#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dpp n LEU 390 N 0.00 2.73 -3.58 1.34 4.77 -1.26 -4.93 117.00 116.06 3dpp n LEU 390 Ca 0.00 -0.92 -0.13 0.00 -0.03 0.00 0.00 56.01 54.93 3dpp n LEU 390 Cb 0.00 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3dpp n LEU 390 CO 0.00 0.46 0.64 -1.48 -1.33 0.00 0.00 177.39 175.68 3dpp s LEU 391 N -2.10 -0.50 0.14 2.23 2.34 -1.26 -5.18 118.68 114.34 3dpp s LEU 391 Ca 0.26 0.70 -0.25 0.00 0.06 0.00 0.00 54.13 54.90 3dpp s LEU 391 Cb 0.20 2.11 0.07 0.00 -0.56 0.00 0.00 46.19 48.01 3dpp s LEU 391 CO 0.36 -0.36 0.99 -1.48 -1.06 0.00 0.00 176.35 174.80 3dpp s LEU 392 N -0.69 -0.16 -0.04 1.48 0.05 -1.26 -5.15 118.68 112.90 3dpp s LEU 392 Ca -0.03 -0.38 -0.25 0.00 0.05 0.00 0.00 54.13 53.51 3dpp s LEU 392 Cb -0.02 2.08 -0.03 0.00 -2.05 0.00 0.00 46.19 46.17 3dpp s LEU 392 CO 0.02 -0.85 0.78 -1.81 -0.55 0.00 0.00 176.35 173.95 3dpp s ASP 393 N -2.95 7.10 0.19 1.48 1.01 -1.26 -5.04 116.67 117.20 3dpp s ASP 393 Ca 0.13 1.33 0.05 0.00 0.71 0.00 0.00 52.55 54.77 3dpp s ASP 393 Cb -0.01 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.42 3dpp s ASP 393 CO 0.02 -0.16 -0.09 0.68 0.21 0.00 0.00 175.17 175.83 3dpp s VAL 394 N 0.84 1.33 -0.10 -1.27 -7.23 -1.26 -1.52 120.40 111.19 3dpp s VAL 394 Ca 0.42 -2.10 -0.18 0.00 -1.81 0.00 0.00 61.98 58.31 3dpp s VAL 394 Cb -0.19 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 3dpp s VAL 394 CO 0.21 -0.59 0.47 0.28 -0.31 0.00 0.00 175.10 175.16 3dpp s THR 395 N -3.23 5.16 -0.13 5.32 -1.32 -0.60 -4.84 115.64 116.00 3dpp s THR 395 Ca 0.21 0.94 0.22 0.00 -1.21 0.00 0.00 61.69 61.85 3dpp s THR 395 Cb 0.02 -3.80 -0.17 0.00 -1.51 0.00 0.00 72.50 67.04 3dpp s THR 395 CO 0.05 0.36 0.74 -0.81 -2.21 0.00 0.00 174.62 172.75 3dpp n PRO 396 N 3.40 0.63 -4.75 7.08 -0.04 -1.26 -0.24 135.00 139.82 3dpp n PRO 396 Ca -0.08 -0.02 -0.31 0.00 -0.04 0.00 0.00 63.50 63.05 3dpp n PRO 396 Cb 0.52 -1.68 -0.13 0.00 -0.04 0.00 0.00 33.50 32.17 3dpp n PRO 396 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dpp s LEU 397 N -5.01 2.48 0.40 1.53 1.43 -1.26 -4.08 118.68 114.18 3dpp s LEU 397 Ca -0.04 -0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 52.35 3dpp s LEU 397 Cb 0.11 -1.45 -0.11 0.00 0.03 0.00 0.00 46.19 44.77 3dpp s LEU 397 CO 0.85 0.26 0.97 -1.20 0.23 0.00 0.00 176.35 177.46 3dpp n SER 398 N 1.67 1.09 -4.07 2.29 7.64 -1.26 -4.40 113.62 116.59 3dpp n SER 398 Ca -0.16 1.04 -0.24 0.00 1.01 0.00 0.00 58.87 60.52 3dpp n SER 398 Cb 0.52 -1.33 -0.16 0.00 -1.01 0.00 0.00 64.21 62.24 3dpp n SER 398 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3dpp s LEU 399 N -0.23 1.82 0.00 -3.43 1.43 0.26 -0.98 118.68 117.54 3dpp s LEU 399 Ca 0.63 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 3dpp s LEU 399 Cb -0.58 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 44.83 3dpp s LEU 399 CO 0.57 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.86 3dpp n GLY 400 N 3.33 1.97 3.33 -3.19 0.00 -0.98 0.12 105.19 109.78 3dpp n GLY 400 Ca -0.19 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 3dpp n GLY 400 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3dpp s ILE 401 N -2.39 0.33 -0.06 -0.61 -4.36 -0.76 -0.59 121.20 112.76 3dpp s ILE 401 Ca 0.00 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.22 3dpp s ILE 401 Cb 0.00 -2.52 -0.05 0.00 1.25 0.00 0.00 42.46 41.14 3dpp s ILE 401 CO 0.00 0.00 0.47 -0.70 0.24 0.00 0.00 174.94 174.95 3dpp s GLU 402 N -3.83 4.21 0.28 0.37 2.12 -1.07 -0.60 118.70 120.17 3dpp s GLU 402 Ca 0.36 0.49 0.06 0.00 0.36 0.00 0.00 54.97 56.24 3dpp s GLU 402 Cb 0.05 -3.35 -0.06 0.00 0.26 0.00 0.00 34.13 31.04 3dpp s GLU 402 CO 0.17 0.38 -0.05 0.95 -0.54 0.00 0.00 175.26 176.17 3dpp s THR 403 N -0.11 1.61 -0.11 -1.70 -4.23 0.15 -4.81 115.64 106.44 3dpp s THR 403 Ca 0.26 -2.11 -0.41 0.00 -1.18 0.00 0.00 61.69 58.25 3dpp s THR 403 Cb -0.16 -2.47 -0.19 0.00 1.34 0.00 0.00 72.50 71.01 3dpp s THR 403 CO 0.13 -0.28 1.28 0.80 -0.54 0.00 0.00 174.62 176.00 3dpp n MET 404 N -0.59 0.27 0.00 3.99 1.56 -1.26 -1.34 117.12 119.76 3dpp n MET 404 Ca -0.05 0.10 0.00 0.00 -0.27 0.00 0.00 57.70 57.48 3dpp n MET 404 Cb 0.64 -1.64 0.00 0.00 2.15 0.00 0.00 33.22 34.37 3dpp n MET 404 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3dpp n GLY 405 N 2.39 0.41 1.36 -5.12 0.00 -1.26 -4.31 105.19 98.67 3dpp n GLY 405 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3dpp n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpp n GLY 406 N -1.75 0.84 3.65 -0.02 0.00 -0.45 -5.00 105.19 102.45 3dpp n GLY 406 Ca 0.00 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 3dpp n GLY 406 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dpp s VAL 407 N -2.98 3.78 -0.07 1.61 0.11 -0.80 -2.15 120.40 119.89 3dpp s VAL 407 Ca 0.00 -1.08 -0.18 0.00 -2.93 0.00 0.00 61.98 57.79 3dpp s VAL 407 Cb 0.00 -2.79 -0.05 0.00 -1.53 0.00 0.00 36.38 32.02 3dpp s VAL 407 CO 0.00 0.13 0.51 -0.32 -3.33 0.00 0.00 175.10 172.08 3dpp s MET 408 N -2.24 4.28 -0.22 1.54 1.75 -0.87 -0.67 119.30 122.88 3dpp s MET 408 Ca 0.24 0.53 -0.01 0.00 -1.25 0.00 0.00 55.69 55.21 3dpp s MET 408 Cb -0.11 -3.38 0.02 0.00 2.84 0.00 0.00 34.83 34.19 3dpp s MET 408 CO 0.16 0.28 -0.11 0.99 -0.65 0.00 0.00 175.02 175.69 3dpp s THR 409 N 0.19 2.61 0.65 10.11 2.01 0.23 -4.93 115.64 126.50 3dpp s THR 409 Ca 0.27 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 61.23 3dpp s THR 409 Cb -0.16 -2.23 -0.02 0.00 0.01 0.00 0.00 72.50 70.09 3dpp s THR 409 CO 0.13 0.36 1.05 -0.89 -0.69 0.00 0.00 174.62 174.57 3dpp s THR 410 N 1.33 4.38 0.00 -0.82 2.01 -1.26 -1.83 115.64 119.44 3dpp s THR 410 Ca 0.02 0.77 0.00 0.00 0.31 0.00 0.00 61.69 62.80 3dpp s THR 410 Cb -0.15 -3.74 0.00 0.00 0.01 0.00 0.00 72.50 68.62 3dpp s THR 410 CO -0.08 -1.01 0.00 -0.11 -0.69 0.00 0.00 174.62 172.74 3dpp n LEU 411 N -2.84 0.00 -3.80 4.42 0.00 0.11 -4.89 117.00 110.00 3dpp n LEU 411 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 56.01 55.84 3dpp n LEU 411 Cb 0.55 0.00 -0.17 0.00 0.00 0.00 0.00 43.42 43.79 3dpp n LEU 411 CO 0.58 0.00 -0.39 -0.63 0.00 0.00 0.00 177.39 176.94 3dpp s ILE 412 N -1.00 0.49 0.42 1.96 1.01 0.33 -4.77 121.20 119.65 3dpp s ILE 412 Ca 0.00 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.46 3dpp s ILE 412 Cb 0.00 -0.62 -0.08 0.00 0.01 0.00 0.00 42.46 41.77 3dpp s ILE 412 CO 0.00 0.28 1.11 0.00 0.00 0.00 0.00 174.94 176.33 3dpp s ALA 413 N 1.87 3.05 0.38 9.38 0.00 -1.26 0.89 121.76 136.06 3dpp s ALA 413 Ca 0.04 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 3dpp s ALA 413 Cb -0.12 -3.33 -0.11 0.00 0.00 0.00 0.00 23.12 19.55 3dpp s ALA 413 CO -0.05 -0.44 1.19 0.36 0.00 0.00 0.00 175.76 176.83 3dpp n LYS 414 N -0.23 1.81 -1.76 0.00 2.85 -1.26 -2.39 118.16 117.17 3dpp n LYS 414 Ca 0.06 0.64 -0.08 0.00 -1.05 0.00 0.00 58.31 57.88 3dpp n LYS 414 Cb 0.49 -2.24 -0.02 0.00 -0.65 0.00 0.00 35.03 32.61 3dpp n LYS 414 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3dpp n ASN 415 N 0.55 -3.44 -4.70 -5.58 5.03 0.67 -4.87 115.26 102.92 3dpp n ASN 415 Ca 0.07 0.09 -0.42 0.00 0.87 0.00 0.00 54.58 55.19 3dpp n ASN 415 Cb 0.38 -2.28 -0.03 0.00 -1.02 0.00 0.00 39.78 36.83 3dpp n ASN 415 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3dpp s THR 416 N -2.37 4.88 0.53 3.41 2.01 -1.01 -4.83 115.64 118.26 3dpp s THR 416 Ca 0.00 1.91 -0.22 0.00 0.31 0.00 0.00 61.69 63.69 3dpp s THR 416 Cb 0.00 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 3dpp s THR 416 CO 0.00 0.13 1.35 0.42 -0.69 0.00 0.00 174.62 175.82 3dpp s THR 417 N 1.32 2.15 0.12 -0.82 -4.23 -1.26 -1.55 115.64 111.37 3dpp s THR 417 Ca 0.47 0.11 0.08 0.00 -1.18 0.00 0.00 61.69 61.18 3dpp s THR 417 Cb -0.19 -3.06 -0.04 0.00 1.34 0.00 0.00 72.50 70.55 3dpp s THR 417 CO 0.22 -0.00 -0.13 0.27 -0.54 0.00 0.00 174.62 174.44 3dpp s ILE 418 N -1.31 3.14 0.91 2.99 -4.36 -0.58 -4.43 121.20 117.56 3dpp s ILE 418 Ca 0.70 -1.42 -0.13 0.00 -0.26 0.00 0.00 60.65 59.54 3dpp s ILE 418 Cb -0.40 -2.47 0.14 0.00 1.25 0.00 0.00 42.46 40.98 3dpp s ILE 418 CO 0.47 0.07 1.15 -2.16 0.24 0.00 0.00 174.94 174.72 3dpp s PRO 419 N -2.28 1.12 -0.26 0.37 0.04 -1.26 -4.76 135.00 127.98 3dpp s PRO 419 Ca 0.21 0.21 -0.27 0.00 0.04 0.00 0.00 61.00 61.19 3dpp s PRO 419 Cb -0.11 -1.84 0.14 0.00 0.04 0.00 0.00 34.50 32.73 3dpp s PRO 419 CO 0.13 -2.19 1.14 -0.08 0.04 0.00 0.00 177.00 176.03 3dpp s THR 420 N -3.34 0.00 -0.08 1.26 -1.32 -0.93 -5.02 115.64 106.21 3dpp s THR 420 Ca 0.64 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 61.17 3dpp s THR 420 Cb -0.13 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.85 3dpp s THR 420 CO 0.53 0.00 -0.24 -0.75 -2.21 0.00 0.00 174.62 171.95 3dpp s LYS 421 N -0.23 2.78 0.01 7.08 2.20 -1.26 -1.09 119.74 129.22 3dpp s LYS 421 Ca 0.03 -0.88 -0.00 0.00 -0.36 0.00 0.00 55.97 54.77 3dpp s LYS 421 Cb -0.04 -2.20 -0.01 0.00 -1.51 0.00 0.00 37.83 34.07 3dpp s LYS 421 CO -0.07 0.27 -0.01 -1.58 -0.36 0.00 0.00 175.35 173.60 3dpp s HIS 422 N 0.12 0.10 0.05 4.03 2.46 0.55 -5.01 115.29 117.59 3dpp s HIS 422 Ca -0.12 -0.21 0.07 0.00 0.47 0.00 0.00 55.06 55.27 3dpp s HIS 422 Cb -0.16 -0.08 -0.03 0.00 -0.13 0.00 0.00 32.58 32.19 3dpp s HIS 422 CO 0.06 -0.08 -0.20 -1.12 -2.47 0.00 0.00 174.74 170.94 3dpp s SER 423 N -0.60 2.38 -0.04 9.88 0.01 -1.26 -0.49 113.70 123.58 3dpp s SER 423 Ca -0.07 -0.53 -0.08 0.00 1.31 0.00 0.00 55.95 56.59 3dpp s SER 423 Cb -0.04 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 66.02 3dpp s SER 423 CO -0.00 0.13 0.18 -1.58 0.41 0.00 0.00 173.24 172.38 3dpp s GLN 424 N -1.26 0.37 -0.01 12.44 0.74 0.18 -5.01 119.66 127.12 3dpp s GLN 424 Ca 0.07 -0.03 -0.14 0.00 0.05 0.00 0.00 55.36 55.30 3dpp s GLN 424 Cb -0.09 0.16 -0.06 0.00 1.10 0.00 0.00 33.01 34.13 3dpp s GLN 424 CO 0.02 -0.07 0.40 0.08 -0.55 0.00 0.00 175.29 175.16 3dpp s VAL 425 N -0.61 5.05 0.20 1.34 1.01 -1.26 -0.92 120.40 125.22 3dpp s VAL 425 Ca -0.07 0.81 0.03 0.00 0.00 0.00 0.00 61.98 62.75 3dpp s VAL 425 Cb -0.04 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 3dpp s VAL 425 CO 0.01 0.58 0.00 -0.36 0.00 0.00 0.00 175.10 175.33 3dpp s PHE 426 N -1.04 1.36 0.00 5.22 0.40 0.01 -4.95 117.98 118.98 3dpp s PHE 426 Ca 0.23 -0.98 0.00 0.00 -0.60 0.00 0.00 56.93 55.58 3dpp s PHE 426 Cb -0.16 -0.78 0.00 0.00 0.51 0.00 0.00 43.02 42.59 3dpp s PHE 426 CO 0.13 -0.14 0.00 0.45 0.70 0.00 0.00 175.22 176.36 3dpp n SER 427 N -0.32 1.51 -4.76 1.36 2.88 -1.26 -0.38 113.62 112.65 3dpp n SER 427 Ca -0.06 -0.10 -0.36 0.00 -1.33 0.00 0.00 58.87 57.03 3dpp n SER 427 Cb 0.63 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 64.02 3dpp n SER 427 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3dpp s THR 428 N 0.33 5.02 0.20 2.46 -4.23 -1.26 -4.94 115.64 113.21 3dpp s THR 428 Ca 0.00 0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.43 3dpp s THR 428 Cb 0.00 -3.20 0.12 0.00 1.34 0.00 0.00 72.50 70.76 3dpp s THR 428 CO 0.00 0.56 1.84 0.00 -0.54 0.00 0.00 174.62 176.48 3dpp h ALA 429 N 5.59 0.83 -1.89 3.99 0.00 -1.97 -3.02 119.26 122.79 3dpp h ALA 429 Ca -0.48 -0.03 -0.49 0.00 0.00 0.00 0.00 54.91 53.91 3dpp h ALA 429 Cb 1.20 -0.21 -0.14 0.00 0.00 0.00 0.00 17.79 18.64 3dpp h ALA 429 CO 0.62 0.17 -0.57 -1.21 0.00 0.00 0.00 179.25 178.26 3dpp s GLU 430 N -6.13 1.74 0.39 0.00 0.41 -1.26 -4.88 118.70 108.98 3dpp s GLU 430 Ca -0.13 -2.01 -0.26 0.00 -0.41 0.00 0.00 54.97 52.16 3dpp s GLU 430 Cb 0.14 -0.71 -0.09 0.00 -1.78 0.00 0.00 34.13 31.69 3dpp s GLU 430 CO 0.76 -0.31 1.27 -0.51 -0.49 0.00 0.00 175.26 175.98 3dpp s ASP 431 N -3.52 6.42 -1.27 -0.19 1.01 -1.26 -3.77 116.67 114.09 3dpp s ASP 431 Ca 0.31 2.59 -0.07 0.00 0.71 0.00 0.00 52.55 56.09 3dpp s ASP 431 Cb 0.06 -2.63 0.01 0.00 1.01 0.00 0.00 42.92 41.37 3dpp s ASP 431 CO 0.15 -0.77 1.10 0.59 0.21 0.00 0.00 175.17 176.45 3dpp n ASN 432 N 0.21 -5.37 -4.51 0.27 3.02 0.21 -4.91 115.26 104.18 3dpp n ASN 432 Ca 0.03 -0.53 -0.39 0.00 -0.03 0.00 0.00 54.58 53.66 3dpp n ASN 432 Cb 0.44 -4.86 -0.11 0.00 -0.61 0.00 0.00 39.78 34.64 3dpp n ASN 432 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3dpp s GLN 433 N -6.07 3.60 0.01 3.52 0.74 -1.25 -4.76 119.66 115.44 3dpp s GLN 433 Ca 0.45 -0.56 0.22 0.00 0.05 0.00 0.00 55.36 55.52 3dpp s GLN 433 Cb -0.20 -3.65 -0.06 0.00 1.10 0.00 0.00 33.01 30.21 3dpp s GLN 433 CO 0.70 -0.34 0.98 0.45 -0.55 0.00 0.00 175.29 176.54 3dpp n SER 434 N 5.04 0.76 -3.80 6.67 2.88 -1.26 -4.52 113.62 119.39 3dpp n SER 434 Ca -0.14 -0.65 -0.12 0.00 -1.33 0.00 0.00 58.87 56.63 3dpp n SER 434 Cb 0.50 0.91 -0.10 0.00 -0.75 0.00 0.00 64.21 64.77 3dpp n SER 434 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dpp s ALA 435 N -3.07 -0.61 0.15 -1.46 0.00 -1.26 -0.48 121.76 115.02 3dpp s ALA 435 Ca 0.07 0.34 0.06 0.00 0.00 0.00 0.00 51.96 52.42 3dpp s ALA 435 Cb 0.16 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 3dpp s ALA 435 CO 0.83 -0.20 -0.13 0.14 0.00 0.00 0.00 175.76 176.41 3dpp s VAL 436 N -0.83 1.35 -0.06 0.00 -7.23 0.26 -5.00 120.40 108.90 3dpp s VAL 436 Ca -0.09 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.15 3dpp s VAL 436 Cb -0.05 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 3dpp s VAL 436 CO 0.02 -0.57 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.31 3dpp s THR 437 N -2.72 3.89 -0.37 5.32 2.01 -1.26 0.13 115.64 122.64 3dpp s THR 437 Ca 0.14 -0.45 -0.03 0.00 0.31 0.00 0.00 61.69 61.66 3dpp s THR 437 Cb -0.01 -2.62 0.08 0.00 0.01 0.00 0.00 72.50 69.96 3dpp s THR 437 CO 0.03 0.57 0.13 -0.63 -0.69 0.00 0.00 174.62 174.03 3dpp s ILE 438 N -0.86 3.28 -0.46 1.82 -1.09 0.24 -4.96 121.20 119.16 3dpp s ILE 438 Ca 0.13 -1.73 -0.19 0.00 -2.23 0.00 0.00 60.65 56.64 3dpp s ILE 438 Cb -0.11 -3.09 0.04 0.00 -1.58 0.00 0.00 42.46 37.72 3dpp s ILE 438 CO 0.03 -0.45 0.57 -1.00 -1.23 0.00 0.00 174.94 172.86 3dpp s HIS 439 N 1.21 3.09 -0.05 3.97 3.76 -1.26 -1.75 115.29 124.26 3dpp s HIS 439 Ca 0.03 -0.38 -0.25 0.00 -0.15 0.00 0.00 55.06 54.32 3dpp s HIS 439 Cb -0.21 -3.30 -0.04 0.00 1.11 0.00 0.00 32.58 30.14 3dpp s HIS 439 CO -0.02 -0.89 0.75 0.08 -0.85 0.00 0.00 174.74 173.81 3dpp s VAL 440 N 2.52 5.00 0.08 -0.90 1.01 0.19 -2.61 120.40 125.69 3dpp s VAL 440 Ca 0.16 1.56 0.07 0.00 0.00 0.00 0.00 61.98 63.77 3dpp s VAL 440 Cb -0.17 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 3dpp s VAL 440 CO 0.14 0.24 -0.18 -0.76 0.00 0.00 0.00 175.10 174.55 3dpp s LEU 441 N 0.79 2.28 -0.16 3.92 1.43 0.24 -1.15 118.68 126.04 3dpp s LEU 441 Ca 0.40 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.88 3dpp s LEU 441 Cb -0.18 -0.72 0.01 0.00 0.03 0.00 0.00 46.19 45.33 3dpp s LEU 441 CO 0.20 0.00 -0.20 -1.58 0.23 0.00 0.00 176.35 175.00 3dpp s GLN 442 N -1.76 3.03 0.00 1.70 0.74 0.49 -2.31 119.66 121.56 3dpp s GLN 442 Ca 0.03 -0.83 0.00 0.00 0.05 0.00 0.00 55.36 54.60 3dpp s GLN 442 Cb -0.10 -2.51 0.00 0.00 1.10 0.00 0.00 33.01 31.50 3dpp s GLN 442 CO 0.03 -0.09 0.00 0.41 -0.55 0.00 0.00 175.29 175.09 3dpp n GLY 443 N 4.28 -0.24 0.00 2.59 0.00 -0.15 0.12 105.19 111.79 3dpp n GLY 443 Ca -0.20 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.26 3dpp n GLY 443 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dpp n GLU 444 N 0.00 -0.07 -3.48 1.61 -0.58 -1.26 -4.05 120.64 112.80 3dpp n GLU 444 Ca 0.00 -0.61 -0.34 0.00 -0.42 0.00 0.00 57.16 55.79 3dpp n GLU 444 Cb 0.00 -0.90 -0.05 0.00 -0.57 0.00 0.00 31.44 29.91 3dpp n GLU 444 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3dpp s ARG 445 N -0.18 3.83 0.25 3.49 1.81 -1.26 -4.90 118.95 121.99 3dpp s ARG 445 Ca 0.00 0.28 0.12 0.00 -1.72 0.00 0.00 55.73 54.41 3dpp s ARG 445 Cb 0.00 -2.92 0.21 0.00 -0.45 0.00 0.00 34.95 31.79 3dpp s ARG 445 CO 0.00 0.50 1.51 0.87 -0.68 0.00 0.00 175.30 177.50 3dpp h LYS 446 N 3.46 0.00 -6.14 3.54 1.79 -1.92 -3.42 116.57 113.88 3dpp h LYS 446 Ca -0.48 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.41 3dpp h LYS 446 Cb 1.19 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.79 3dpp h LYS 446 CO 0.67 0.66 0.72 1.03 -1.08 0.00 0.00 179.45 181.45 3dpp s ARG 447 N -3.23 4.32 0.52 3.15 0.52 -1.26 -2.04 118.95 120.92 3dpp s ARG 447 Ca 0.01 1.38 0.24 0.00 -0.52 0.00 0.00 55.73 56.83 3dpp s ARG 447 Cb 0.11 -3.61 1.40 0.00 0.52 0.00 0.00 34.95 33.37 3dpp s ARG 447 CO 0.76 -0.52 2.09 0.00 0.02 0.00 0.00 175.30 177.65 3dpp h ALA 448 N 7.35 1.48 0.00 2.13 0.00 -1.68 0.22 119.26 128.76 3dpp h ALA 448 Ca -0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3dpp h ALA 448 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3dpp h ALA 448 CO 0.94 0.13 0.00 0.00 0.00 0.00 0.00 179.25 180.32 3dpp h ALA 449 N 1.89 1.00 0.00 0.00 0.00 -1.90 -2.88 119.26 117.38 3dpp h ALA 449 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dpp h ALA 449 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3dpp h ALA 449 CO 0.01 0.00 -0.81 -0.25 0.00 0.00 0.00 179.25 178.20 3dpp n ASP 450 N -2.52 0.64 -4.96 0.00 8.00 0.78 -4.89 116.55 113.60 3dpp n ASP 450 Ca 0.03 -0.07 -0.20 0.00 0.71 0.00 0.00 54.79 55.26 3dpp n ASP 450 Cb 0.34 0.48 0.04 0.00 -0.02 0.00 0.00 41.12 41.96 3dpp n ASP 450 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3dpp s ASN 451 N -3.99 5.28 -0.17 -2.24 0.01 -1.09 -4.92 114.94 107.82 3dpp s ASN 451 Ca 0.05 -0.23 -0.20 0.00 -0.71 0.00 0.00 52.86 51.77 3dpp s ASN 451 Cb 0.14 -0.64 -0.03 0.00 0.41 0.00 0.00 41.25 41.13 3dpp s ASN 451 CO 0.76 -1.12 0.60 -0.75 -1.51 0.00 0.00 177.10 175.08 3dpp s LYS 452 N -4.68 4.26 -0.31 -0.60 2.47 0.12 -4.86 119.74 116.15 3dpp s LYS 452 Ca 0.58 0.60 -0.23 0.00 -1.56 0.00 0.00 55.97 55.35 3dpp s LYS 452 Cb -0.09 -3.53 -0.00 0.00 -1.46 0.00 0.00 37.83 32.74 3dpp s LYS 452 CO 0.37 -0.12 0.78 0.45 0.16 0.00 0.00 175.35 176.99 3dpp s SER 453 N 1.04 6.65 0.03 1.43 0.15 -1.26 0.19 113.70 121.93 3dpp s SER 453 Ca 0.29 0.65 0.22 0.00 0.70 0.00 0.00 55.95 57.81 3dpp s SER 453 Cb -0.16 -2.40 -0.09 0.00 -1.71 0.00 0.00 66.02 61.66 3dpp s SER 453 CO 0.11 -0.61 0.88 0.18 1.20 0.00 0.00 173.24 175.01 3dpp n LEU 454 N 6.18 0.55 0.00 3.45 4.77 -0.30 -4.94 117.00 126.71 3dpp n LEU 454 Ca 0.03 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 3dpp n LEU 454 Cb 0.48 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3dpp n LEU 454 CO 0.50 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3dpp n GLY 455 N 1.35 0.23 3.63 -0.72 0.00 -1.16 -4.99 105.19 103.53 3dpp n GLY 455 Ca 0.01 -1.67 -0.03 0.00 0.00 0.00 0.00 46.02 44.33 3dpp n GLY 455 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3dpp s GLN 456 N -2.00 0.13 0.24 1.61 -2.07 -1.26 0.54 119.66 116.84 3dpp s GLN 456 Ca 0.00 0.01 -0.16 0.00 -1.82 0.00 0.00 55.36 53.39 3dpp s GLN 456 Cb 0.00 0.06 0.01 0.00 -1.09 0.00 0.00 33.01 31.99 3dpp s GLN 456 CO 0.00 -0.04 0.55 -0.59 -1.32 0.00 0.00 175.29 173.89 3dpp s PHE 457 N -1.27 0.06 0.06 9.60 -0.71 -0.72 -5.00 117.98 119.99 3dpp s PHE 457 Ca 0.08 -0.44 0.04 0.00 -1.04 0.00 0.00 56.93 55.58 3dpp s PHE 457 Cb -0.01 0.39 -0.04 0.00 -1.21 0.00 0.00 43.02 42.15 3dpp s PHE 457 CO -0.06 -1.02 -0.02 -0.80 -1.34 0.00 0.00 175.22 171.97 3dpp s ASN 458 N -2.94 4.90 -0.26 1.98 0.02 -1.26 -0.59 114.94 116.78 3dpp s ASN 458 Ca 0.15 -0.16 -0.01 0.00 -1.02 0.00 0.00 52.86 51.82 3dpp s ASN 458 Cb -0.02 -1.16 0.04 0.00 0.02 0.00 0.00 41.25 40.13 3dpp s ASN 458 CO 0.04 0.21 -0.06 -0.22 0.02 0.00 0.00 177.10 177.09 3dpp s LEU 459 N -1.99 3.38 0.51 0.60 2.96 0.12 -4.86 118.68 119.40 3dpp s LEU 459 Ca 0.23 -1.08 0.05 0.00 -0.22 0.00 0.00 54.13 53.10 3dpp s LEU 459 Cb -0.11 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.94 3dpp s LEU 459 CO 0.14 -0.17 0.26 -1.81 -1.32 0.00 0.00 176.35 173.46 3dpp s ASP 460 N 1.25 4.48 -0.06 3.68 -0.00 -1.26 -0.57 116.67 124.19 3dpp s ASP 460 Ca -0.03 -1.33 0.00 0.00 -0.00 0.00 0.00 52.55 51.19 3dpp s ASP 460 Cb -0.18 0.31 0.00 0.00 -0.00 0.00 0.00 42.92 43.05 3dpp s ASP 460 CO -0.04 -0.95 0.00 0.61 -0.00 0.00 0.00 175.17 174.79 3dpp n GLY 461 N -1.55 0.47 3.73 0.21 0.00 -1.12 -4.86 105.19 102.06 3dpp n GLY 461 Ca -0.06 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3dpp n GLY 461 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dpp s ILE 462 N -1.92 3.14 -0.03 -0.61 1.01 0.36 -4.89 121.20 118.27 3dpp s ILE 462 Ca 0.00 0.88 -0.30 0.00 0.00 0.00 0.00 60.65 61.23 3dpp s ILE 462 Cb 0.00 -3.56 -0.07 0.00 0.01 0.00 0.00 42.46 38.84 3dpp s ILE 462 CO 0.00 0.10 1.87 0.21 0.00 0.00 0.00 174.94 177.13 3dpp s ASN 463 N 0.72 6.42 -0.39 3.58 3.04 -1.26 -4.19 114.94 122.86 3dpp s ASN 463 Ca 0.61 2.40 -0.31 0.00 0.04 0.00 0.00 52.86 55.60 3dpp s ASN 463 Cb -0.38 -2.53 -0.10 0.00 -1.54 0.00 0.00 41.25 36.71 3dpp s ASN 463 CO 0.35 -1.12 2.29 -2.65 -3.04 0.00 0.00 177.10 172.93 3dpp n PRO 464 N 7.54 1.23 -4.43 0.43 -0.02 -1.26 -4.80 135.00 133.70 3dpp n PRO 464 Ca 0.20 0.28 -0.21 0.00 -2.02 0.00 0.00 63.50 61.74 3dpp n PRO 464 Cb 0.42 -2.81 -0.10 0.00 -0.02 0.00 0.00 33.50 31.00 3dpp n PRO 464 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dpp s ALA 465 N 8.73 2.32 0.77 3.55 0.00 -1.26 -4.79 121.76 131.08 3dpp s ALA 465 Ca 1.07 -1.82 -0.13 0.00 0.00 0.00 0.00 51.96 51.07 3dpp s ALA 465 Cb -0.60 0.79 0.06 0.00 0.00 0.00 0.00 23.12 23.37 3dpp s ALA 465 CO 0.41 -0.36 1.17 -2.14 0.00 0.00 0.00 175.76 174.84 3dpp s PRO 466 N -3.88 1.99 0.20 0.00 0.02 -1.26 -0.61 135.00 131.46 3dpp s PRO 466 Ca 0.34 1.61 -0.32 0.00 0.02 0.00 0.00 61.00 62.65 3dpp s PRO 466 Cb 0.07 -1.83 -0.11 0.00 0.02 0.00 0.00 34.50 32.65 3dpp s PRO 466 CO 0.15 -1.92 1.65 -0.98 -0.33 0.00 0.00 177.00 175.57 3dpp s ARG 467 N -4.20 4.16 0.00 5.54 1.70 -1.25 -2.27 118.95 122.64 3dpp s ARG 467 Ca 0.70 2.51 0.00 0.00 -0.47 0.00 0.00 55.73 58.48 3dpp s ARG 467 Cb -0.25 -3.10 0.00 0.00 -0.57 0.00 0.00 34.95 31.03 3dpp s ARG 467 CO 0.49 -0.68 0.00 0.41 -1.08 0.00 0.00 175.30 174.44 3dpp n GLY 468 N 3.65 1.35 0.13 3.88 0.00 -1.14 -4.93 105.19 108.13 3dpp n GLY 468 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3dpp n GLY 468 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3dpp h MET 469 N 3.58 -0.19 -7.11 1.61 4.05 -1.78 -3.46 114.93 111.64 3dpp h MET 469 Ca 0.00 0.01 -0.54 0.00 -0.28 0.00 0.00 59.70 58.89 3dpp h MET 469 Cb 0.00 0.04 0.13 0.00 -0.80 0.00 0.00 31.60 30.98 3dpp h MET 469 CO 0.00 0.22 0.47 -2.14 0.23 0.00 0.00 176.91 175.70 3dpp s PRO 470 N -3.02 2.72 -0.47 0.39 0.02 -1.26 -4.96 135.00 128.43 3dpp s PRO 470 Ca -0.11 1.89 0.00 0.00 0.02 0.00 0.00 61.00 62.80 3dpp s PRO 470 Cb 0.00 -1.89 0.12 0.00 0.02 0.00 0.00 34.50 32.76 3dpp s PRO 470 CO 0.41 -1.42 0.23 -0.65 -0.33 0.00 0.00 177.00 175.24 3dpp s GLN 471 N -3.44 2.00 -0.51 5.54 -0.21 -1.26 -4.15 119.66 117.62 3dpp s GLN 471 Ca 0.79 -2.17 -0.15 0.00 0.02 0.00 0.00 55.36 53.84 3dpp s GLN 471 Cb -0.32 -3.47 0.11 0.00 1.00 0.00 0.00 33.01 30.33 3dpp s GLN 471 CO 0.37 -1.07 0.45 0.42 -2.12 0.00 0.00 175.29 173.34 3dpp s ILE 472 N 0.50 5.14 -0.29 1.08 -1.09 0.49 -0.01 121.20 127.01 3dpp s ILE 472 Ca 0.13 -1.37 -0.27 0.00 -2.23 0.00 0.00 60.65 56.91 3dpp s ILE 472 Cb -0.22 -4.22 0.01 0.00 -1.58 0.00 0.00 42.46 36.45 3dpp s ILE 472 CO -0.04 -0.76 0.96 -0.70 -1.23 0.00 0.00 174.94 173.17 3dpp s GLU 473 N 1.60 4.08 -0.12 2.79 2.56 0.16 -0.81 118.70 128.95 3dpp s GLU 473 Ca 0.03 0.97 -0.03 0.00 0.00 0.00 0.00 54.97 55.94 3dpp s GLU 473 Cb -0.28 -3.71 -0.03 0.00 2.00 0.00 0.00 34.13 32.11 3dpp s GLU 473 CO 0.04 -0.75 -0.03 0.08 -0.56 0.00 0.00 175.26 174.04 3dpp s VAL 474 N 3.29 4.03 -0.07 3.70 1.01 -0.09 -0.01 120.40 132.26 3dpp s VAL 474 Ca 0.40 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.06 3dpp s VAL 474 Cb -0.14 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.53 3dpp s VAL 474 CO 0.12 0.54 -0.08 -0.89 0.00 0.00 0.00 175.10 174.79 3dpp s THR 475 N -0.17 0.86 -0.20 3.92 2.01 0.98 -0.65 115.64 122.40 3dpp s THR 475 Ca 0.04 -0.28 -0.07 0.00 0.31 0.00 0.00 61.69 61.69 3dpp s THR 475 Cb -0.13 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 3dpp s THR 475 CO 0.02 0.31 0.05 -0.36 -0.69 0.00 0.00 174.62 173.96 3dpp s PHE 476 N 1.07 3.17 -0.05 4.92 0.40 0.35 -1.08 117.98 126.77 3dpp s PHE 476 Ca -0.08 -0.11 -0.01 0.00 -0.60 0.00 0.00 56.93 56.13 3dpp s PHE 476 Cb -0.14 -2.12 0.03 0.00 0.51 0.00 0.00 43.02 41.30 3dpp s PHE 476 CO -0.01 -0.02 0.01 0.34 0.70 0.00 0.00 175.22 176.24 3dpp s ASP 477 N 0.76 1.04 -0.23 1.36 3.68 -0.59 -0.33 116.67 122.36 3dpp s ASP 477 Ca 0.03 -0.04 -0.04 0.00 2.13 0.00 0.00 52.55 54.63 3dpp s ASP 477 Cb -0.14 -0.31 -0.01 0.00 -1.45 0.00 0.00 42.92 41.02 3dpp s ASP 477 CO 0.02 -0.16 -0.02 -0.63 0.13 0.00 0.00 175.17 174.51 3dpp s ILE 478 N 1.58 3.52 0.00 4.11 1.01 -0.25 -0.44 121.20 130.72 3dpp s ILE 478 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.17 3dpp s ILE 478 Cb -0.13 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.72 3dpp s ILE 478 CO -0.03 0.39 0.00 -0.90 0.00 0.00 0.00 174.94 174.40 3dpp n ASP 479 N 4.82 -0.14 0.16 3.58 5.68 -0.26 -2.18 116.55 128.19 3dpp n ASP 479 Ca -0.18 -0.81 0.06 0.00 -0.50 0.00 0.00 54.79 53.36 3dpp n ASP 479 Cb 0.51 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.55 3dpp n ASP 479 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dpp h ALA 480 N -2.00 0.76 -0.67 2.12 0.00 -1.93 -2.65 119.26 114.89 3dpp h ALA 480 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3dpp h ALA 480 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3dpp h ALA 480 CO 0.00 0.43 0.00 -0.25 0.00 0.00 0.00 179.25 179.43 3dpp n ASP 481 N -3.15 3.77 0.00 0.00 8.00 -1.26 -4.86 116.55 119.05 3dpp n ASP 481 Ca 0.02 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.52 3dpp n ASP 481 Cb 0.67 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 3dpp n ASP 481 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dpp n GLY 482 N 1.62 0.82 3.70 0.44 0.00 -1.00 -4.72 105.19 106.06 3dpp n GLY 482 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 3dpp n GLY 482 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dpp s ILE 483 N -3.17 2.95 -0.18 -0.61 1.01 -1.26 -3.66 121.20 116.29 3dpp s ILE 483 Ca 0.00 0.56 -0.04 0.00 0.00 0.00 0.00 60.65 61.16 3dpp s ILE 483 Cb 0.00 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.09 3dpp s ILE 483 CO 0.00 0.02 -0.02 -0.22 0.00 0.00 0.00 174.94 174.72 3dpp s LEU 484 N 1.90 3.22 -0.14 2.97 2.96 0.69 -1.11 118.68 129.17 3dpp s LEU 484 Ca 0.71 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 54.46 3dpp s LEU 484 Cb -0.40 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.49 3dpp s LEU 484 CO 0.31 0.11 -0.20 -1.00 -1.32 0.00 0.00 176.35 174.26 3dpp s HIS 485 N 0.71 2.70 -0.20 5.38 3.76 0.41 0.12 115.29 128.18 3dpp s HIS 485 Ca -0.01 -1.20 0.01 0.00 -0.15 0.00 0.00 55.06 53.71 3dpp s HIS 485 Cb -0.14 -1.83 0.03 0.00 1.11 0.00 0.00 32.58 31.75 3dpp s HIS 485 CO 0.02 -0.54 -0.16 0.08 -0.85 0.00 0.00 174.74 173.29 3dpp s VAL 486 N 0.76 1.99 0.13 -0.90 1.01 -0.34 -1.53 120.40 121.51 3dpp s VAL 486 Ca -0.08 -1.08 0.09 0.00 0.00 0.00 0.00 61.98 60.92 3dpp s VAL 486 Cb -0.16 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 3dpp s VAL 486 CO -0.00 0.36 -0.19 -0.94 0.00 0.00 0.00 175.10 174.32 3dpp s SER 487 N 1.28 3.79 -0.06 3.32 1.04 -0.24 -1.57 113.70 121.26 3dpp s SER 487 Ca 0.01 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.83 3dpp s SER 487 Cb -0.15 -0.49 0.02 0.00 0.10 0.00 0.00 66.02 65.51 3dpp s SER 487 CO -0.10 0.17 -0.04 0.00 0.98 0.00 0.00 173.24 174.25 3dpp s ALA 488 N -1.19 0.80 -0.08 5.32 0.00 -0.62 -0.01 121.76 125.97 3dpp s ALA 488 Ca 0.18 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.99 3dpp s ALA 488 Cb -0.10 -0.59 0.02 0.00 0.00 0.00 0.00 23.12 22.45 3dpp s ALA 488 CO 0.10 -0.19 -0.08 0.21 0.00 0.00 0.00 175.76 175.80 3dpp s LYS 489 N 1.32 1.37 -0.46 0.00 2.20 0.99 -1.66 119.74 123.50 3dpp s LYS 489 Ca -0.05 -0.24 -0.29 0.00 -0.36 0.00 0.00 55.97 55.03 3dpp s LYS 489 Cb -0.14 -1.34 0.03 0.00 -1.51 0.00 0.00 37.83 34.87 3dpp s LYS 489 CO -0.02 -0.14 1.13 0.34 -0.36 0.00 0.00 175.35 176.29 3dpp s ASP 490 N 1.26 6.67 0.35 1.43 2.15 -0.27 0.37 116.67 128.63 3dpp s ASP 490 Ca -0.04 0.54 0.02 0.00 0.43 0.00 0.00 52.55 53.49 3dpp s ASP 490 Cb -0.14 -2.55 0.62 0.00 -0.30 0.00 0.00 42.92 40.56 3dpp s ASP 490 CO -0.03 -1.20 2.00 0.11 -0.17 0.00 0.00 175.17 175.88 3dpp h LYS 491 N 9.08 0.86 0.00 4.34 1.57 -0.75 0.44 116.57 132.10 3dpp h LYS 491 Ca -0.23 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 3dpp h LYS 491 Cb 1.06 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.18 3dpp h LYS 491 CO 1.11 0.57 0.00 -1.71 -0.57 0.00 0.00 179.45 178.85 3dpp n ASN 492 N -4.44 0.00 0.13 0.86 5.15 -1.26 -3.90 115.26 111.80 3dpp n ASN 492 Ca 0.07 0.72 0.11 0.00 -0.60 0.00 0.00 54.58 54.88 3dpp n ASN 492 Cb 0.06 -0.33 0.61 0.00 -0.53 0.00 0.00 39.78 39.58 3dpp n ASN 492 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 3dpp h SER 493 N 0.00 0.10 0.00 1.20 4.64 -1.89 -3.46 113.55 114.14 3dpp h SER 493 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dpp h SER 493 Cb 0.00 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3dpp h SER 493 CO 0.00 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 3dpp n GLY 494 N -1.55 0.95 3.72 -0.77 0.00 0.15 -5.00 105.19 102.69 3dpp n GLY 494 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3dpp n GLY 494 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dpp n LYS 495 N -2.07 2.73 -4.17 1.61 4.76 -1.24 -4.77 118.16 115.01 3dpp n LYS 495 Ca 0.00 0.98 -0.16 0.00 -2.87 0.00 0.00 58.31 56.27 3dpp n LYS 495 Cb 0.00 -2.81 -0.13 0.00 -1.84 0.00 0.00 35.03 30.25 3dpp n LYS 495 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3dpp s GLU 496 N 0.74 0.57 0.17 1.97 2.12 -1.26 -1.11 118.70 121.89 3dpp s GLU 496 Ca 0.72 -0.50 -0.08 0.00 0.36 0.00 0.00 54.97 55.47 3dpp s GLU 496 Cb -0.51 -0.48 -0.01 0.00 0.26 0.00 0.00 34.13 33.39 3dpp s GLU 496 CO 0.37 0.12 0.27 -1.14 -0.54 0.00 0.00 175.26 174.33 3dpp s GLN 497 N -0.83 1.15 -0.07 4.30 2.00 -0.66 -5.03 119.66 120.53 3dpp s GLN 497 Ca -0.02 -1.21 -0.23 0.00 -2.00 0.00 0.00 55.36 51.90 3dpp s GLN 497 Cb -0.06 0.37 0.05 0.00 0.80 0.00 0.00 33.01 34.17 3dpp s GLN 497 CO 0.00 -0.42 0.52 0.15 -0.50 0.00 0.00 175.29 175.04 3dpp s LYS 498 N -3.98 0.83 -0.04 1.67 1.02 -1.26 -1.59 119.74 116.38 3dpp s LYS 498 Ca 0.19 0.21 -0.08 0.00 0.02 0.00 0.00 55.97 56.31 3dpp s LYS 498 Cb 0.04 0.38 0.01 0.00 -0.52 0.00 0.00 37.83 37.74 3dpp s LYS 498 CO 0.01 -0.22 0.18 -1.50 -0.92 0.00 0.00 175.35 172.90 3dpp s ILE 499 N -0.91 0.04 -0.12 2.17 2.07 -0.61 -5.01 121.20 118.83 3dpp s ILE 499 Ca -0.09 -0.33 0.01 0.00 -1.41 0.00 0.00 60.65 58.83 3dpp s ILE 499 Cb -0.03 -0.38 -0.01 0.00 0.13 0.00 0.00 42.46 42.18 3dpp s ILE 499 CO 0.06 -0.18 -0.15 -0.89 -1.91 0.00 0.00 174.94 171.87 3dpp s THR 500 N -0.64 2.85 -0.12 4.00 2.01 -1.26 -1.20 115.64 121.28 3dpp s THR 500 Ca -0.07 -0.74 0.01 0.00 0.31 0.00 0.00 61.69 61.20 3dpp s THR 500 Cb -0.04 -2.17 0.02 0.00 0.01 0.00 0.00 72.50 70.31 3dpp s THR 500 CO 0.01 0.53 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.71 3dpp s ILE 501 N 0.31 1.44 0.20 1.82 1.01 0.32 -4.98 121.20 121.32 3dpp s ILE 501 Ca -0.12 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 3dpp s ILE 501 Cb -0.16 -1.34 -0.09 0.00 0.01 0.00 0.00 42.46 40.87 3dpp s ILE 501 CO 0.06 0.43 1.42 -0.54 0.00 0.00 0.00 174.94 176.31 3dpp s LYS 502 N 1.20 4.30 0.61 2.79 1.02 -1.26 -0.22 119.74 128.18 3dpp s LYS 502 Ca -0.02 2.21 0.27 0.00 0.02 0.00 0.00 55.97 58.45 3dpp s LYS 502 Cb -0.14 -3.16 1.31 0.00 -0.52 0.00 0.00 37.83 35.32 3dpp s LYS 502 CO -0.05 -0.41 1.73 0.00 -0.92 0.00 0.00 175.35 175.71 3dpp h ALA 503 N 5.65 2.16 -0.00 5.17 0.00 -1.84 0.39 119.26 130.78 3dpp h ALA 503 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3dpp h ALA 503 Cb 1.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3dpp h ALA 503 CO 0.81 -0.86 -0.46 -1.13 0.00 0.00 0.00 179.25 177.61 3dpp n SER 504 N -3.39 0.60 -4.60 0.00 3.41 -1.26 -4.88 113.62 103.51 3dpp n SER 504 Ca 0.09 -0.38 -0.28 0.00 -0.26 0.00 0.00 58.87 58.04 3dpp n SER 504 Cb 0.80 0.24 0.20 0.00 -0.26 0.00 0.00 64.21 65.19 3dpp n SER 504 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3dpp s SER 505 N -2.91 1.99 0.00 4.04 0.01 0.14 -4.84 113.70 112.13 3dpp s SER 505 Ca 0.13 1.23 0.00 0.00 1.31 0.00 0.00 55.95 58.62 3dpp s SER 505 Cb 0.18 -1.93 0.00 0.00 0.21 0.00 0.00 66.02 64.48 3dpp s SER 505 CO 0.67 -3.53 0.00 0.61 0.41 0.00 0.00 173.24 171.40 3dpp n GLY 506 N -0.54 -0.28 3.87 3.44 0.00 -1.26 -4.96 105.19 105.46 3dpp n GLY 506 Ca 0.04 -1.26 -0.37 0.00 0.00 0.00 0.00 46.02 44.44 3dpp n GLY 506 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dpp s LEU 507 N 0.00 4.38 0.00 0.99 1.43 -1.26 -5.09 118.68 119.13 3dpp s LEU 507 Ca 0.00 0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 3dpp s LEU 507 Cb 0.00 -2.10 0.15 0.00 0.03 0.00 0.00 46.19 44.27 3dpp s LEU 507 CO 0.00 0.39 0.82 -0.46 0.23 0.00 0.00 176.35 177.32 3dpp n ASN 508 N 2.09 -0.15 -0.11 2.29 0.23 -1.26 -4.74 115.26 113.61 3dpp n ASN 508 Ca -0.19 -1.25 -0.12 0.00 -0.53 0.00 0.00 54.58 52.48 3dpp n ASN 508 Cb 0.55 -0.64 -0.03 0.00 -2.08 0.00 0.00 39.78 37.58 3dpp n ASN 508 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3dpp h GLU 509 N 0.00 0.66 -0.28 -3.83 5.08 -1.98 0.67 114.58 114.89 3dpp h GLU 509 Ca -0.27 -0.28 0.01 0.00 -1.00 0.00 0.00 59.36 57.82 3dpp h GLU 509 Cb 0.75 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 3dpp h GLU 509 CO 0.19 0.87 0.18 0.22 -1.00 0.00 0.00 179.01 179.46 3dpp h ASP 510 N 0.43 0.30 0.14 1.42 3.58 -2.00 0.13 116.42 120.42 3dpp h ASP 510 Ca 0.07 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 3dpp h ASP 510 Cb 0.66 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 3dpp h ASP 510 CO 0.04 0.22 -0.24 -0.33 -2.88 0.00 0.00 179.24 176.05 3dpp h GLU 511 N 0.36 0.18 -0.06 0.28 5.08 -1.82 -2.03 114.58 116.57 3dpp h GLU 511 Ca 0.11 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3dpp h GLU 511 Cb -0.02 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 3dpp h GLU 511 CO -0.04 0.41 -0.03 0.82 -1.00 0.00 0.00 179.01 179.17 3dpp h ILE 512 N 0.17 1.33 -0.37 3.13 2.04 0.19 -1.32 117.51 122.68 3dpp h ILE 512 Ca 0.03 -1.06 0.06 0.00 1.00 0.00 0.00 64.86 64.89 3dpp h ILE 512 Cb 0.51 1.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 3dpp h ILE 512 CO 0.04 0.29 0.07 1.56 0.00 0.00 0.00 178.15 180.10 3dpp h GLN 513 N -0.26 0.18 0.20 2.37 4.20 -0.65 -2.41 115.11 118.74 3dpp h GLN 513 Ca 0.01 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 3dpp h GLN 513 Cb 0.48 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.22 3dpp h GLN 513 CO 0.01 0.12 -0.09 0.87 -0.67 0.00 0.00 178.83 179.07 3dpp h LYS 514 N 0.19 -0.25 -0.86 1.46 1.57 -1.18 0.52 116.57 118.01 3dpp h LYS 514 Ca 0.18 0.02 0.19 0.00 -1.87 0.00 0.00 60.65 59.17 3dpp h LYS 514 Cb 0.21 0.06 -0.16 0.00 0.08 0.00 0.00 32.23 32.42 3dpp h LYS 514 CO -0.24 -0.10 -0.11 1.98 -0.57 0.00 0.00 179.45 180.41 3dpp h MET 515 N -0.35 0.03 -0.16 3.15 4.05 -0.93 0.92 114.93 121.64 3dpp h MET 515 Ca -0.03 -0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.23 3dpp h MET 515 Cb 0.27 -0.01 0.01 0.00 -0.80 0.00 0.00 31.60 31.07 3dpp h MET 515 CO 0.04 0.02 -0.53 0.28 0.23 0.00 0.00 176.91 176.95 3dpp h VAL 516 N 0.03 1.33 -0.42 -5.77 2.07 -0.86 0.36 116.25 112.98 3dpp h VAL 516 Ca 0.45 -1.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 3dpp h VAL 516 Cb 0.78 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 3dpp h VAL 516 CO -0.84 0.55 0.23 0.03 0.02 0.00 0.00 177.57 177.56 3dpp h ARG 517 N 0.30 0.59 -0.39 1.57 3.08 0.46 -2.33 114.38 117.66 3dpp h ARG 517 Ca -0.02 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 3dpp h ARG 517 Cb 1.15 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 3dpp h ARG 517 CO 0.11 0.48 -0.11 -0.44 -1.07 0.00 0.00 179.97 178.95 3dpp h ASP 518 N 0.55 0.67 0.04 7.04 5.19 0.15 -1.62 116.42 128.44 3dpp h ASP 518 Ca 0.15 -0.19 -0.00 0.00 -0.62 0.00 0.00 57.03 56.37 3dpp h ASP 518 Cb 0.07 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.40 3dpp h ASP 518 CO -0.02 0.81 -0.02 0.00 -3.12 0.00 0.00 179.24 176.89 3dpp h ALA 519 N 1.26 -0.06 -0.61 3.45 0.00 -0.01 -1.90 119.26 121.40 3dpp h ALA 519 Ca 0.11 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.92 3dpp h ALA 519 Cb 0.55 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 3dpp h ALA 519 CO 0.03 -0.33 0.19 0.93 0.00 0.00 0.00 179.25 180.07 3dpp h GLU 520 N -0.46 0.34 0.00 0.00 3.07 -1.29 -2.31 114.58 113.93 3dpp h GLU 520 Ca -0.01 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 3dpp h GLU 520 Cb 0.42 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3dpp h GLU 520 CO 0.01 0.22 -0.26 0.00 -1.40 0.00 0.00 179.01 177.59 3dpp h ALA 521 N 1.44 1.10 -0.29 3.43 0.00 -0.95 -2.70 119.26 121.29 3dpp h ALA 521 Ca 0.31 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3dpp h ALA 521 Cb 0.42 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 3dpp h ALA 521 CO -0.35 0.32 -0.12 0.09 0.00 0.00 0.00 179.25 179.20 3dpp n ASN 522 N -3.54 2.53 0.06 0.00 3.02 -0.74 -4.76 115.26 111.84 3dpp n ASN 522 Ca -0.01 -3.68 -0.13 0.00 -0.03 0.00 0.00 54.58 50.74 3dpp n ASN 522 Cb 0.41 -0.61 -0.08 0.00 -0.61 0.00 0.00 39.78 38.89 3dpp n ASN 522 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dpp h ALA 523 N 1.04 -0.09 -0.76 5.41 0.00 -1.08 -1.44 119.26 122.35 3dpp h ALA 523 Ca 0.16 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.12 3dpp h ALA 523 Cb 1.53 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 19.27 3dpp h ALA 523 CO 0.31 -0.49 0.35 1.05 0.00 0.00 0.00 179.25 180.47 3dpp h GLU 524 N -0.21 0.52 0.00 0.00 4.11 -1.85 -0.81 114.58 116.34 3dpp h GLU 524 Ca -0.01 -0.03 -0.11 0.00 0.07 0.00 0.00 59.36 59.27 3dpp h GLU 524 Cb 0.18 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3dpp h GLU 524 CO 0.02 0.35 -0.55 0.00 0.07 0.00 0.00 179.01 178.89 3dpp h ALA 525 N 1.51 0.85 0.07 1.06 0.00 -1.78 -0.00 119.26 120.97 3dpp h ALA 525 Ca 0.40 -0.50 -0.26 0.00 0.00 0.00 0.00 54.91 54.55 3dpp h ALA 525 Cb 0.54 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.26 3dpp h ALA 525 CO -0.35 0.68 -1.12 -0.44 0.00 0.00 0.00 179.25 178.02 3dpp h ASP 526 N 0.00 0.63 0.55 0.00 5.19 -0.60 -0.89 116.42 121.31 3dpp h ASP 526 Ca -0.01 -0.57 -0.03 0.00 -0.62 0.00 0.00 57.03 55.81 3dpp h ASP 526 Cb 1.14 -0.20 0.01 0.00 0.18 0.00 0.00 39.33 40.46 3dpp h ASP 526 CO 0.07 1.39 -0.27 -0.09 -3.12 0.00 0.00 179.24 177.23 3dpp h ARG 527 N 0.21 -0.72 -0.90 3.56 2.43 -0.95 -1.80 114.38 116.21 3dpp h ARG 527 Ca -0.13 0.05 0.24 0.00 -0.81 0.00 0.00 59.98 59.33 3dpp h ARG 527 Cb 1.79 0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 31.46 3dpp h ARG 527 CO 0.20 -0.44 0.63 0.87 -1.51 0.00 0.00 179.97 179.72 3dpp h LYS 528 N -0.85 0.12 -0.02 0.20 1.57 -0.90 -1.89 116.57 114.81 3dpp h LYS 528 Ca -0.08 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 3dpp h LYS 528 Cb 0.61 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3dpp h LYS 528 CO 0.12 0.08 -0.17 0.35 -0.57 0.00 0.00 179.45 179.27 3dpp h PHE 529 N 0.12 0.20 -0.53 -1.35 3.57 -0.78 -1.63 116.94 116.55 3dpp h PHE 529 Ca 0.44 -0.10 0.10 0.00 3.53 0.00 0.00 57.97 61.94 3dpp h PHE 529 Cb 1.55 -0.03 -0.08 0.00 2.79 0.00 0.00 35.95 40.19 3dpp h PHE 529 CO -0.00 0.85 0.07 1.49 -2.23 0.00 0.00 178.31 178.48 3dpp h GLU 530 N -0.51 0.19 -0.32 1.11 4.81 -0.56 0.55 114.58 119.84 3dpp h GLU 530 Ca -0.02 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.09 3dpp h GLU 530 Cb 0.88 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 3dpp h GLU 530 CO 0.03 0.13 -0.25 0.93 -0.73 0.00 0.00 179.01 179.12 3dpp h GLU 531 N 0.20 0.74 -0.66 1.92 5.08 -1.47 -0.92 114.58 119.47 3dpp h GLU 531 Ca 0.27 -0.36 0.14 0.00 -1.00 0.00 0.00 59.36 58.40 3dpp h GLU 531 Cb 0.39 -0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.52 3dpp h GLU 531 CO -0.38 0.98 -0.03 1.25 -1.00 0.00 0.00 179.01 179.83 3dpp h LEU 532 N 0.51 -0.35 -0.25 1.33 5.85 -0.22 0.12 115.31 122.30 3dpp h LEU 532 Ca 0.06 0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.90 3dpp h LEU 532 Cb 0.81 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 3dpp h LEU 532 CO 0.07 -0.15 -0.03 0.58 -0.34 0.00 0.00 178.44 178.56 3dpp h VAL 533 N 0.09 1.27 -0.74 1.05 2.07 -0.73 0.50 116.25 119.76 3dpp h VAL 533 Ca 0.34 -1.00 0.15 0.00 0.82 0.00 0.00 66.70 67.01 3dpp h VAL 533 Cb 0.57 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 3dpp h VAL 533 CO -0.59 0.31 0.49 -0.61 0.02 0.00 0.00 177.57 177.20 3dpp h GLN 534 N 0.22 0.36 0.13 1.57 4.15 0.47 0.45 115.11 122.46 3dpp h GLN 534 Ca 0.07 -0.02 -0.28 0.00 0.77 0.00 0.00 58.65 59.18 3dpp h GLN 534 Cb 0.48 -0.08 0.02 0.00 0.21 0.00 0.00 27.48 28.11 3dpp h GLN 534 CO 0.02 0.24 -1.24 1.15 -1.93 0.00 0.00 178.83 177.07 3dpp h THR 535 N 0.37 1.39 -0.30 2.39 2.02 -0.27 -3.02 112.91 115.49 3dpp h THR 535 Ca 0.36 -2.74 -0.06 0.00 0.77 0.00 0.00 66.41 64.74 3dpp h THR 535 Cb 0.87 2.81 -0.02 0.00 -1.74 0.00 0.00 68.15 70.08 3dpp h THR 535 CO -0.11 0.81 -0.08 0.03 0.37 0.00 0.00 175.52 176.55 3dpp h ARG 536 N 0.17 0.49 0.02 6.66 3.08 0.20 -2.51 114.38 122.49 3dpp h ARG 536 Ca -0.16 -0.12 -0.21 0.00 0.07 0.00 0.00 59.98 59.55 3dpp h ARG 536 Cb 1.93 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.90 3dpp h ARG 536 CO 0.22 0.58 -1.00 -0.91 -1.07 0.00 0.00 179.97 177.79 3dpp h ASN 537 N 0.46 0.11 0.56 7.04 2.35 -0.85 -0.52 115.58 124.73 3dpp h ASN 537 Ca 0.09 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.67 3dpp h ASN 537 Cb 0.42 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 3dpp h ASN 537 CO 0.02 1.04 -0.30 1.56 -1.65 0.00 0.00 177.43 178.10 3dpp h GLN 538 N 0.03 0.00 0.05 0.81 4.20 -1.33 -2.38 115.11 116.49 3dpp h GLN 538 Ca -0.04 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.41 3dpp h GLN 538 Cb 1.72 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.48 3dpp h GLN 538 CO 0.14 0.30 -1.39 0.78 -0.67 0.00 0.00 178.83 178.00 3dpp h GLY 539 N 1.42 0.13 -0.21 3.46 0.00 -1.23 -0.87 103.07 105.77 3dpp h GLY 539 Ca -0.00 -0.34 0.21 0.00 0.00 0.00 0.00 47.33 47.20 3dpp h GLY 539 CO 0.04 0.29 0.34 -1.80 0.00 0.00 0.00 176.54 175.42 3dpp h ASP 540 N -0.60 0.25 -0.07 0.19 3.58 -1.10 0.12 116.42 118.78 3dpp h ASP 540 Ca -0.34 0.16 -0.18 0.00 0.42 0.00 0.00 57.03 57.09 3dpp h ASP 540 Cb 1.55 0.16 0.01 0.00 1.72 0.00 0.00 39.33 42.77 3dpp h ASP 540 CO -0.07 -0.02 -0.67 0.45 -2.88 0.00 0.00 179.24 176.04 3dpp h HIS 541 N 0.36 0.82 0.00 0.28 3.86 -1.42 -1.63 115.15 117.43 3dpp h HIS 541 Ca 0.54 -0.39 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3dpp h HIS 541 Cb 1.01 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.37 3dpp h HIS 541 CO -0.17 1.20 -0.01 1.25 0.86 0.00 0.00 177.93 181.06 3dpp h LEU 542 N 0.20 0.00 0.15 2.43 5.85 0.18 -1.13 115.31 122.99 3dpp h LEU 542 Ca -0.06 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 3dpp h LEU 542 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 3dpp h LEU 542 CO 0.14 0.01 -0.07 0.25 -0.34 0.00 0.00 178.44 178.43 3dpp h LEU 543 N 0.00 -0.17 -1.54 2.25 5.85 0.13 0.46 115.31 122.30 3dpp h LEU 543 Ca -0.00 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 3dpp h LEU 543 Cb 0.03 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3dpp h LEU 543 CO 0.00 0.41 -0.24 0.45 -0.34 0.00 0.00 178.44 178.72 3dpp h HIS 544 N -0.97 0.00 -0.07 1.25 3.86 -1.07 -1.42 115.15 116.73 3dpp h HIS 544 Ca -0.02 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.08 3dpp h HIS 544 Cb 0.43 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.91 3dpp h HIS 544 CO 0.07 0.24 -0.40 0.77 0.86 0.00 0.00 177.93 179.47 3dpp h SER 545 N 0.00 0.47 -0.01 2.45 0.02 -1.14 -0.34 113.55 115.00 3dpp h SER 545 Ca -0.00 -0.67 -0.09 0.00 -0.84 0.00 0.00 61.79 60.19 3dpp h SER 545 Cb 0.47 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 3dpp h SER 545 CO 0.03 1.06 -0.27 0.74 -1.14 0.00 0.00 176.83 177.26 3dpp h THR 546 N -0.09 1.27 0.00 -2.27 2.02 -0.60 -0.06 112.91 113.18 3dpp h THR 546 Ca -0.03 -1.28 -0.14 0.00 0.77 0.00 0.00 66.41 65.74 3dpp h THR 546 Cb 1.07 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 3dpp h THR 546 CO 0.08 0.40 -0.65 0.03 0.37 0.00 0.00 175.52 175.76 3dpp h ARG 547 N 0.39 0.00 0.00 6.66 3.08 -1.19 -2.31 114.38 121.01 3dpp h ARG 547 Ca 0.06 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.93 3dpp h ARG 547 Cb 0.67 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 3dpp h ARG 547 CO 0.05 0.65 -0.87 0.87 -1.07 0.00 0.00 179.97 179.60 3dpp h LYS 548 N 0.00 0.00 0.00 0.04 1.57 -0.16 -2.69 116.57 115.33 3dpp h LYS 548 Ca -0.01 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 3dpp h LYS 548 Cb 1.23 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.51 3dpp h LYS 548 CO 0.08 0.79 -1.18 1.96 -0.57 0.00 0.00 179.45 180.53 3dpp h GLN 549 N 0.00 0.00 0.11 3.15 4.20 -0.84 -3.06 115.11 118.67 3dpp h GLN 549 Ca -0.02 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 3dpp h GLN 549 Cb 1.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.42 3dpp h GLN 549 CO 0.10 0.85 -0.05 0.28 -0.67 0.00 0.00 178.83 179.34 3dpp h VAL 550 N 0.00 0.00 0.00 -0.54 2.07 -1.46 -3.06 116.25 113.26 3dpp h VAL 550 Ca -0.08 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3dpp h VAL 550 Cb 1.82 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3dpp h VAL 550 CO 0.11 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 177.08 3dpp n GLU 551 N -4.42 0.46 -0.01 1.57 4.71 -1.02 0.11 120.64 122.04 3dpp n GLU 551 Ca -0.02 0.00 0.03 0.00 -0.01 0.00 0.00 57.16 57.16 3dpp n GLU 551 Cb 0.06 -1.23 -0.07 0.00 -1.01 0.00 0.00 31.44 29.19 3dpp n GLU 551 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 3dpp n GLU 552 N 0.29 0.68 -4.16 3.49 0.28 -1.16 -4.98 120.64 115.08 3dpp n GLU 552 Ca 0.00 -0.07 -0.25 0.00 -0.16 0.00 0.00 57.16 56.67 3dpp n GLU 552 Cb 0.12 -1.22 -0.06 0.00 1.43 0.00 0.00 31.44 31.70 3dpp n GLU 552 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3dpp s ALA 553 N -2.57 3.37 -0.12 -1.84 0.00 0.30 -5.05 121.76 115.85 3dpp s ALA 553 Ca -0.04 -1.35 -0.09 0.00 0.00 0.00 0.00 51.96 50.48 3dpp s ALA 553 Cb 0.05 -1.13 -0.05 0.00 0.00 0.00 0.00 23.12 21.98 3dpp s ALA 553 CO 0.38 0.44 -0.21 0.41 0.00 0.00 0.00 175.76 176.78 3dpp n GLY 554 N -0.42 -0.29 1.45 0.00 0.00 -1.26 -4.42 105.19 100.25 3dpp n GLY 554 Ca -0.09 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3dpp n GLY 554 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dpp n ASP 555 N -3.87 3.74 -1.28 1.61 5.68 -1.26 -4.57 116.55 116.61 3dpp n ASP 555 Ca -0.22 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.10 3dpp n ASP 555 Cb 0.55 -0.76 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 3dpp n ASP 555 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 3dpp n LYS 556 N 1.35 0.00 -0.99 0.11 2.85 -1.26 -4.71 118.16 115.50 3dpp n LYS 556 Ca 0.00 0.00 0.13 0.00 -1.05 0.00 0.00 58.31 57.39 3dpp n LYS 556 Cb 0.39 -0.47 -0.03 0.00 -0.65 0.00 0.00 35.03 34.27 3dpp n LYS 556 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 3dpp n LEU 557 N 0.40 0.00 -0.49 -5.58 -0.00 -1.26 -3.09 117.00 106.99 3dpp n LEU 557 Ca 0.00 1.06 0.00 0.00 -0.00 0.00 0.00 56.01 57.07 3dpp n LEU 557 Cb 0.00 -3.09 0.00 0.00 -0.00 0.00 0.00 43.42 40.33 3dpp n LEU 557 CO 0.00 -2.07 0.00 -2.65 -0.00 0.00 0.00 177.39 172.67 3dpp n PRO 558 N -3.16 0.00 0.00 1.47 -0.02 -1.26 -4.34 135.00 127.69 3dpp n PRO 558 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 3dpp n PRO 558 Cb 0.45 -0.66 0.00 0.00 -0.02 0.00 0.00 33.50 33.27 3dpp n PRO 558 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dpp n ALA 559 N 0.14 0.00 0.36 3.55 0.00 -1.18 -4.05 120.51 119.33 3dpp n ALA 559 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3dpp n ALA 559 Cb 0.00 -0.26 0.18 0.00 0.00 0.00 0.00 19.45 19.37 3dpp n ALA 559 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3dpp h ASP 560 N 0.00 0.00 0.02 0.00 3.45 -1.83 -0.88 116.42 117.17 3dpp h ASP 560 Ca 0.00 -0.06 -0.04 0.00 0.43 0.00 0.00 57.03 57.37 3dpp h ASP 560 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3dpp h ASP 560 CO 0.00 0.03 -0.17 0.44 -1.57 0.00 0.00 179.24 177.97 3dpp h ASP 561 N 0.00 0.11 -0.24 6.45 3.32 -1.79 -3.23 116.42 121.04 3dpp h ASP 561 Ca 0.00 -0.94 0.01 0.00 0.02 0.00 0.00 57.03 56.12 3dpp h ASP 561 Cb 0.88 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 3dpp h ASP 561 CO 0.00 1.03 0.16 0.11 -1.72 0.00 0.00 179.24 178.82 3dpp h LYS 562 N -0.80 0.28 0.00 3.56 6.56 -1.59 -2.62 116.57 121.95 3dpp h LYS 562 Ca -0.03 -0.02 -0.19 0.00 -1.06 0.00 0.00 60.65 59.35 3dpp h LYS 562 Cb 1.08 -0.06 -0.03 0.00 -0.57 0.00 0.00 32.23 32.65 3dpp h LYS 562 CO 0.03 0.18 -1.03 0.00 -2.06 0.00 0.00 179.45 176.58 3dpp h THR 563 N 0.28 1.29 0.00 -0.16 1.03 -1.25 -2.69 112.91 111.41 3dpp h THR 563 Ca 0.09 -2.92 -0.06 0.00 -0.01 0.00 0.00 66.41 63.51 3dpp h THR 563 Cb 0.02 2.62 -0.01 0.00 -1.07 0.00 0.00 68.15 69.71 3dpp h THR 563 CO -0.02 0.74 -0.28 0.00 -0.01 0.00 0.00 175.52 175.94 3dpp h ALA 564 N 1.15 0.89 0.18 0.00 0.00 -1.48 -2.67 119.26 117.33 3dpp h ALA 564 Ca -0.06 -0.26 -0.33 0.00 0.00 0.00 0.00 54.91 54.26 3dpp h ALA 564 Cb 1.70 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.46 3dpp h ALA 564 CO 0.10 0.35 -1.61 0.82 0.00 0.00 0.00 179.25 178.91 3dpp h ILE 565 N 0.00 1.09 0.00 0.00 2.04 -1.42 -2.78 117.51 116.44 3dpp h ILE 565 Ca -0.00 -2.66 -0.10 0.00 1.00 0.00 0.00 64.86 63.10 3dpp h ILE 565 Cb 1.01 2.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.90 3dpp h ILE 565 CO 0.04 0.84 -0.47 -0.33 0.00 0.00 0.00 178.15 178.23 3dpp h GLU 566 N 0.10 0.00 0.00 2.37 4.39 -1.38 0.18 114.58 120.24 3dpp h GLU 566 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3dpp h GLU 566 Cb 2.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.73 3dpp h GLU 566 CO 0.19 0.47 -0.31 0.45 -1.16 0.00 0.00 179.01 178.65 3dpp n SER 567 N -3.67 0.33 -0.00 1.42 2.88 -1.01 -3.20 113.62 110.36 3dpp n SER 567 Ca -0.01 0.06 0.07 0.00 -1.33 0.00 0.00 58.87 57.66 3dpp n SER 567 Cb 0.54 -0.05 -0.10 0.00 -0.75 0.00 0.00 64.21 63.86 3dpp n SER 567 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dpp n ALA 568 N -1.52 2.88 0.43 -1.46 0.00 -0.68 -3.89 120.51 116.27 3dpp n ALA 568 Ca 0.06 -0.34 0.12 0.00 0.00 0.00 0.00 53.44 53.28 3dpp n ALA 568 Cb 0.34 -0.47 0.19 0.00 0.00 0.00 0.00 19.45 19.51 3dpp n ALA 568 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dpp h LEU 569 N 0.00 0.00 0.00 0.00 3.38 -0.67 -2.91 115.31 115.11 3dpp h LEU 569 Ca 0.00 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3dpp h LEU 569 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3dpp h LEU 569 CO 0.00 0.04 -0.64 0.74 0.09 0.00 0.00 178.44 178.67 3dpp h THR 570 N 0.00 0.64 -1.01 0.22 2.02 -1.72 -2.07 112.91 110.99 3dpp h THR 570 Ca 0.00 -1.67 0.25 0.00 0.77 0.00 0.00 66.41 65.76 3dpp h THR 570 Cb 0.84 1.40 -0.08 0.00 -1.74 0.00 0.00 68.15 68.57 3dpp h THR 570 CO 0.00 0.22 0.66 0.00 0.37 0.00 0.00 175.52 176.76 3dpp h ALA 571 N -0.64 2.25 0.03 6.16 0.00 -1.67 0.14 119.26 125.52 3dpp h ALA 571 Ca -0.14 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3dpp h ALA 571 Cb 0.82 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.63 3dpp h ALA 571 CO -0.08 -0.62 -0.23 1.25 0.00 0.00 0.00 179.25 179.57 3dpp h LEU 572 N 0.39 0.15 -0.96 0.00 5.85 -1.59 -0.83 115.31 118.31 3dpp h LEU 572 Ca 0.56 -0.91 0.28 0.00 0.84 0.00 0.00 57.88 58.65 3dpp h LEU 572 Cb 1.43 -0.05 -0.14 0.00 0.37 0.00 0.00 40.66 42.27 3dpp h LEU 572 CO -0.25 1.05 0.47 -0.08 -0.34 0.00 0.00 178.44 179.29 3dpp h GLU 573 N -0.72 0.32 0.16 1.25 4.81 -0.40 -0.46 114.58 119.55 3dpp h GLU 573 Ca -0.04 -0.02 -0.31 0.00 -0.13 0.00 0.00 59.36 58.86 3dpp h GLU 573 Cb 1.11 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.42 3dpp h GLU 573 CO 0.04 0.21 -1.55 1.15 -0.73 0.00 0.00 179.01 178.14 3dpp h THR 574 N 0.33 1.02 -0.48 0.32 2.02 -0.73 -3.19 112.91 112.20 3dpp h THR 574 Ca 0.66 -2.48 0.13 0.00 0.77 0.00 0.00 66.41 65.49 3dpp h THR 574 Cb 1.42 2.79 -0.02 0.00 -1.74 0.00 0.00 68.15 70.59 3dpp h THR 574 CO -0.60 0.79 0.34 0.00 0.37 0.00 0.00 175.52 176.42 3dpp h ALA 575 N 0.05 2.39 0.00 6.16 0.00 -0.45 -1.52 119.26 125.89 3dpp h ALA 575 Ca -0.31 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 3dpp h ALA 575 Cb 1.95 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.75 3dpp h ALA 575 CO 0.14 -0.52 -0.28 -0.07 0.00 0.00 0.00 179.25 178.51 3dpp h LEU 576 N 0.05 0.00 -0.03 0.00 3.38 -1.09 -2.60 115.31 115.01 3dpp h LEU 576 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3dpp h LEU 576 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3dpp h LEU 576 CO -0.01 0.28 0.00 0.29 0.09 0.00 0.00 178.44 179.09 3dpp n LYS 577 N -3.61 0.24 -2.05 1.13 5.02 -0.57 -4.78 118.16 113.54 3dpp n LYS 577 Ca -0.01 0.21 -0.29 0.00 -2.02 0.00 0.00 58.31 56.20 3dpp n LYS 577 Cb 0.41 -1.78 0.17 0.00 -0.02 0.00 0.00 35.03 33.81 3dpp n LYS 577 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3dpp s GLY 578 N -3.53 1.77 -0.02 0.72 0.00 -0.98 -4.99 107.32 100.29 3dpp s GLY 578 Ca 0.11 -1.28 0.07 0.00 0.00 0.00 0.00 44.72 43.62 3dpp s GLY 578 CO 0.58 -0.56 1.16 1.18 0.00 0.00 0.00 173.10 175.47 3dpp n GLU 579 N -3.59 2.83 -3.66 2.90 1.02 -1.26 -4.93 120.64 113.95 3dpp n GLU 579 Ca 0.15 -1.93 -0.39 0.00 -0.02 0.00 0.00 57.16 54.97 3dpp n GLU 579 Cb 0.60 -1.22 -0.11 0.00 -0.02 0.00 0.00 31.44 30.68 3dpp n GLU 579 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3dpp s ASP 580 N -1.18 5.55 0.31 1.62 2.15 -1.26 -4.96 116.67 118.89 3dpp s ASP 580 Ca 0.16 -1.25 0.01 0.00 0.43 0.00 0.00 52.55 51.91 3dpp s ASP 580 Cb 0.10 -1.95 0.51 0.00 -0.30 0.00 0.00 42.92 41.27 3dpp s ASP 580 CO 0.08 -0.42 1.87 0.50 -0.17 0.00 0.00 175.17 177.03 3dpp h LYS 581 N 8.34 0.72 -0.15 4.34 3.64 -1.93 -2.63 116.57 128.91 3dpp h LYS 581 Ca -0.23 -0.13 -0.19 0.00 -1.27 0.00 0.00 60.65 58.83 3dpp h LYS 581 Cb 1.09 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.79 3dpp h LYS 581 CO 0.68 0.65 -0.67 0.00 -2.27 0.00 0.00 179.45 177.83 3dpp h ALA 582 N 1.44 0.55 0.00 5.00 0.00 -1.99 -1.95 119.26 122.30 3dpp h ALA 582 Ca 0.16 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 3dpp h ALA 582 Cb 0.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3dpp h ALA 582 CO -0.00 0.71 -0.30 0.00 0.00 0.00 0.00 179.25 179.66 3dpp h ALA 583 N 0.84 1.08 0.10 0.00 0.00 -1.86 0.16 119.26 119.58 3dpp h ALA 583 Ca -0.02 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.40 3dpp h ALA 583 Cb 1.25 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 19.02 3dpp h ALA 583 CO 0.13 0.38 -0.91 0.82 0.00 0.00 0.00 179.25 179.67 3dpp h ILE 584 N 0.00 1.41 0.00 0.00 2.04 -1.30 -2.71 117.51 116.95 3dpp h ILE 584 Ca -0.00 -2.39 -0.09 0.00 1.00 0.00 0.00 64.86 63.38 3dpp h ILE 584 Cb 0.76 2.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.70 3dpp h ILE 584 CO 0.04 0.70 -0.43 -0.33 0.00 0.00 0.00 178.15 178.13 3dpp h GLU 585 N -0.09 0.00 0.00 2.37 5.08 -0.69 -0.26 114.58 120.99 3dpp h GLU 585 Ca -0.14 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 3dpp h GLU 585 Cb 1.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.89 3dpp h GLU 585 CO 0.17 0.43 -0.17 0.00 -1.00 0.00 0.00 179.01 178.44 3dpp h ALA 586 N 1.57 0.93 0.00 3.43 0.00 -0.65 -1.25 119.26 123.29 3dpp h ALA 586 Ca -0.00 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.48 3dpp h ALA 586 Cb 0.81 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3dpp h ALA 586 CO 0.06 0.22 -1.92 1.63 0.00 0.00 0.00 179.25 179.24 3dpp n LYS 587 N -3.20 0.65 -0.04 0.00 4.76 -0.97 -3.14 118.16 116.22 3dpp n LYS 587 Ca 0.02 0.13 -0.00 0.00 -2.87 0.00 0.00 58.31 55.59 3dpp n LYS 587 Cb 0.52 -1.68 0.28 0.00 -1.84 0.00 0.00 35.03 32.31 3dpp n LYS 587 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 3dpp h MET 588 N 0.00 0.63 0.19 1.97 2.86 -0.68 -1.05 114.93 118.86 3dpp h MET 588 Ca -0.34 -0.12 -0.31 0.00 -2.06 0.00 0.00 59.70 56.88 3dpp h MET 588 Cb 1.93 -0.10 0.03 0.00 0.06 0.00 0.00 31.60 33.53 3dpp h MET 588 CO 0.05 0.59 -1.34 0.37 1.06 0.00 0.00 176.91 177.64 3dpp h GLN 589 N 0.61 0.57 -0.52 1.72 5.75 -1.34 -1.06 115.11 120.84 3dpp h GLN 589 Ca 0.14 -0.87 -0.08 0.00 -0.15 0.00 0.00 58.65 57.70 3dpp h GLN 589 Cb 0.26 0.31 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 3dpp h GLN 589 CO -0.00 1.41 0.02 0.93 -2.65 0.00 0.00 178.83 178.53 3dpp h GLU 590 N 0.16 0.86 -0.48 1.69 5.08 -1.48 -1.12 114.58 119.29 3dpp h GLU 590 Ca -0.22 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 57.80 3dpp h GLU 590 Cb 2.03 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 31.16 3dpp h GLU 590 CO 0.25 0.85 -0.11 1.25 -1.00 0.00 0.00 179.01 180.25 3dpp h LEU 591 N 0.80 0.89 -1.81 1.33 5.85 -1.10 -1.74 115.31 119.54 3dpp h LEU 591 Ca 0.16 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 3dpp h LEU 591 Cb 0.46 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 3dpp h LEU 591 CO 0.02 1.01 -0.13 0.00 -0.34 0.00 0.00 178.44 179.00 3dpp h ALA 592 N 1.07 1.24 -0.86 1.25 0.00 -0.01 -3.20 119.26 118.74 3dpp h ALA 592 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dpp h ALA 592 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3dpp h ALA 592 CO 0.04 0.16 0.00 1.04 0.00 0.00 0.00 179.25 180.50 3dpp n GLN 593 N -3.59 0.00 -0.25 0.00 6.02 -0.61 -3.84 117.38 115.11 3dpp n GLN 593 Ca -0.02 0.36 -0.01 0.00 -0.01 0.00 0.00 57.00 57.32 3dpp n GLN 593 Cb 0.26 -1.06 -0.02 0.00 1.02 0.00 0.00 30.24 30.45 3dpp n GLN 593 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3dpp n VAL 594 N -1.57 0.91 -1.37 5.09 0.24 -1.08 -2.55 118.33 118.01 3dpp n VAL 594 Ca 0.00 -0.31 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 3dpp n VAL 594 Cb 0.00 -1.33 0.00 0.00 -1.47 0.00 0.00 33.84 31.04 3dpp n VAL 594 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3dpp n SER 595 N 2.05 0.00 -0.34 -1.34 7.64 -1.23 -4.45 113.62 115.95 3dpp n SER 595 Ca 0.04 -1.31 0.12 0.00 1.01 0.00 0.00 58.87 58.73 3dpp n SER 595 Cb 0.25 -0.06 0.30 0.00 -1.01 0.00 0.00 64.21 63.68 3dpp n SER 595 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 3dpp h GLN 596 N 0.00 0.69 0.00 1.43 4.20 -1.70 0.25 115.11 119.99 3dpp h GLN 596 Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3dpp h GLN 596 Cb 1.13 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.75 3dpp h GLN 596 CO 0.00 0.46 -0.46 0.36 -0.67 0.00 0.00 178.83 178.52 3dpp n LYS 597 N -4.81 0.05 -0.05 1.46 0.00 -1.26 -2.77 118.16 110.78 3dpp n LYS 597 Ca 0.22 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.54 3dpp n LYS 597 Cb 0.54 -1.53 -0.13 0.00 -0.00 0.00 0.00 35.03 33.91 3dpp n LYS 597 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 3dpp n LEU 598 N -1.60 0.00 -0.08 -5.58 7.94 -0.76 -3.67 117.00 113.25 3dpp n LEU 598 Ca 0.05 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.08 3dpp n LEU 598 Cb 0.35 0.21 0.70 0.00 0.53 0.00 0.00 43.42 45.21 3dpp n LEU 598 CO 0.34 0.21 0.95 0.23 -1.11 0.00 0.00 177.39 178.02 3dpp n MET 599 N -2.37 1.11 0.00 1.96 2.81 0.81 -5.02 117.12 116.43 3dpp n MET 599 Ca -0.15 -0.16 0.00 0.00 -1.81 0.00 0.00 57.70 55.57 3dpp n MET 599 Cb 0.76 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.87 3dpp n MET 599 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63