Ca 0.24 0.77 -0.37 0.00 -0.77 0.00 0.00 57.85 57.72 3kpd n ARG 490 Cb 0.62 -5.70 -0.06 0.00 -1.02 0.00 0.00 32.46 26.30 3kpd n ARG 490 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3kpd s ARG 491 N -6.15 3.83 -0.27 5.56 0.52 -1.26 -0.84 118.95 120.34 3kpd s ARG 491 Ca 0.49 0.16 -0.29 0.00 -0.52 0.00 0.00 55.73 55.57 3kpd s ARG 491 Cb -0.23 -3.26 -0.01 0.00 0.52 0.00 0.00 34.95 31.97 3kpd s ARG 491 CO 0.61 0.62 1.50 0.08 0.02 0.00 0.00 175.30 178.13 3kpd s VAL 492 N -0.71 3.85 -0.17 3.52 1.01 -1.18 0.13 120.40 126.84 3kpd s VAL 492 Ca 0.19 0.94 0.09 0.00 0.00 0.00 0.00 61.98 63.20 3kpd s VAL 492 Cb -0.14 -3.90 0.19 0.00 0.00 0.00 0.00 36.38 32.52 3kpd s VAL 492 CO 0.08 -0.41 1.12 1.33 0.00 0.00 0.00 175.10 177.22 3kpd n VAL 493 N 6.49 1.42 -3.61 2.92 0.24 0.23 -4.82 118.33 121.21 3kpd n VAL 493 Ca 0.17 -1.51 0.00 0.00 -2.04 0.00 0.00 64.34 60.96 3kpd n VAL 493 Cb 0.46 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.01 3kpd n VAL 493 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kpd n GLY 494 N -0.69 -0.75 3.58 7.63 0.00 -1.14 -4.62 105.19 109.20 3kpd n GLY 494 Ca 0.09 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 3kpd n GLY 494 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kpd s ILE 495 N -2.95 0.00 -0.04 -0.61 2.07 -1.26 -0.46 121.20 117.95 3kpd s ILE 495 Ca 0.00 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.31 3kpd s ILE 495 Cb 0.00 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 3kpd s ILE 495 CO 0.00 0.00 -0.25 -0.69 -1.91 0.00 0.00 174.94 172.09 3kpd s VAL 496 N -0.43 2.11 0.49 4.00 1.01 -0.41 -2.55 120.40 124.63 3kpd s VAL 496 Ca -0.04 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 60.89 3kpd s VAL 496 Cb -0.03 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 3kpd s VAL 496 CO 0.03 0.58 0.05 0.42 0.00 0.00 0.00 175.10 176.18 3kpd s THR 497 N -0.44 0.85 -0.28 3.92 -4.23 -1.26 -0.53 115.64 113.67 3kpd s THR 497 Ca 0.05 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.77 3kpd s THR 497 Cb -0.11 -2.11 0.25 0.00 1.34 0.00 0.00 72.50 71.87 3kpd s THR 497 CO 0.01 0.00 1.60 0.77 -0.54 0.00 0.00 174.62 176.46 3kpd h SER 498 N 1.43 0.00 0.03 3.99 4.64 -1.44 -2.68 113.55 119.52 3kpd h SER 498 Ca -0.41 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.87 3kpd h SER 498 Cb 1.31 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 3kpd h SER 498 CO 0.67 0.17 -0.11 -0.33 -0.87 0.00 0.00 176.83 176.35 3kpd h GLU 499 N 0.00 0.20 -0.22 4.77 3.07 -1.97 -0.33 114.58 120.10 3kpd h GLU 499 Ca -0.00 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.75 3kpd h GLU 499 Cb 1.07 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.94 3kpd h GLU 499 CO 0.02 0.33 -0.11 -0.44 -1.40 0.00 0.00 179.01 177.41 3kpd h ASP 500 N 0.19 0.48 -0.14 1.42 3.32 -1.88 0.21 116.42 120.03 3kpd h ASP 500 Ca 0.04 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.62 3kpd h ASP 500 Cb 0.33 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3kpd h ASP 500 CO 0.02 0.78 -0.08 0.40 -1.72 0.00 0.00 179.24 178.64 3kpd h ILE 501 N 0.18 1.21 -0.35 0.35 1.08 -1.46 -2.06 117.51 116.46 3kpd h ILE 501 Ca 0.05 -0.89 -0.06 0.00 -0.39 0.00 0.00 64.86 63.57 3kpd h ILE 501 Cb 0.60 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.42 3kpd h ILE 501 CO 0.03 0.29 -0.01 0.28 -0.69 0.00 0.00 178.15 178.06 3kpd h SER 502 N 0.43 0.61 -0.63 1.72 0.02 -0.67 -2.75 113.55 112.28 3kpd h SER 502 Ca 0.09 -0.31 0.05 0.00 -0.84 0.00 0.00 61.79 60.78 3kpd h SER 502 Cb 0.41 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 3kpd h SER 502 CO 0.02 0.78 0.34 -0.09 -1.14 0.00 0.00 176.83 176.74 3kpd h ARG 503 N 0.43 0.62 -0.45 3.45 2.43 -0.33 -1.06 114.38 119.46 3kpd h ARG 503 Ca 0.10 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.32 3kpd h ARG 503 Cb 0.47 -0.14 -0.08 0.00 -0.42 0.00 0.00 29.97 29.80 3kpd h ARG 503 CO 0.02 0.41 -0.04 1.25 -1.51 0.00 0.00 179.97 180.10 3kpd h LEU 504 N 0.64 -0.27 -8.17 3.80 6.46 -1.21 -3.30 115.31 113.26 3kpd h LEU 504 Ca 0.28 0.12 -0.20 0.00 -0.12 0.00 0.00 57.88 57.96 3kpd h LEU 504 Cb 0.17 0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.29 3kpd h LEU 504 CO -0.18 -0.09 0.55 0.12 -0.62 0.00 0.00 178.44 178.22 3kpd s PHE 505 N -6.19 1.60 0.00 1.25 5.36 -0.40 -5.12 117.98 114.48 3kpd s PHE 505 Ca -0.14 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 56.99 3kpd s PHE 505 Cb 0.15 -3.79 0.00 0.00 -0.34 0.00 0.00 43.02 39.05 3kpd s PHE 505 CO 0.72 -1.40 0.00 0.41 -1.46 0.00 0.00 175.22 173.48