#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ux0 h THR 387 N 0.00 1.63 -0.98 1.12 1.03 -2.04 0.24 112.91 113.90 2ux0 h THR 387 Ca 0.00 -3.10 0.07 0.00 -0.01 0.00 0.00 66.41 63.37 2ux0 h THR 387 Cb 0.00 2.71 -0.07 0.00 -1.07 0.00 0.00 68.15 69.72 2ux0 h THR 387 CO 0.00 0.89 0.63 -0.08 -0.01 0.00 0.00 175.52 176.95 2ux0 h GLU 388 N 0.02 1.08 -0.05 0.00 4.22 -2.06 -1.06 114.58 116.74 2ux0 h GLU 388 Ca -0.03 -0.07 -0.20 0.00 0.08 0.00 0.00 59.36 59.15 2ux0 h GLU 388 Cb 1.67 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.69 2ux0 h GLU 388 CO 0.13 0.72 -0.73 0.22 -2.18 0.00 0.00 179.01 177.16 2ux0 h ASP 389 N 1.11 0.72 -0.50 1.04 3.58 -1.97 -2.98 116.42 117.43 2ux0 h ASP 389 Ca 0.44 -0.71 -0.10 0.00 0.42 0.00 0.00 57.03 57.08 2ux0 h ASP 389 Cb 0.23 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 2ux0 h ASP 389 CO -0.19 1.33 -0.06 -0.33 -2.88 0.00 0.00 179.24 177.11 2ux0 h GLU 390 N 0.18 0.97 -0.38 0.28 3.07 -0.41 -1.30 114.58 116.99 2ux0 h GLU 390 Ca -0.08 -0.32 0.07 0.00 -0.50 0.00 0.00 59.36 58.53 2ux0 h GLU 390 Cb 1.40 -0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 29.17 2ux0 h GLU 390 CO 0.15 0.99 -0.03 0.22 -1.40 0.00 0.00 179.01 178.93 2ux0 h ASP 391 N 0.87 -0.22 -0.42 1.42 1.82 -1.27 -1.63 116.42 116.99 2ux0 h ASP 391 Ca 0.15 0.10 -0.04 0.00 -0.39 0.00 0.00 57.03 56.84 2ux0 h ASP 391 Cb 0.59 0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.77 2ux0 h ASP 391 CO 0.04 -0.07 0.10 0.25 -1.61 0.00 0.00 179.24 177.95 2ux0 h LEU 392 N 0.07 0.64 -0.53 2.28 5.85 -1.30 -2.17 115.31 120.15 2ux0 h LEU 392 Ca 0.19 -0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.75 2ux0 h LEU 392 Cb 0.27 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 2ux0 h LEU 392 CO -0.34 0.71 0.18 0.50 -0.34 0.00 0.00 178.44 179.15 2ux0 h LYS 393 N 0.54 0.35 -0.17 1.25 1.63 -1.01 -1.03 116.57 118.12 2ux0 h LYS 393 Ca 0.13 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.92 2ux0 h LYS 393 Cb 0.32 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 2ux0 h LYS 393 CO 0.00 0.23 0.10 0.28 -3.45 0.00 0.00 179.45 176.61 2ux0 h VAL 394 N 0.36 1.02 -0.38 2.00 2.07 -0.99 -0.66 116.25 119.67 2ux0 h VAL 394 Ca 0.26 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.71 2ux0 h VAL 394 Cb 0.29 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2ux0 h VAL 394 CO -0.27 0.04 0.24 0.03 0.02 0.00 0.00 177.57 177.63 2ux0 h ARG 395 N 0.21 0.50 -0.81 1.57 3.08 -1.12 -0.26 114.38 117.55 2ux0 h ARG 395 Ca 0.07 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.12 2ux0 h ARG 395 Cb -0.00 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 29.88 2ux0 h ARG 395 CO -0.03 0.34 0.51 0.87 -1.07 0.00 0.00 179.97 180.59 2ux0 h LYS 396 N 0.51 0.95 -0.29 0.04 1.57 -0.93 -1.11 116.57 117.30 2ux0 h LYS 396 Ca 0.14 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.79 2ux0 h LYS 396 Cb -0.05 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.03 2ux0 h LYS 396 CO -0.03 0.63 -0.13 1.96 -0.57 0.00 0.00 179.45 181.31 2ux0 h GLN 397 N 0.98 0.49 -0.61 3.15 1.08 -0.58 -2.37 115.11 117.25 2ux0 h GLN 397 Ca 0.33 -0.14 0.08 0.00 -1.45 0.00 0.00 58.65 57.48 2ux0 h GLN 397 Cb 0.06 -0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.37 2ux0 h GLN 397 CO -0.13 0.62 0.26 1.49 -0.95 0.00 0.00 178.83 180.11 2ux0 h GLU 398 N 0.45 0.45 -0.02 1.46 4.81 0.22 0.11 114.58 122.05 2ux0 h GLU 398 Ca 0.08 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 2ux0 h GLU 398 Cb 0.50 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2ux0 h GLU 398 CO 0.03 0.30 -0.71 0.82 -0.73 0.00 0.00 179.01 178.71 2ux0 h ILE 399 N 0.46 1.46 -0.07 2.32 1.08 -1.14 -2.51 117.51 119.11 2ux0 h ILE 399 Ca 0.30 -2.30 -0.02 0.00 -0.39 0.00 0.00 64.86 62.45 2ux0 h ILE 399 Cb 0.33 2.23 -0.00 0.00 -3.07 0.00 0.00 36.82 36.31 2ux0 h ILE 399 CO -0.27 0.67 -0.04 0.40 -0.69 0.00 0.00 178.15 178.22 2ux0 h ILE 400 N 0.10 1.33 -0.52 -0.67 2.04 -0.99 -1.84 117.51 116.96 2ux0 h ILE 400 Ca -0.02 -1.06 0.07 0.00 1.00 0.00 0.00 64.86 64.85 2ux0 h ILE 400 Cb 1.26 1.89 -0.06 0.00 -0.74 0.00 0.00 36.82 39.17 2ux0 h ILE 400 CO 0.10 0.29 0.18 0.50 0.00 0.00 0.00 178.15 179.23 2ux0 h LYS 401 N -0.23 0.35 -0.31 2.37 1.63 -0.89 -0.30 116.57 119.20 2ux0 h LYS 401 Ca 0.02 -0.02 -0.15 0.00 -0.85 0.00 0.00 60.65 59.64 2ux0 h LYS 401 Cb 0.49 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 2ux0 h LYS 401 CO 0.01 0.23 -0.43 0.97 -3.45 0.00 0.00 179.45 176.79 2ux0 h ILE 402 N 0.36 1.29 -0.60 2.00 6.09 -1.46 -0.71 117.51 124.48 2ux0 h ILE 402 Ca 0.25 -1.61 0.01 0.00 -1.37 0.00 0.00 64.86 62.14 2ux0 h ILE 402 Cb 0.27 1.50 -0.03 0.00 0.47 0.00 0.00 36.82 39.03 2ux0 h ILE 402 CO -0.25 0.52 0.39 0.74 -3.07 0.00 0.00 178.15 176.48 2ux0 h THR 403 N 0.62 1.14 -0.71 2.19 2.02 -0.89 -0.48 112.91 116.80 2ux0 h THR 403 Ca 0.04 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.91 2ux0 h THR 403 Cb 0.99 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 2ux0 h THR 403 CO 0.09 0.15 0.30 -0.33 0.37 0.00 0.00 175.52 176.10 2ux0 h GLU 404 N 0.80 1.04 -0.61 6.66 5.08 -0.65 -1.87 114.58 125.03 2ux0 h GLU 404 Ca 0.22 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 2ux0 h GLU 404 Cb -0.08 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 2ux0 h GLU 404 CO -0.06 0.83 0.02 1.96 -1.00 0.00 0.00 179.01 180.77 2ux0 h GLN 405 N 1.03 1.06 -0.50 2.33 4.20 -0.70 -1.29 115.11 121.24 2ux0 h GLN 405 Ca 0.24 -0.33 0.02 0.00 0.06 0.00 0.00 58.65 58.65 2ux0 h GLN 405 Cb 0.17 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2ux0 h GLN 405 CO -0.02 1.03 0.29 1.25 -0.67 0.00 0.00 178.83 180.71 2ux0 h LEU 406 N 0.97 0.47 -0.81 1.46 5.85 -0.65 -1.25 115.31 121.35 2ux0 h LEU 406 Ca 0.18 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 2ux0 h LEU 406 Cb 0.54 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2ux0 h LEU 406 CO 0.03 0.33 0.14 0.40 -0.34 0.00 0.00 178.44 179.01 2ux0 h ILE 407 N 0.59 1.25 -0.64 4.05 2.04 -1.11 -1.40 117.51 122.29 2ux0 h ILE 407 Ca 0.20 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 2ux0 h ILE 407 Cb 0.03 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2ux0 h ILE 407 CO -0.10 0.36 0.39 -0.33 0.00 0.00 0.00 178.15 178.48 2ux0 h GLU 408 N 0.98 0.86 -0.90 2.37 5.08 -0.86 -0.99 114.58 121.12 2ux0 h GLU 408 Ca 0.21 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2ux0 h GLU 408 Cb 0.37 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2ux0 h GLU 408 CO 0.00 0.60 0.52 0.00 -1.00 0.00 0.00 179.01 179.14 2ux0 h ALA 409 N 1.21 1.14 -0.18 3.43 0.00 -0.65 -0.80 119.26 123.41 2ux0 h ALA 409 Ca 0.23 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2ux0 h ALA 409 Cb -0.04 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2ux0 h ALA 409 CO -0.04 0.62 0.00 0.82 0.00 0.00 0.00 179.25 180.64 2ux0 h ILE 410 N 1.24 1.25 -0.87 0.00 2.04 -0.96 -0.02 117.51 120.18 2ux0 h ILE 410 Ca 0.32 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 2ux0 h ILE 410 Cb -0.03 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 2ux0 h ILE 410 CO -0.06 0.26 0.47 0.78 0.00 0.00 0.00 178.15 179.59 2ux0 h ASN 411 N 0.06 1.10 1.22 1.72 2.35 -0.92 -2.42 115.58 118.69 2ux0 h ASN 411 Ca 0.05 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2ux0 h ASN 411 Cb 0.38 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2ux0 h ASN 411 CO 0.01 0.89 0.00 0.59 -1.65 0.00 0.00 177.43 177.27 2ux0 n ASN 412 N -4.33 0.62 -1.10 5.81 3.02 -0.33 -4.88 115.26 114.07 2ux0 n ASN 412 Ca 0.09 0.58 -0.09 0.00 -0.03 0.00 0.00 54.58 55.13 2ux0 n ASN 412 Cb 0.11 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.54 2ux0 n ASN 412 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ux0 n GLY 413 N 1.05 0.08 3.42 7.41 0.00 -0.79 -4.54 105.19 111.82 2ux0 n GLY 413 Ca 0.05 -0.49 -0.44 0.00 0.00 0.00 0.00 46.02 45.14 2ux0 n GLY 413 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ux0 s ASP 414 N -2.72 6.24 0.25 1.61 3.68 -0.09 -4.45 116.67 121.19 2ux0 s ASP 414 Ca 0.04 -1.31 0.12 0.00 2.13 0.00 0.00 52.55 53.53 2ux0 s ASP 414 Cb -0.02 -2.37 0.21 0.00 -1.45 0.00 0.00 42.92 39.29 2ux0 s ASP 414 CO 0.05 -1.26 1.51 0.15 0.13 0.00 0.00 175.17 175.75 2ux0 h PHE 415 N 9.31 0.00 -0.14 -5.34 3.57 -1.94 -1.62 116.94 120.77 2ux0 h PHE 415 Ca -0.23 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.24 2ux0 h PHE 415 Cb 1.07 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.81 2ux0 h PHE 415 CO 0.94 0.66 -0.02 1.49 -2.23 0.00 0.00 178.31 179.16 2ux0 h GLU 416 N 0.00 0.26 -0.66 1.11 4.22 -1.97 0.20 114.58 117.74 2ux0 h GLU 416 Ca -0.01 -0.09 -0.03 0.00 0.08 0.00 0.00 59.36 59.31 2ux0 h GLU 416 Cb 1.30 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 2ux0 h GLU 416 CO 0.09 0.52 0.31 0.00 -2.18 0.00 0.00 179.01 177.75 2ux0 h ALA 417 N 0.73 0.86 0.07 2.92 0.00 -1.95 -2.06 119.26 119.83 2ux0 h ALA 417 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2ux0 h ALA 417 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2ux0 h ALA 417 CO 0.01 0.43 -0.10 -0.92 0.00 0.00 0.00 179.25 178.67 2ux0 h TYR 418 N 0.92 -0.25 0.00 0.00 3.20 -1.04 -2.36 116.97 117.44 2ux0 h TYR 418 Ca 0.23 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 2ux0 h TYR 418 Cb 0.13 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2ux0 h TYR 418 CO 0.01 -0.15 -0.21 1.15 -1.64 0.00 0.00 178.16 177.31 2ux0 h THR 419 N -0.20 0.88 -0.05 1.81 2.02 -0.49 -1.24 112.91 115.63 2ux0 h THR 419 Ca 0.01 -0.79 -0.12 0.00 0.77 0.00 0.00 66.41 66.28 2ux0 h THR 419 Cb 0.21 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 2ux0 h THR 419 CO -0.05 0.20 -0.52 0.11 0.37 0.00 0.00 175.52 175.63 2ux0 h LYS 420 N 0.00 0.14 0.00 6.66 1.57 -1.06 -3.25 116.57 120.63 2ux0 h LYS 420 Ca -0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2ux0 h LYS 420 Cb 0.45 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2ux0 h LYS 420 CO 0.03 0.63 -1.17 -0.89 -0.57 0.00 0.00 179.45 177.48 2ux0 n ILE 421 N -3.93 0.49 -3.96 1.86 5.41 -0.75 -4.90 119.36 113.57 2ux0 n ILE 421 Ca -0.02 -0.52 -0.36 0.00 1.00 0.00 0.00 62.75 62.85 2ux0 n ILE 421 Cb 0.55 -0.25 -0.07 0.00 -0.71 0.00 0.00 39.64 39.16 2ux0 n ILE 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ux0 s ASP 423 N -0.88 6.62 0.56 0.00 2.15 -0.48 -4.81 116.67 119.84 2ux0 s ASP 423 Ca 0.14 2.79 0.27 0.00 0.43 0.00 0.00 52.55 56.18 2ux0 s ASP 423 Cb -0.12 -2.65 1.50 0.00 -0.30 0.00 0.00 42.92 41.35 2ux0 s ASP 423 CO 0.03 -0.67 2.00 -0.65 -0.17 0.00 0.00 175.17 175.71 2ux0 h PRO 424 N 3.66 0.00 -0.64 4.34 0.11 -1.89 -1.53 132.00 136.05 2ux0 h PRO 424 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ux0 h PRO 424 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2ux0 h PRO 424 CO 0.68 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.88 2ux0 n GLY 425 N -1.53 1.88 3.62 -0.55 0.00 -1.26 -4.75 105.19 102.60 2ux0 n GLY 425 Ca 0.07 -0.51 -0.51 0.00 0.00 0.00 0.00 46.02 45.07 2ux0 n GLY 425 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ux0 n LEU 426 N 0.50 2.11 -4.70 0.99 7.94 -0.58 -4.90 117.00 118.36 2ux0 n LEU 426 Ca 0.15 1.10 -0.29 0.00 -1.11 0.00 0.00 56.01 55.87 2ux0 n LEU 426 Cb 0.65 -1.25 -0.08 0.00 0.53 0.00 0.00 43.42 43.27 2ux0 n LEU 426 CO 0.16 -0.79 -0.32 0.42 -1.11 0.00 0.00 177.39 175.75 2ux0 s THR 427 N 0.88 4.03 -0.04 1.96 -4.23 -0.85 -0.97 115.64 116.41 2ux0 s THR 427 Ca 0.84 -1.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.28 2ux0 s THR 427 Cb -0.89 -2.95 0.03 0.00 1.34 0.00 0.00 72.50 70.04 2ux0 s THR 427 CO 0.46 0.06 0.09 -0.55 -0.54 0.00 0.00 174.62 174.14 2ux0 s SER 428 N -2.49 0.02 -0.23 3.99 0.15 -0.14 -1.80 113.70 113.21 2ux0 s SER 428 Ca 0.27 0.17 -0.09 0.00 0.70 0.00 0.00 55.95 57.00 2ux0 s SER 428 Cb -0.11 0.06 -0.05 0.00 -1.71 0.00 0.00 66.02 64.21 2ux0 s SER 428 CO 0.19 -0.14 0.13 -0.36 1.20 0.00 0.00 173.24 174.26 2ux0 s PHE 429 N 1.18 3.26 0.06 3.44 2.99 -0.12 -1.72 117.98 127.07 2ux0 s PHE 429 Ca -0.08 0.09 -0.26 0.00 0.00 0.00 0.00 56.93 56.67 2ux0 s PHE 429 Cb -0.12 -2.24 0.08 0.00 0.00 0.00 0.00 43.02 40.74 2ux0 s PHE 429 CO -0.05 -0.00 0.72 -1.83 -0.00 0.00 0.00 175.22 174.06 2ux0 s GLU 430 N 1.08 1.07 0.36 0.44 -1.05 -1.26 -0.52 118.70 118.82 2ux0 s GLU 430 Ca 0.06 -0.28 0.09 0.00 -0.15 0.00 0.00 54.97 54.69 2ux0 s GLU 430 Cb -0.14 0.49 0.82 0.00 -0.44 0.00 0.00 34.13 34.86 2ux0 s GLU 430 CO 0.04 -0.44 1.90 -1.35 0.95 0.00 0.00 175.26 176.36 2ux0 h PRO 431 N 2.18 0.66 0.00 -4.83 0.11 -1.90 0.11 132.00 128.33 2ux0 h PRO 431 Ca -0.28 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2ux0 h PRO 431 Cb 1.26 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2ux0 h PRO 431 CO 0.36 0.44 0.00 0.93 -0.21 0.00 0.00 178.00 179.52 2ux0 h GLU 432 N 0.68 0.00 -0.03 1.05 4.39 -1.97 -2.66 114.58 116.05 2ux0 h GLU 432 Ca 0.40 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.10 2ux0 h GLU 432 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2ux0 h GLU 432 CO -0.17 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.68 2ux0 n ALA 433 N -1.97 2.58 -3.70 3.43 0.00 0.38 -4.97 120.51 116.26 2ux0 n ALA 433 Ca 0.02 -0.43 -0.25 0.00 0.00 0.00 0.00 53.44 52.77 2ux0 n ALA 433 Cb 0.30 -1.19 0.06 0.00 0.00 0.00 0.00 19.45 18.62 2ux0 n ALA 433 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ux0 n LEU 434 N 0.09 -3.15 0.00 0.00 4.77 -1.00 -1.96 117.00 115.75 2ux0 n LEU 434 Ca 0.19 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 2ux0 n LEU 434 Cb 0.33 -2.84 0.00 0.00 -2.33 0.00 0.00 43.42 38.58 2ux0 n LEU 434 CO 0.16 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 2ux0 n GLY 435 N -1.77 0.83 3.93 -0.72 0.00 -1.26 -5.04 105.19 101.17 2ux0 n GLY 435 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2ux0 n GLY 435 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ux0 s ASN 436 N -2.96 6.30 -0.17 1.61 0.01 -0.83 -5.07 114.94 113.83 2ux0 s ASN 436 Ca 0.00 0.17 -0.19 0.00 -0.71 0.00 0.00 52.86 52.13 2ux0 s ASN 436 Cb 0.00 -1.89 -0.03 0.00 0.41 0.00 0.00 41.25 39.73 2ux0 s ASN 436 CO 0.00 0.07 0.53 -0.22 -1.51 0.00 0.00 177.10 175.97 2ux0 s LEU 437 N -3.13 4.19 0.15 0.60 2.96 -1.26 -4.52 118.68 117.67 2ux0 s LEU 437 Ca 0.34 0.75 0.10 0.00 -0.22 0.00 0.00 54.13 55.10 2ux0 s LEU 437 Cb -0.11 -2.74 -0.04 0.00 0.50 0.00 0.00 46.19 43.79 2ux0 s LEU 437 CO 0.28 -0.14 -0.18 0.68 -1.32 0.00 0.00 176.35 175.67 2ux0 s VAL 438 N 1.38 2.76 -0.55 1.68 -7.23 -0.70 -4.92 120.40 112.82 2ux0 s VAL 438 Ca 0.26 -1.69 -0.28 0.00 -1.81 0.00 0.00 61.98 58.46 2ux0 s VAL 438 Cb -0.15 -2.30 0.01 0.00 0.56 0.00 0.00 36.38 34.49 2ux0 s VAL 438 CO 0.10 -0.00 1.48 -1.83 -0.31 0.00 0.00 175.10 174.54 2ux0 s GLU 439 N -2.42 3.24 0.58 4.82 -1.05 -1.26 -0.96 118.70 121.65 2ux0 s GLU 439 Ca 0.20 0.52 0.28 0.00 -0.15 0.00 0.00 54.97 55.82 2ux0 s GLU 439 Cb -0.09 -4.15 1.55 0.00 -0.44 0.00 0.00 34.13 30.99 2ux0 s GLU 439 CO 0.11 -2.01 1.99 0.78 0.95 0.00 0.00 175.26 177.08 2ux0 h GLY 440 N 13.43 0.00 1.41 -3.83 0.00 -1.36 -2.95 103.07 109.77 2ux0 h GLY 440 Ca -0.27 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.85 2ux0 h GLY 440 CO 1.17 0.00 -0.81 -0.33 0.00 0.00 0.00 176.54 176.57 2ux0 h MET 441 N 0.00 0.57 0.02 4.80 2.86 -1.86 -1.58 114.93 119.74 2ux0 h MET 441 Ca 0.16 -0.50 -0.18 0.00 -2.06 0.00 0.00 59.70 57.12 2ux0 h MET 441 Cb 0.86 0.12 0.02 0.00 0.06 0.00 0.00 31.60 32.66 2ux0 h MET 441 CO -0.00 1.13 -0.73 0.22 1.06 0.00 0.00 176.91 178.58 2ux0 h ASP 442 N 0.37 0.61 0.24 1.22 3.58 -1.91 -3.25 116.42 117.28 2ux0 h ASP 442 Ca -0.06 -0.78 -0.10 0.00 0.42 0.00 0.00 57.03 56.52 2ux0 h ASP 442 Cb 1.43 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 2ux0 h ASP 442 CO 0.15 1.31 -0.40 0.15 -2.88 0.00 0.00 179.24 177.58 2ux0 h PHE 443 N -0.02 0.25 0.00 0.28 3.04 -1.57 -3.01 116.94 115.91 2ux0 h PHE 443 Ca -0.10 -0.06 0.00 0.00 3.98 0.00 0.00 57.97 61.79 2ux0 h PHE 443 Cb 1.44 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 39.89 2ux0 h PHE 443 CO 0.14 0.58 -0.24 0.45 -2.02 0.00 0.00 178.31 177.22 2ux0 h HIS 444 N 0.18 0.00 -0.99 0.41 3.86 -1.42 -3.31 115.15 113.89 2ux0 h HIS 444 Ca 0.02 0.00 0.20 0.00 -1.16 0.00 0.00 60.37 59.43 2ux0 h HIS 444 Cb 0.78 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 29.16 2ux0 h HIS 444 CO 0.01 0.00 0.62 0.87 0.86 0.00 0.00 177.93 180.29 2ux0 h LYS 445 N 0.00 0.65 -0.60 2.45 6.56 -1.56 -1.97 116.57 122.10 2ux0 h LYS 445 Ca 0.00 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.52 2ux0 h LYS 445 Cb 0.98 -0.15 -0.03 0.00 -0.57 0.00 0.00 32.23 32.47 2ux0 h LYS 445 CO 0.00 0.43 0.27 0.35 -2.06 0.00 0.00 179.45 178.44 2ux0 h PHE 446 N 0.67 0.86 0.00 -1.35 3.57 -1.75 -0.53 116.94 118.41 2ux0 h PHE 446 Ca 0.56 -0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.90 2ux0 h PHE 446 Cb 0.99 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2ux0 h PHE 446 CO -0.00 0.65 -0.55 1.88 -2.23 0.00 0.00 178.31 178.05 2ux0 h TYR 447 N 0.86 0.00 0.01 0.41 -1.99 -1.59 -1.84 116.97 112.82 2ux0 h TYR 447 Ca 0.21 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.90 2ux0 h TYR 447 Cb 0.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.86 2ux0 h TYR 447 CO 0.01 0.55 -0.16 0.74 -0.00 0.00 0.00 178.16 179.30 2ux0 h PHE 448 N 0.00 0.15 -0.43 4.88 -1.00 -1.31 -0.14 116.94 119.10 2ux0 h PHE 448 Ca -0.01 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.69 2ux0 h PHE 448 Cb 1.30 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.83 2ux0 h PHE 448 CO 0.00 0.92 0.27 0.93 -1.61 0.00 0.00 178.31 178.81 2ux0 h GLU 449 N -0.66 0.57 0.00 1.51 5.08 -1.09 -3.21 114.58 116.79 2ux0 h GLU 449 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2ux0 h GLU 449 Cb 0.97 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.09 2ux0 h GLU 449 CO 0.03 0.39 -0.01 0.09 -1.00 0.00 0.00 179.01 178.51 2ux0 n ASN 450 N -4.46 1.69 0.00 1.42 3.02 -0.70 -4.86 115.26 111.38 2ux0 n ASN 450 Ca 0.03 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 2ux0 n ASN 450 Cb 0.07 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2ux0 n ASN 450 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2ux0 n LEU 451 N -0.52 0.00 -0.22 3.41 7.94 -0.93 -4.91 117.00 121.77 2ux0 n LEU 451 Ca 0.02 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.84 2ux0 n LEU 451 Cb 0.34 0.35 0.03 0.00 0.53 0.00 0.00 43.42 44.67 2ux0 n LEU 451 CO 0.00 -0.49 0.91 -0.07 -1.11 0.00 0.00 177.39 176.63 2ux0 h LEU 452 N 0.00 0.95 -0.95 -1.96 3.38 -1.20 -1.17 115.31 114.37 2ux0 h LEU 452 Ca 0.00 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 2ux0 h LEU 452 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2ux0 h LEU 452 CO 0.00 0.95 -0.25 0.77 0.09 0.00 0.00 178.44 180.00 2ux0 h SER 453 N 0.91 0.00 0.79 -0.43 4.64 -1.77 -3.27 113.55 114.42 2ux0 h SER 453 Ca 0.19 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.41 2ux0 h SER 453 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 2ux0 h SER 453 CO 0.01 0.25 -0.50 0.11 -0.87 0.00 0.00 176.83 175.83 2ux0 h LYS 454 N 0.00 0.00 -5.52 4.77 6.56 -1.46 -3.47 116.57 117.44 2ux0 h LYS 454 Ca -0.00 0.00 -0.59 0.00 -1.06 0.00 0.00 60.65 59.00 2ux0 h LYS 454 Cb 0.83 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 32.39 2ux0 h LYS 454 CO 0.03 0.50 -0.24 0.54 -2.06 0.00 0.00 179.45 178.22 2ux0 s ASN 455 N -6.61 6.49 -0.20 0.86 2.20 -1.07 -4.95 114.94 111.65 2ux0 s ASN 455 Ca -0.00 0.57 0.16 0.00 -0.94 0.00 0.00 52.86 52.65 2ux0 s ASN 455 Cb 0.11 -2.22 0.65 0.00 -2.00 0.00 0.00 41.25 37.79 2ux0 s ASN 455 CO 0.72 0.02 1.55 -0.24 -2.94 0.00 0.00 177.10 176.21 2ux0 n SER 456 N 3.91 4.62 -4.72 3.54 2.88 -1.26 -5.01 113.62 117.58 2ux0 n SER 456 Ca -0.10 -2.99 -0.41 0.00 -1.33 0.00 0.00 58.87 54.05 2ux0 n SER 456 Cb 0.52 -0.60 -0.04 0.00 -0.75 0.00 0.00 64.21 63.33 2ux0 n SER 456 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2ux0 s LYS 457 N -2.81 4.55 0.52 -1.46 1.02 -1.26 -5.04 119.74 115.26 2ux0 s LYS 457 Ca 0.47 1.23 -0.21 0.00 0.02 0.00 0.00 55.97 57.48 2ux0 s LYS 457 Cb 0.37 -3.42 -0.06 0.00 -0.52 0.00 0.00 37.83 34.20 2ux0 s LYS 457 CO 0.12 0.10 1.21 -2.14 -0.92 0.00 0.00 175.35 173.71 2ux0 s PRO 458 N 0.54 3.38 -0.16 -1.68 0.02 -1.26 -4.97 135.00 130.87 2ux0 s PRO 458 Ca 0.45 1.85 -0.09 0.00 0.02 0.00 0.00 61.00 63.24 2ux0 s PRO 458 Cb -0.21 -2.20 0.06 0.00 0.02 0.00 0.00 34.50 32.17 2ux0 s PRO 458 CO 0.25 -0.88 0.39 0.96 -0.33 0.00 0.00 177.00 177.38 2ux0 s ILE 459 N -1.54 -0.05 -0.23 2.83 -4.36 -1.26 -3.99 121.20 112.60 2ux0 s ILE 459 Ca 0.70 0.11 -0.04 0.00 -0.26 0.00 0.00 60.65 61.15 2ux0 s ILE 459 Cb -0.31 -0.58 -0.01 0.00 1.25 0.00 0.00 42.46 42.82 2ux0 s ILE 459 CO 0.36 0.04 -0.03 -2.28 0.24 0.00 0.00 174.94 173.27 2ux0 s HIS 460 N 1.43 2.98 -0.11 1.37 2.46 -0.64 -4.97 115.29 117.80 2ux0 s HIS 460 Ca -0.09 -0.93 -0.12 0.00 0.47 0.00 0.00 55.06 54.39 2ux0 s HIS 460 Cb -0.09 -2.12 -0.05 0.00 -0.13 0.00 0.00 32.58 30.20 2ux0 s HIS 460 CO -0.12 -0.54 0.27 0.99 -2.47 0.00 0.00 174.74 172.86 2ux0 s THR 461 N 1.48 5.30 -0.09 0.89 2.01 -1.26 -0.71 115.64 123.27 2ux0 s THR 461 Ca 0.05 0.50 0.04 0.00 0.31 0.00 0.00 61.69 62.59 2ux0 s THR 461 Cb -0.14 -3.57 0.00 0.00 0.01 0.00 0.00 72.50 68.79 2ux0 s THR 461 CO -0.03 0.50 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.31 2ux0 s THR 462 N -0.31 1.79 -0.29 -0.82 2.01 0.10 -4.99 115.64 113.13 2ux0 s THR 462 Ca 0.17 -0.87 -0.09 0.00 0.31 0.00 0.00 61.69 61.22 2ux0 s THR 462 Cb -0.13 -1.56 -0.02 0.00 0.01 0.00 0.00 72.50 70.80 2ux0 s THR 462 CO 0.06 0.50 0.13 -0.63 -0.69 0.00 0.00 174.62 173.98 2ux0 s ILE 463 N 0.38 4.56 -0.12 1.82 1.01 -1.26 -0.98 121.20 126.62 2ux0 s ILE 463 Ca -0.16 -0.29 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 2ux0 s ILE 463 Cb -0.17 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 2ux0 s ILE 463 CO 0.07 0.17 -0.03 -0.76 0.00 0.00 0.00 174.94 174.39 2ux0 s LEU 464 N 1.63 3.35 -1.31 2.97 1.43 0.02 -4.75 118.68 122.01 2ux0 s LEU 464 Ca 0.05 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.11 2ux0 s LEU 464 Cb -0.16 -1.78 -0.00 0.00 0.03 0.00 0.00 46.19 44.27 2ux0 s LEU 464 CO 0.06 0.27 0.63 0.59 0.23 0.00 0.00 176.35 178.13 2ux0 n ASN 465 N 2.86 -1.38 -4.75 2.29 5.03 -1.26 -2.26 115.26 115.79 2ux0 n ASN 465 Ca -0.18 -0.89 -0.35 0.00 0.87 0.00 0.00 54.58 54.03 2ux0 n ASN 465 Cb 0.53 -3.74 0.04 0.00 -1.02 0.00 0.00 39.78 35.60 2ux0 n ASN 465 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2ux0 s PRO 466 N -6.10 2.84 -0.04 3.52 0.04 -1.26 -4.68 135.00 129.32 2ux0 s PRO 466 Ca 0.05 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.88 2ux0 s PRO 466 Cb -0.02 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.63 2ux0 s PRO 466 CO 0.84 -1.30 -0.01 -1.58 0.04 0.00 0.00 177.00 174.99 2ux0 s HIS 467 N -1.71 0.53 -0.12 0.56 2.46 0.33 -5.00 115.29 112.33 2ux0 s HIS 467 Ca 0.76 -0.10 0.01 0.00 0.47 0.00 0.00 55.06 56.20 2ux0 s HIS 467 Cb -0.29 -0.58 -0.01 0.00 -0.13 0.00 0.00 32.58 31.57 2ux0 s HIS 467 CO 0.35 -0.19 -0.15 0.08 -2.47 0.00 0.00 174.74 172.37 2ux0 s VAL 468 N 1.20 2.92 -0.30 0.89 1.01 -1.26 -1.00 120.40 123.85 2ux0 s VAL 468 Ca -0.07 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 2ux0 s VAL 468 Cb -0.14 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 2ux0 s VAL 468 CO -0.02 0.53 0.16 -1.00 0.00 0.00 0.00 175.10 174.77 2ux0 s HIS 469 N 0.31 3.18 -0.27 5.22 3.76 0.35 -4.98 115.29 122.86 2ux0 s HIS 469 Ca -0.11 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.27 2ux0 s HIS 469 Cb -0.16 -2.36 -0.01 0.00 1.11 0.00 0.00 32.58 31.16 2ux0 s HIS 469 CO 0.06 -0.35 0.72 0.08 -0.85 0.00 0.00 174.74 174.41 2ux0 s VAL 470 N 1.67 4.89 -0.62 -0.90 1.01 -1.26 -1.44 120.40 123.75 2ux0 s VAL 470 Ca 0.06 1.22 0.03 0.00 0.00 0.00 0.00 61.98 63.29 2ux0 s VAL 470 Cb -0.16 -4.05 0.37 0.00 0.00 0.00 0.00 36.38 32.54 2ux0 s VAL 470 CO 0.08 -0.10 1.28 -0.38 0.00 0.00 0.00 175.10 175.98 2ux0 n ILE 471 N 5.33 3.25 0.00 2.22 5.41 -0.47 -5.00 119.36 130.10 2ux0 n ILE 471 Ca 0.02 -5.19 0.00 0.00 1.00 0.00 0.00 62.75 58.58 2ux0 n ILE 471 Cb 0.48 -1.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.07 2ux0 n ILE 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ux0 n GLY 472 N -0.36 0.51 0.38 7.39 0.00 -1.25 -4.18 105.19 107.69 2ux0 n GLY 472 Ca 0.39 -1.96 0.15 0.00 0.00 0.00 0.00 46.02 44.61 2ux0 n GLY 472 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ux0 h GLU 473 N 0.00 0.48 -0.02 1.61 -0.00 -2.04 -3.04 114.58 111.58 2ux0 h GLU 473 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 2ux0 h GLU 473 Cb 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 28.75 28.64 2ux0 h GLU 473 CO 0.00 0.32 0.00 -0.40 -0.00 0.00 0.00 179.01 178.93 2ux0 n ASP 474 N -4.51 1.86 -4.01 3.06 5.68 -1.26 -4.96 116.55 112.41 2ux0 n ASP 474 Ca 0.17 -1.82 -0.16 0.00 -0.50 0.00 0.00 54.79 52.48 2ux0 n ASP 474 Cb 0.55 -0.01 -0.14 0.00 -1.14 0.00 0.00 41.12 40.39 2ux0 n ASP 474 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ux0 s ALA 475 N -0.82 0.59 0.32 2.12 0.00 -1.15 -0.74 121.76 122.08 2ux0 s ALA 475 Ca 0.01 -0.42 -0.11 0.00 0.00 0.00 0.00 51.96 51.44 2ux0 s ALA 475 Cb 0.01 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.04 2ux0 s ALA 475 CO 0.01 0.11 0.59 0.00 0.00 0.00 0.00 175.76 176.46 2ux0 s ALA 476 N -0.47 -0.15 -0.25 0.00 0.00 -0.82 -1.37 121.76 118.71 2ux0 s ALA 476 Ca -0.00 -0.99 -0.13 0.00 0.00 0.00 0.00 51.96 50.84 2ux0 s ALA 476 Cb -0.04 0.97 0.08 0.00 0.00 0.00 0.00 23.12 24.13 2ux0 s ALA 476 CO 0.00 -0.89 0.58 0.00 0.00 0.00 0.00 175.76 175.45 2ux0 s ILE 478 N 1.84 1.88 -0.08 0.00 2.07 -0.12 -0.49 121.20 126.28 2ux0 s ILE 478 Ca -0.09 -0.95 0.05 0.00 -1.41 0.00 0.00 60.65 58.25 2ux0 s ILE 478 Cb -0.08 -1.61 -0.00 0.00 0.13 0.00 0.00 42.46 40.90 2ux0 s ILE 478 CO -0.17 0.52 -0.24 0.00 -1.91 0.00 0.00 174.94 173.14 2ux0 s ALA 479 N 0.10 2.13 0.13 1.50 0.00 -0.17 -0.93 121.76 124.52 2ux0 s ALA 479 Ca -0.09 -0.98 -0.18 0.00 0.00 0.00 0.00 51.96 50.71 2ux0 s ALA 479 Cb -0.15 -0.75 0.04 0.00 0.00 0.00 0.00 23.12 22.26 2ux0 s ALA 479 CO 0.05 0.33 0.44 1.52 0.00 0.00 0.00 175.76 178.10 2ux0 s TYR 480 N 0.17 -0.27 -0.12 0.00 -0.85 -0.35 -0.51 117.35 115.42 2ux0 s TYR 480 Ca -0.13 -0.00 -0.09 0.00 -0.52 0.00 0.00 57.07 56.32 2ux0 s TYR 480 Cb -0.16 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.45 2ux0 s TYR 480 CO 0.07 -0.72 0.19 0.42 -1.52 0.00 0.00 175.55 173.99 2ux0 s ILE 481 N -3.70 5.40 -0.22 -3.49 1.01 -0.96 -0.55 121.20 118.69 2ux0 s ILE 481 Ca 0.02 0.34 -0.01 0.00 0.00 0.00 0.00 60.65 61.00 2ux0 s ILE 481 Cb 0.01 -3.48 0.02 0.00 0.01 0.00 0.00 42.46 39.02 2ux0 s ILE 481 CO -0.12 0.56 -0.11 -0.60 0.00 0.00 0.00 174.94 174.67 2ux0 s ARG 482 N -0.66 2.95 -0.19 2.79 3.52 0.55 -0.80 118.95 127.12 2ux0 s ARG 482 Ca 0.15 -0.88 -0.09 0.00 -0.13 0.00 0.00 55.73 54.78 2ux0 s ARG 482 Cb -0.13 -2.83 -0.05 0.00 -1.56 0.00 0.00 34.95 30.38 2ux0 s ARG 482 CO 0.04 -0.31 0.11 -0.51 -0.81 0.00 0.00 175.30 173.83 2ux0 s LEU 483 N 1.32 4.12 -0.17 -0.88 1.43 -0.15 -1.08 118.68 123.27 2ux0 s LEU 483 Ca 0.02 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 2ux0 s LEU 483 Cb -0.15 -2.05 0.03 0.00 0.03 0.00 0.00 46.19 44.04 2ux0 s LEU 483 CO -0.07 0.20 -0.14 -0.89 0.23 0.00 0.00 176.35 175.67 2ux0 s THR 484 N 0.23 1.72 0.02 5.49 2.01 -0.27 0.02 115.64 124.86 2ux0 s THR 484 Ca 0.07 -0.84 -0.18 0.00 0.31 0.00 0.00 61.69 61.05 2ux0 s THR 484 Cb -0.11 -1.66 -0.06 0.00 0.01 0.00 0.00 72.50 70.68 2ux0 s THR 484 CO -0.01 0.38 0.53 -1.10 -0.69 0.00 0.00 174.62 173.73 2ux0 s GLN 485 N 1.40 4.18 0.33 4.92 -0.21 0.11 -1.34 119.66 129.06 2ux0 s GLN 485 Ca 0.03 0.63 -0.16 0.00 0.02 0.00 0.00 55.36 55.88 2ux0 s GLN 485 Cb -0.14 -3.28 0.03 0.00 1.00 0.00 0.00 33.01 30.62 2ux0 s GLN 485 CO -0.10 0.53 0.72 1.52 -2.12 0.00 0.00 175.29 175.84 2ux0 s TYR 486 N -0.69 0.09 -0.08 0.91 -0.85 -0.70 -1.62 117.35 114.40 2ux0 s TYR 486 Ca 0.28 -0.64 0.03 0.00 -0.52 0.00 0.00 57.07 56.22 2ux0 s TYR 486 Cb -0.18 0.68 -0.02 0.00 0.38 0.00 0.00 41.96 42.82 2ux0 s TYR 486 CO 0.16 -1.38 -0.16 0.42 -1.52 0.00 0.00 175.55 173.07 2ux0 s ILE 487 N -3.07 2.84 0.58 -3.49 1.01 -1.26 -0.92 121.20 116.90 2ux0 s ILE 487 Ca 0.15 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 60.08 2ux0 s ILE 487 Cb -0.05 -2.13 0.07 0.00 0.01 0.00 0.00 42.46 40.36 2ux0 s ILE 487 CO 0.10 0.56 0.80 1.51 0.00 0.00 0.00 174.94 177.91 2ux0 s ASP 488 N -0.16 5.05 0.26 3.58 3.84 0.17 -4.97 116.67 124.43 2ux0 s ASP 488 Ca -0.01 -0.45 -0.05 0.00 -0.00 0.00 0.00 52.55 52.04 2ux0 s ASP 488 Cb -0.14 -0.24 0.29 0.00 -1.38 0.00 0.00 42.92 41.46 2ux0 s ASP 488 CO 0.03 -1.32 1.87 1.23 -0.00 0.00 0.00 175.17 176.99 2ux0 h GLY 489 N 0.06 1.23 1.37 2.12 0.00 -2.01 -1.95 103.07 103.89 2ux0 h GLY 489 Ca -0.36 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.40 2ux0 h GLY 489 CO 0.44 0.54 0.00 -1.06 0.00 0.00 0.00 176.54 176.46 2ux0 n GLN 490 N -4.34 0.25 0.00 4.80 3.00 -1.26 -4.83 117.38 115.00 2ux0 n GLN 490 Ca 0.08 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 2ux0 n GLN 490 Cb 0.11 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.85 2ux0 n GLN 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ux0 n GLY 491 N -0.25 2.88 3.78 1.08 0.00 -0.73 -5.09 105.19 106.86 2ux0 n GLY 491 Ca 0.07 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 2ux0 n GLY 491 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ux0 s ARG 492 N 0.00 3.12 0.11 1.61 1.70 -1.26 -4.26 118.95 119.97 2ux0 s ARG 492 Ca 0.00 1.40 -0.16 0.00 -0.47 0.00 0.00 55.73 56.50 2ux0 s ARG 492 Cb 0.00 -1.99 -0.07 0.00 -0.57 0.00 0.00 34.95 32.32 2ux0 s ARG 492 CO 0.00 -1.00 0.54 -1.25 -1.08 0.00 0.00 175.30 172.51 2ux0 s PRO 493 N -3.84 4.05 0.17 3.89 0.04 -1.26 0.46 135.00 138.50 2ux0 s PRO 493 Ca 0.68 0.56 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 2ux0 s PRO 493 Cb -0.20 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 2ux0 s PRO 493 CO 0.36 0.55 0.09 1.03 0.04 0.00 0.00 177.00 179.07 2ux0 s ARG 494 N -1.60 1.07 0.05 4.56 0.52 -0.09 -4.95 118.95 118.51 2ux0 s ARG 494 Ca 0.34 -1.54 0.08 0.00 -0.52 0.00 0.00 55.73 54.08 2ux0 s ARG 494 Cb -0.17 0.25 -0.03 0.00 0.52 0.00 0.00 34.95 35.53 2ux0 s ARG 494 CO 0.19 -0.33 -0.22 0.99 0.02 0.00 0.00 175.30 175.95 2ux0 s THR 495 N -4.10 1.77 0.01 0.02 2.01 -1.26 -1.73 115.64 112.37 2ux0 s THR 495 Ca 0.32 -1.28 0.04 0.00 0.31 0.00 0.00 61.69 61.08 2ux0 s THR 495 Cb 0.07 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 71.02 2ux0 s THR 495 CO 0.07 0.21 -0.12 -0.94 -0.69 0.00 0.00 174.62 173.15 2ux0 s SER 496 N -1.28 1.45 -0.03 3.53 1.04 -0.45 -4.96 113.70 113.01 2ux0 s SER 496 Ca 0.08 -0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.22 2ux0 s SER 496 Cb -0.09 -0.13 -0.03 0.00 0.10 0.00 0.00 66.02 65.87 2ux0 s SER 496 CO 0.02 0.08 -0.11 -1.58 0.98 0.00 0.00 173.24 172.64 2ux0 s GLN 497 N -0.66 2.53 0.03 4.02 0.74 -1.26 -1.11 119.66 123.94 2ux0 s GLN 497 Ca 0.03 -0.70 -0.04 0.00 0.05 0.00 0.00 55.36 54.70 2ux0 s GLN 497 Cb -0.06 -2.44 -0.01 0.00 1.10 0.00 0.00 33.01 31.59 2ux0 s GLN 497 CO 0.00 0.62 0.07 -1.54 -0.55 0.00 0.00 175.29 173.89 2ux0 s SER 498 N -1.01 0.18 -0.16 6.67 1.04 -0.24 -4.26 113.70 115.92 2ux0 s SER 498 Ca 0.14 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 56.04 2ux0 s SER 498 Cb -0.11 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 2ux0 s SER 498 CO 0.03 -0.45 -0.04 -1.61 0.98 0.00 0.00 173.24 172.15 2ux0 s GLU 499 N -2.22 3.61 -0.03 4.02 8.01 -0.09 -0.33 118.70 131.66 2ux0 s GLU 499 Ca -0.08 -0.55 0.02 0.00 0.01 0.00 0.00 54.97 54.37 2ux0 s GLU 499 Cb -0.04 -2.91 0.01 0.00 -4.31 0.00 0.00 34.13 26.88 2ux0 s GLU 499 CO -0.03 0.18 -0.08 -1.21 0.01 0.00 0.00 175.26 174.13 2ux0 s GLU 500 N 0.52 0.97 -0.11 1.61 2.02 0.28 -1.06 118.70 122.92 2ux0 s GLU 500 Ca -0.04 -0.27 0.02 0.00 0.02 0.00 0.00 54.97 54.71 2ux0 s GLU 500 Cb -0.14 -0.90 -0.01 0.00 0.10 0.00 0.00 34.13 33.18 2ux0 s GLU 500 CO 0.03 0.07 -0.19 0.99 0.02 0.00 0.00 175.26 176.18 2ux0 s THR 501 N 0.36 2.55 -0.07 3.63 2.01 0.53 -1.21 115.64 123.45 2ux0 s THR 501 Ca -0.06 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.13 2ux0 s THR 501 Cb -0.10 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.39 2ux0 s THR 501 CO 0.01 0.54 -0.17 -0.13 -0.69 0.00 0.00 174.62 174.18 2ux0 s ARG 502 N 0.35 2.08 -0.14 4.92 1.81 -0.11 -1.15 118.95 126.71 2ux0 s ARG 502 Ca -0.15 -0.59 -0.05 0.00 -1.72 0.00 0.00 55.73 53.22 2ux0 s ARG 502 Cb -0.17 -1.68 -0.04 0.00 -0.45 0.00 0.00 34.95 32.61 2ux0 s ARG 502 CO 0.07 0.13 0.03 0.08 -0.68 0.00 0.00 175.30 174.93 2ux0 s VAL 503 N 0.41 4.50 0.00 3.52 1.01 -0.55 -0.95 120.40 128.35 2ux0 s VAL 503 Ca -0.13 -0.15 0.08 0.00 0.00 0.00 0.00 61.98 61.78 2ux0 s VAL 503 Cb -0.15 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2ux0 s VAL 503 CO 0.05 0.53 -0.26 0.26 0.00 0.00 0.00 175.10 175.68 2ux0 s TRP 504 N -0.20 2.29 -0.06 5.22 0.52 -0.17 -1.11 118.94 125.43 2ux0 s TRP 504 Ca 0.06 -0.42 -0.00 0.00 0.02 0.00 0.00 56.10 55.75 2ux0 s TRP 504 Cb -0.12 -1.44 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 2ux0 s TRP 504 CO 0.02 0.01 -0.02 -1.58 0.02 0.00 0.00 176.95 175.40 2ux0 s HIS 505 N -0.67 0.74 -0.31 -1.98 2.46 0.07 -1.95 115.29 113.65 2ux0 s HIS 505 Ca 0.10 -0.21 -0.24 0.00 0.47 0.00 0.00 55.06 55.18 2ux0 s HIS 505 Cb -0.10 -0.76 0.00 0.00 -0.13 0.00 0.00 32.58 31.60 2ux0 s HIS 505 CO 0.00 -0.28 0.81 0.50 -2.47 0.00 0.00 174.74 173.30 2ux0 s ARG 506 N 1.49 3.96 -0.11 2.88 3.52 0.08 -0.67 118.95 130.11 2ux0 s ARG 506 Ca -0.02 0.62 0.02 0.00 -0.13 0.00 0.00 55.73 56.22 2ux0 s ARG 506 Cb -0.13 -3.73 0.01 0.00 -1.56 0.00 0.00 34.95 29.54 2ux0 s ARG 506 CO -0.03 -0.70 -0.18 -0.98 -0.81 0.00 0.00 175.30 172.60 2ux0 s ARG 507 N 3.02 2.48 -1.37 5.12 3.03 -0.47 -4.77 118.95 125.99 2ux0 s ARG 507 Ca 0.33 -0.67 -0.03 0.00 2.03 0.00 0.00 55.73 57.40 2ux0 s ARG 507 Cb -0.14 -2.03 -0.00 0.00 -1.03 0.00 0.00 34.95 31.75 2ux0 s ARG 507 CO 0.13 -0.00 0.48 -0.25 -1.13 0.00 0.00 175.30 174.53 2ux0 n ASP 508 N 4.02 -0.94 0.00 -2.89 8.00 -1.26 -2.13 116.55 121.35 2ux0 n ASP 508 Ca -0.20 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.31 2ux0 n ASP 508 Cb 0.52 -3.14 0.00 0.00 -0.02 0.00 0.00 41.12 38.47 2ux0 n ASP 508 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ux0 n GLY 509 N -1.92 0.69 3.28 0.44 0.00 -1.26 -4.98 105.19 101.43 2ux0 n GLY 509 Ca -0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 2ux0 n GLY 509 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ux0 s LYS 510 N -0.35 3.21 0.05 1.61 0.00 -0.90 -5.10 119.74 118.27 2ux0 s LYS 510 Ca 0.00 -0.77 -0.31 0.00 0.00 0.00 0.00 55.97 54.90 2ux0 s LYS 510 Cb 0.00 -2.53 -0.06 0.00 0.00 0.00 0.00 37.83 35.24 2ux0 s LYS 510 CO 0.00 0.12 1.22 -1.58 0.00 0.00 0.00 175.35 175.11 2ux0 s TRP 511 N 0.54 3.39 -0.01 1.78 0.52 -1.26 -1.37 118.94 122.53 2ux0 s TRP 511 Ca -0.11 1.26 0.05 0.00 0.02 0.00 0.00 56.10 57.32 2ux0 s TRP 511 Cb -0.16 -3.45 -0.01 0.00 -1.15 0.00 0.00 33.47 28.70 2ux0 s TRP 511 CO 0.04 -1.39 -0.16 -0.51 0.02 0.00 0.00 176.95 174.95 2ux0 s LEU 512 N 1.18 2.04 -0.28 2.99 1.43 0.16 -4.84 118.68 121.36 2ux0 s LEU 512 Ca 0.59 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.13 2ux0 s LEU 512 Cb -0.30 -0.84 0.01 0.00 0.03 0.00 0.00 46.19 45.08 2ux0 s LEU 512 CO 0.29 0.20 0.91 0.21 0.23 0.00 0.00 176.35 178.19 2ux0 s ASN 513 N -0.41 6.84 -0.08 2.29 3.04 -0.43 -0.75 114.94 125.44 2ux0 s ASN 513 Ca 0.06 0.96 0.18 0.00 0.04 0.00 0.00 52.86 54.11 2ux0 s ASN 513 Cb -0.06 -2.47 -0.27 0.00 -1.54 0.00 0.00 41.25 36.91 2ux0 s ASN 513 CO -0.01 -0.67 0.29 1.33 -3.04 0.00 0.00 177.10 175.00 2ux0 n VAL 514 N 5.52 0.45 -3.80 -5.21 0.24 -0.27 -1.39 118.33 113.87 2ux0 n VAL 514 Ca 0.08 -0.56 -0.12 0.00 -2.04 0.00 0.00 64.34 61.70 2ux0 n VAL 514 Cb 0.47 -0.16 -0.09 0.00 -1.47 0.00 0.00 33.84 32.60 2ux0 n VAL 514 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2ux0 s HIS 515 N -3.00 -0.10 -0.10 6.34 5.65 -1.22 -2.01 115.29 120.84 2ux0 s HIS 515 Ca -0.08 0.14 -0.04 0.00 0.25 0.00 0.00 55.06 55.32 2ux0 s HIS 515 Cb 0.10 0.04 0.05 0.00 -1.18 0.00 0.00 32.58 31.59 2ux0 s HIS 515 CO 0.77 -0.34 0.22 -0.47 -0.65 0.00 0.00 174.74 174.27 2ux0 s TYR 516 N -1.29 -0.30 -0.12 3.88 5.04 -0.74 -1.48 117.35 122.35 2ux0 s TYR 516 Ca -0.13 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.24 2ux0 s TYR 516 Cb -0.06 -0.03 0.02 0.00 0.35 0.00 0.00 41.96 42.24 2ux0 s TYR 516 CO 0.03 -0.25 -0.11 -1.58 -1.34 0.00 0.00 175.55 172.30 2ux0 s HIS 517 N 1.57 1.78 -0.07 4.97 5.65 -0.30 -0.94 115.29 127.95 2ux0 s HIS 517 Ca -0.06 -0.91 0.03 0.00 0.25 0.00 0.00 55.06 54.38 2ux0 s HIS 517 Cb -0.11 -1.37 0.00 0.00 -1.18 0.00 0.00 32.58 29.93 2ux0 s HIS 517 CO -0.08 -0.54 -0.18 0.00 -0.65 0.00 0.00 174.74 173.30 2ux0 s SER 519 N 0.40 2.12 0.00 0.00 1.04 -0.23 -4.08 113.70 112.96 2ux0 s SER 519 Ca -0.14 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.85 2ux0 s SER 519 Cb -0.16 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2ux0 s SER 519 CO 0.05 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2ux0 n GLY 520 N 2.10 1.94 3.68 7.32 0.00 -1.26 -0.91 105.19 118.05 2ux0 n GLY 520 Ca -0.17 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2ux0 n GLY 520 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32