#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h82 s ASN 356 N 0.00 7.28 0.08 -1.43 0.02 -1.26 -5.05 114.94 114.58 3h82 s ASN 356 Ca 0.00 2.23 0.02 0.00 -1.02 0.00 0.00 52.86 54.09 3h82 s ASN 356 Cb 0.00 -2.62 -0.04 0.00 0.02 0.00 0.00 41.25 38.61 3h82 s ASN 356 CO 0.00 -0.13 -0.08 0.54 0.02 0.00 0.00 177.10 177.45 3h82 s VAL 357 N -1.19 0.70 -0.23 1.60 0.11 -1.26 -5.10 120.40 115.03 3h82 s VAL 357 Ca 0.45 -1.64 -0.29 0.00 -2.93 0.00 0.00 61.98 57.57 3h82 s VAL 357 Cb -0.31 -1.32 -0.01 0.00 -1.53 0.00 0.00 36.38 33.21 3h82 s VAL 357 CO 0.40 -0.68 1.39 0.00 -3.33 0.00 0.00 175.10 172.88 3h82 s GLN 359 N 4.12 4.39 0.53 0.00 -0.21 -1.26 -5.01 119.66 122.22 3h82 s GLN 359 Ca 0.61 1.85 -0.22 0.00 0.02 0.00 0.00 55.36 57.62 3h82 s GLN 359 Cb -0.21 -3.34 -0.05 0.00 1.00 0.00 0.00 33.01 30.41 3h82 s GLN 359 CO 0.23 -0.32 1.31 -2.14 -2.12 0.00 0.00 175.29 172.24 3h82 s PRO 360 N 1.17 3.28 -0.08 2.91 0.02 -1.26 -4.97 135.00 136.08 3h82 s PRO 360 Ca 0.60 2.11 -0.23 0.00 0.02 0.00 0.00 61.00 63.50 3h82 s PRO 360 Cb -0.31 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 31.89 3h82 s PRO 360 CO 0.29 -1.04 0.71 0.95 -0.33 0.00 0.00 177.00 177.58 3h82 s THR 361 N -1.37 5.04 0.11 0.99 -4.23 -1.26 -5.02 115.64 109.90 3h82 s THR 361 Ca 0.70 1.45 -0.24 0.00 -1.18 0.00 0.00 61.69 62.42 3h82 s THR 361 Cb -0.37 -4.04 0.06 0.00 1.34 0.00 0.00 72.50 69.49 3h82 s THR 361 CO 0.44 0.23 0.58 0.00 -0.54 0.00 0.00 174.62 175.34 3h82 s ARG 362 N 0.92 1.19 0.05 3.99 1.70 -1.26 -1.39 118.95 124.16 3h82 s ARG 362 Ca 0.37 -0.35 -0.09 0.00 -0.47 0.00 0.00 55.73 55.20 3h82 s ARG 362 Cb -0.18 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 3h82 s ARG 362 CO 0.18 -0.49 0.17 -0.59 -1.08 0.00 0.00 175.30 173.49 3h82 s PHE 363 N -3.19 0.10 0.03 5.89 -0.71 -0.43 -4.74 117.98 114.93 3h82 s PHE 363 Ca -0.02 -0.36 -0.07 0.00 -1.04 0.00 0.00 56.93 55.44 3h82 s PHE 363 Cb -0.01 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.70 3h82 s PHE 363 CO -0.08 -0.43 0.31 0.42 -1.34 0.00 0.00 175.22 174.10 3h82 s ILE 364 N -2.75 5.23 0.05 -4.49 1.01 -1.26 -0.61 121.20 118.38 3h82 s ILE 364 Ca -0.04 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.84 3h82 s ILE 364 Cb -0.00 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 3h82 s ILE 364 CO -0.05 0.33 -0.02 -0.94 0.00 0.00 0.00 174.94 174.27 3h82 s SER 365 N -1.75 0.44 0.11 3.58 1.04 -0.18 -1.06 113.70 115.87 3h82 s SER 365 Ca 0.30 -0.92 0.10 0.00 0.48 0.00 0.00 55.95 55.91 3h82 s SER 365 Cb -0.13 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 3h82 s SER 365 CO 0.17 -0.57 -0.24 -0.60 0.98 0.00 0.00 173.24 172.98 3h82 s ARG 366 N -3.63 1.62 0.02 4.02 3.52 -0.26 -0.56 118.95 123.68 3h82 s ARG 366 Ca 0.04 -1.24 0.01 0.00 -0.13 0.00 0.00 55.73 54.41 3h82 s ARG 366 Cb 0.06 -2.00 -0.02 0.00 -1.56 0.00 0.00 34.95 31.43 3h82 s ARG 366 CO -0.09 0.48 -0.04 -1.01 -0.81 0.00 0.00 175.30 173.82 3h82 s HIS 367 N -1.04 0.37 0.99 5.12 3.76 -0.11 -0.17 115.29 124.21 3h82 s HIS 367 Ca 0.15 -0.43 -0.13 0.00 -0.15 0.00 0.00 55.06 54.50 3h82 s HIS 367 Cb -0.10 -0.24 0.18 0.00 1.11 0.00 0.00 32.58 33.53 3h82 s HIS 367 CO 0.07 -0.12 1.12 0.54 -0.85 0.00 0.00 174.74 175.49 3h82 s ASN 368 N -1.24 2.77 0.57 1.40 2.20 -0.57 -0.84 114.94 119.23 3h82 s ASN 368 Ca -0.11 1.02 0.30 0.00 -0.94 0.00 0.00 52.86 53.13 3h82 s ASN 368 Cb -0.08 -1.60 1.73 0.00 -2.00 0.00 0.00 41.25 39.30 3h82 s ASN 368 CO -0.00 -3.02 2.19 0.40 -2.94 0.00 0.00 177.10 173.73 3h82 h ILE 369 N -1.82 0.48 0.00 0.54 1.08 -1.91 -0.63 117.51 115.25 3h82 h ILE 369 Ca -0.52 -0.22 -0.06 0.00 -0.39 0.00 0.00 64.86 63.67 3h82 h ILE 369 Cb 1.33 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 36.21 3h82 h ILE 369 CO 0.57 0.05 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.44 3h82 h GLU 370 N 0.00 0.00 0.00 2.37 3.07 -1.97 -3.45 114.58 114.60 3h82 h GLU 370 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3h82 h GLU 370 Cb 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 3h82 h GLU 370 CO 0.01 0.31 0.00 0.41 -1.40 0.00 0.00 179.01 178.33 3h82 n GLY 371 N 0.66 0.90 3.71 -3.84 0.00 -0.24 -4.94 105.19 101.44 3h82 n GLY 371 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3h82 n GLY 371 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h82 s ILE 372 N -2.00 3.18 0.06 -0.61 -1.09 -1.26 -1.87 121.20 117.61 3h82 s ILE 372 Ca 0.00 0.78 -0.30 0.00 -2.23 0.00 0.00 60.65 58.90 3h82 s ILE 372 Cb 0.00 -3.50 -0.09 0.00 -1.58 0.00 0.00 42.46 37.29 3h82 s ILE 372 CO 0.00 0.04 1.93 -0.36 -1.23 0.00 0.00 174.94 175.32 3h82 s PHE 373 N 1.58 1.50 -0.57 3.97 0.40 -0.10 -1.52 117.98 123.25 3h82 s PHE 373 Ca 0.67 -0.35 0.05 0.00 -0.60 0.00 0.00 56.93 56.71 3h82 s PHE 373 Cb -0.38 -4.23 0.02 0.00 0.51 0.00 0.00 43.02 38.94 3h82 s PHE 373 CO 0.30 -5.39 0.54 0.25 0.70 0.00 0.00 175.22 171.63 3h82 n THR 374 N 5.36 0.00 -3.65 0.64 -2.24 0.76 -1.10 114.28 114.05 3h82 n THR 374 Ca 0.19 -0.47 -0.14 0.00 -2.27 0.00 0.00 64.05 61.37 3h82 n THR 374 Cb 0.40 1.08 -0.08 0.00 -2.10 0.00 0.00 70.33 69.64 3h82 n THR 374 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3h82 s PHE 375 N -0.76 -0.67 -0.04 4.78 5.36 -1.08 -4.93 117.98 120.64 3h82 s PHE 375 Ca 0.05 1.57 -0.02 0.00 -0.96 0.00 0.00 56.93 57.58 3h82 s PHE 375 Cb 0.04 0.25 0.03 0.00 -0.34 0.00 0.00 43.02 43.01 3h82 s PHE 375 CO 0.11 -0.37 0.05 0.08 -1.46 0.00 0.00 175.22 173.63 3h82 s VAL 376 N 0.10 -0.05 0.31 3.12 1.01 -1.26 -1.10 120.40 122.52 3h82 s VAL 376 Ca -0.02 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.05 3h82 s VAL 376 Cb -0.04 -0.19 -0.10 0.00 0.00 0.00 0.00 36.38 36.04 3h82 s VAL 376 CO 0.02 0.19 1.36 -0.62 0.00 0.00 0.00 175.10 176.05 3h82 s ASP 377 N 2.10 6.70 0.18 3.32 2.15 -0.23 -4.83 116.67 126.06 3h82 s ASP 377 Ca 0.04 2.71 0.14 0.00 0.43 0.00 0.00 52.55 55.87 3h82 s ASP 377 Cb -0.12 -2.64 0.71 0.00 -0.30 0.00 0.00 42.92 40.57 3h82 s ASP 377 CO -0.03 -0.61 1.43 1.57 -0.17 0.00 0.00 175.17 177.36 3h82 n HIS 378 N 1.22 0.44 0.12 -5.34 -0.00 -1.26 -1.00 115.22 109.40 3h82 n HIS 378 Ca 0.02 0.21 0.03 0.00 -0.00 0.00 0.00 57.72 57.99 3h82 n HIS 378 Cb 0.41 -0.84 0.15 0.00 -0.00 0.00 0.00 29.99 29.71 3h82 n HIS 378 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 3h82 n ARG 379 N -1.94 0.02 0.26 1.57 1.74 -1.26 -2.14 116.66 114.91 3h82 n ARG 379 Ca -0.00 0.47 0.08 0.00 -0.77 0.00 0.00 57.85 57.63 3h82 n ARG 379 Cb 0.06 -1.57 0.64 0.00 -1.02 0.00 0.00 32.46 30.57 3h82 n ARG 379 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h82 h VAL 381 N 0.00 1.19 0.00 0.00 2.07 -1.33 0.47 116.25 118.65 3h82 h VAL 381 Ca -0.00 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 3h82 h VAL 381 Cb 0.05 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3h82 h VAL 381 CO 0.00 0.21 -0.32 0.00 0.02 0.00 0.00 177.57 177.48 3h82 h ALA 382 N 0.98 1.09 0.05 1.67 0.00 -1.68 -0.54 119.26 120.82 3h82 h ALA 382 Ca 0.12 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 3h82 h ALA 382 Cb 0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3h82 h ALA 382 CO -0.01 0.40 -0.79 1.15 0.00 0.00 0.00 179.25 180.00 3h82 h THR 383 N 0.00 1.34 0.00 0.00 2.02 -0.88 -3.43 112.91 111.96 3h82 h THR 383 Ca -0.00 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.83 3h82 h THR 383 Cb 0.77 2.90 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 3h82 h THR 383 CO 0.04 0.57 0.00 1.33 0.37 0.00 0.00 175.52 177.83 3h82 n VAL 384 N -4.32 0.00 -0.41 3.16 0.24 0.11 -4.94 118.33 112.17 3h82 n VAL 384 Ca -0.20 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 3h82 n VAL 384 Cb 0.69 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 34.13 3h82 n VAL 384 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h82 n GLY 385 N 0.45 0.81 3.87 7.63 0.00 -0.21 -0.60 105.19 117.13 3h82 n GLY 385 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3h82 n GLY 385 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h82 s TYR 386 N -2.88 3.51 0.53 1.61 2.02 -1.25 -4.70 117.35 116.19 3h82 s TYR 386 Ca 0.00 0.87 -0.18 0.00 -0.37 0.00 0.00 57.07 57.39 3h82 s TYR 386 Cb 0.00 -2.24 -0.07 0.00 -0.40 0.00 0.00 41.96 39.25 3h82 s TYR 386 CO 0.00 0.38 1.05 -0.65 -1.57 0.00 0.00 175.55 174.76 3h82 s GLN 387 N -2.41 3.60 0.30 -0.62 -1.52 -1.26 -3.01 119.66 114.74 3h82 s GLN 387 Ca 0.41 1.31 0.04 0.00 -1.95 0.00 0.00 55.36 55.17 3h82 s GLN 387 Cb -0.13 -2.07 0.65 0.00 -0.22 0.00 0.00 33.01 31.25 3h82 s GLN 387 CO 0.20 -0.59 1.81 -1.35 -0.25 0.00 0.00 175.29 175.12 3h82 h PRO 388 N 1.11 0.85 0.00 2.91 0.11 -1.89 0.78 132.00 135.86 3h82 h PRO 388 Ca -0.48 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 3h82 h PRO 388 Cb 1.22 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 3h82 h PRO 388 CO 0.58 0.56 -0.01 -0.56 -0.21 0.00 0.00 178.00 178.37 3h82 h GLN 389 N 0.88 0.00 0.00 1.05 -0.00 -1.93 -0.17 115.11 114.94 3h82 h GLN 389 Ca 0.53 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 59.16 3h82 h GLN 389 Cb 0.68 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.16 3h82 h GLN 389 CO -0.31 0.01 -0.10 0.93 -0.00 0.00 0.00 178.83 179.36 3h82 h GLU 390 N 0.00 0.00 0.00 0.06 5.08 -1.21 -3.32 114.58 115.20 3h82 h GLU 390 Ca -0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.97 3h82 h GLU 390 Cb 0.21 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.39 3h82 h GLU 390 CO 0.00 0.10 -2.46 1.28 -1.00 0.00 0.00 179.01 176.93 3h82 n LEU 391 N -3.18 2.41 -4.58 1.33 4.77 -0.36 -4.86 117.00 112.53 3h82 n LEU 391 Ca 0.01 -0.11 -0.51 0.00 -0.03 0.00 0.00 56.01 55.37 3h82 n LEU 391 Cb 0.42 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.82 3h82 n LEU 391 CO 0.31 0.86 0.81 0.18 -1.33 0.00 0.00 177.39 178.22 3h82 n LEU 392 N -3.16 1.54 0.00 2.23 4.77 -0.22 -1.28 117.00 120.88 3h82 n LEU 392 Ca -0.43 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 3h82 n LEU 392 Cb 1.02 -1.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3h82 n LEU 392 CO 0.29 -1.19 0.00 0.61 -1.33 0.00 0.00 177.39 175.77 3h82 n GLY 393 N 2.27 2.01 3.93 -0.72 0.00 -0.25 -4.97 105.19 107.46 3h82 n GLY 393 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3h82 n GLY 393 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h82 s LYS 394 N -0.35 3.31 0.08 1.61 1.02 -0.41 -4.82 119.74 120.18 3h82 s LYS 394 Ca 0.00 -0.80 -0.26 0.00 0.02 0.00 0.00 55.97 54.93 3h82 s LYS 394 Cb 0.00 -2.82 -0.06 0.00 -0.52 0.00 0.00 37.83 34.43 3h82 s LYS 394 CO 0.00 0.44 0.81 1.21 -0.92 0.00 0.00 175.35 176.89 3h82 s ASN 395 N -3.78 7.30 0.53 2.83 3.84 -1.26 -0.92 114.94 123.48 3h82 s ASN 395 Ca 0.34 1.55 0.20 0.00 0.21 0.00 0.00 52.86 55.16 3h82 s ASN 395 Cb -0.09 -2.50 1.40 0.00 -0.55 0.00 0.00 41.25 39.51 3h82 s ASN 395 CO 0.28 0.03 2.16 -0.29 -2.79 0.00 0.00 177.10 176.48 3h82 h ILE 396 N 3.98 0.87 -0.08 -5.21 2.10 -1.73 -1.12 117.51 116.31 3h82 h ILE 396 Ca -0.44 -0.11 0.02 0.00 1.08 0.00 0.00 64.86 65.42 3h82 h ILE 396 Cb 1.21 1.06 -0.00 0.00 -1.09 0.00 0.00 36.82 37.99 3h82 h ILE 396 CO 0.70 0.03 0.08 0.58 -1.08 0.00 0.00 178.15 178.46 3h82 h VAL 397 N 0.00 0.62 0.00 2.19 2.07 -1.93 -1.02 116.25 118.18 3h82 h VAL 397 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3h82 h VAL 397 Cb 0.06 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3h82 h VAL 397 CO 0.00 0.00 -0.03 -0.33 0.02 0.00 0.00 177.57 177.24 3h82 h GLU 398 N 0.00 0.00 -0.24 1.57 5.08 -1.60 -1.50 114.58 117.90 3h82 h GLU 398 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3h82 h GLU 398 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3h82 h GLU 398 CO -0.00 0.03 0.00 1.19 -1.00 0.00 0.00 179.01 179.22 3h82 n PHE 399 N -3.43 0.30 -3.60 4.33 3.01 -0.39 -4.97 117.46 112.71 3h82 n PHE 399 Ca -0.02 -0.16 -0.37 0.00 1.01 0.00 0.00 57.45 57.90 3h82 n PHE 399 Cb 0.13 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.54 3h82 n PHE 399 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3h82 n HIS 401 N 2.28 1.58 -0.33 0.00 -0.00 -0.25 -4.75 115.22 113.75 3h82 n HIS 401 Ca -0.15 0.62 0.23 0.00 0.46 0.00 0.00 57.72 58.88 3h82 n HIS 401 Cb 0.53 -2.32 0.50 0.00 -0.12 0.00 0.00 29.99 28.57 3h82 n HIS 401 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3h82 h PRO 402 N 3.01 0.39 0.00 1.57 0.11 -1.94 0.12 132.00 135.26 3h82 h PRO 402 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3h82 h PRO 402 Cb 1.32 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3h82 h PRO 402 CO 0.67 0.26 0.00 0.93 -0.21 0.00 0.00 178.00 179.65 3h82 h GLU 403 N 0.40 0.00 -0.01 1.05 5.08 -1.99 -3.10 114.58 116.01 3h82 h GLU 403 Ca 0.61 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.97 3h82 h GLU 403 Cb 1.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.77 3h82 h GLU 403 CO -0.33 0.00 -0.26 -0.25 -1.00 0.00 0.00 179.01 177.17 3h82 n ASP 404 N -2.86 1.66 -0.15 1.42 8.00 0.36 -4.70 116.55 120.28 3h82 n ASP 404 Ca 0.01 -1.33 -0.03 0.00 0.71 0.00 0.00 54.79 54.15 3h82 n ASP 404 Cb 0.30 0.40 0.18 0.00 -0.02 0.00 0.00 41.12 41.98 3h82 n ASP 404 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 3h82 h GLN 405 N 1.87 0.87 -0.36 -1.24 4.20 -1.30 -1.14 115.11 118.00 3h82 h GLN 405 Ca 0.00 -0.17 -0.09 0.00 0.06 0.00 0.00 58.65 58.45 3h82 h GLN 405 Cb 0.53 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 3h82 h GLN 405 CO 0.00 0.77 -0.12 0.37 -0.67 0.00 0.00 178.83 179.18 3h82 h GLN 406 N 0.84 0.72 -0.95 1.46 5.75 -1.84 -0.41 115.11 120.68 3h82 h GLN 406 Ca 0.19 -0.29 0.04 0.00 -0.15 0.00 0.00 58.65 58.43 3h82 h GLN 406 Cb 0.28 -0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.74 3h82 h GLN 406 CO -0.00 0.89 0.62 1.25 -2.65 0.00 0.00 178.83 178.94 3h82 h LEU 407 N 0.52 1.03 -0.24 -2.39 5.85 -1.77 0.10 115.31 118.41 3h82 h LEU 407 Ca 0.09 -0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.62 3h82 h LEU 407 Cb 0.65 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3h82 h LEU 407 CO 0.04 0.70 -0.57 0.25 -0.34 0.00 0.00 178.44 178.53 3h82 h LEU 408 N 1.20 0.92 -0.76 2.25 5.85 -0.97 -1.50 115.31 122.30 3h82 h LEU 408 Ca 0.38 -0.56 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 3h82 h LEU 408 Cb 0.01 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 3h82 h LEU 408 CO -0.13 1.31 0.31 0.03 -0.34 0.00 0.00 178.44 179.62 3h82 h ARG 409 N 0.57 1.14 -0.12 1.25 3.08 -0.78 -1.89 114.38 117.62 3h82 h ARG 409 Ca -0.00 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.82 3h82 h ARG 409 Cb 1.18 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 3h82 h ARG 409 CO 0.12 0.92 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.50 3h82 h ASP 410 N 1.10 0.16 -0.10 7.04 3.32 -0.60 -2.04 116.42 125.31 3h82 h ASP 410 Ca 0.25 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 3h82 h ASP 410 Cb 0.21 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3h82 h ASP 410 CO -0.02 0.20 -0.17 0.77 -1.72 0.00 0.00 179.24 178.30 3h82 h SER 411 N 0.17 0.47 -0.50 6.45 4.64 -0.45 -1.50 113.55 122.83 3h82 h SER 411 Ca 0.04 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.16 3h82 h SER 411 Cb 0.14 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 3h82 h SER 411 CO 0.00 0.66 0.03 -0.26 -0.87 0.00 0.00 176.83 176.40 3h82 h PHE 412 N 0.43 0.93 -0.50 4.77 0.04 -1.13 0.20 116.94 121.69 3h82 h PHE 412 Ca 0.07 -0.15 -0.11 0.00 2.80 0.00 0.00 57.97 60.58 3h82 h PHE 412 Cb 0.55 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 3h82 h PHE 412 CO 0.02 0.86 -0.13 1.96 -0.60 0.00 0.00 178.31 180.41 3h82 h GLN 413 N 0.73 0.95 -0.51 1.51 4.20 -1.47 -2.80 115.11 117.71 3h82 h GLN 413 Ca 0.15 -0.35 -0.11 0.00 0.06 0.00 0.00 58.65 58.39 3h82 h GLN 413 Cb 0.47 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 3h82 h GLN 413 CO 0.02 1.02 -0.13 1.96 -0.67 0.00 0.00 178.83 181.03 3h82 h GLN 414 N 0.84 0.99 -0.18 1.46 4.20 -0.94 -2.10 115.11 119.38 3h82 h GLN 414 Ca 0.13 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.41 3h82 h GLN 414 Cb 0.68 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 3h82 h GLN 414 CO 0.05 1.06 -0.10 -0.24 -0.67 0.00 0.00 178.83 178.93 3h82 h VAL 415 N 0.85 1.18 -0.32 -0.54 3.04 -0.53 -1.76 116.25 118.16 3h82 h VAL 415 Ca 0.13 -0.76 -0.07 0.00 -1.01 0.00 0.00 66.70 64.99 3h82 h VAL 415 Cb 0.70 1.15 -0.01 0.00 -2.01 0.00 0.00 31.29 31.12 3h82 h VAL 415 CO 0.05 0.24 -0.09 0.58 -1.01 0.00 0.00 177.57 177.34 3h82 h VAL 416 N 0.27 1.28 0.00 1.51 2.07 -1.26 -2.82 116.25 117.30 3h82 h VAL 416 Ca 0.06 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 3h82 h VAL 416 Cb 0.35 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 3h82 h VAL 416 CO 0.02 0.37 -0.06 0.50 0.02 0.00 0.00 177.57 178.42 3h82 h LYS 417 N 0.39 0.00 0.00 1.57 3.64 -0.87 -1.04 116.57 120.26 3h82 h LYS 417 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3h82 h LYS 417 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3h82 h LYS 417 CO 0.03 0.06 0.00 1.28 -2.27 0.00 0.00 179.45 178.55 3h82 n LEU 418 N -3.97 0.32 -3.78 5.20 4.77 -0.71 -4.92 117.00 113.91 3h82 n LEU 418 Ca -0.03 0.54 -0.25 0.00 -0.03 0.00 0.00 56.01 56.25 3h82 n LEU 418 Cb 0.14 -0.46 0.04 0.00 -2.33 0.00 0.00 43.42 40.81 3h82 n LEU 418 CO 0.30 -0.18 0.04 0.29 -1.33 0.00 0.00 177.39 176.52 3h82 n LYS 419 N -1.82 -5.50 0.00 3.23 4.76 -0.40 -2.12 118.16 116.32 3h82 n LYS 419 Ca 0.05 0.63 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 3h82 n LYS 419 Cb 0.32 -5.40 0.00 0.00 -1.84 0.00 0.00 35.03 28.11 3h82 n LYS 419 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h82 n GLY 420 N -1.65 2.45 3.92 0.72 0.00 -1.26 -4.98 105.19 104.39 3h82 n GLY 420 Ca -0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 3h82 n GLY 420 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h82 s GLN 421 N -0.45 2.58 -0.03 1.61 -0.21 -0.90 -4.50 119.66 117.77 3h82 s GLN 421 Ca 0.00 -0.05 -0.20 0.00 0.02 0.00 0.00 55.36 55.13 3h82 s GLN 421 Cb 0.00 -2.19 -0.05 0.00 1.00 0.00 0.00 33.01 31.77 3h82 s GLN 421 CO 0.00 -0.99 0.59 0.08 -2.12 0.00 0.00 175.29 172.85 3h82 s VAL 422 N -3.16 4.97 -0.08 1.09 1.01 -1.26 -4.51 120.40 118.45 3h82 s VAL 422 Ca 0.57 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.80 3h82 s VAL 422 Cb -0.11 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 3h82 s VAL 422 CO 0.46 0.38 -0.14 -0.22 0.00 0.00 0.00 175.10 175.58 3h82 s LEU 423 N 0.04 2.72 0.07 3.92 2.96 0.14 -4.94 118.68 123.60 3h82 s LEU 423 Ca 0.31 -0.25 0.07 0.00 -0.22 0.00 0.00 54.13 54.04 3h82 s LEU 423 Cb -0.18 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 3h82 s LEU 423 CO 0.16 0.28 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.91 3h82 s SER 424 N -0.32 4.25 -0.07 3.68 0.01 -1.26 -0.46 113.70 119.53 3h82 s SER 424 Ca 0.03 -0.37 -0.09 0.00 1.31 0.00 0.00 55.95 56.82 3h82 s SER 424 Cb -0.13 -0.80 0.02 0.00 0.21 0.00 0.00 66.02 65.33 3h82 s SER 424 CO 0.02 0.21 0.24 0.54 0.41 0.00 0.00 173.24 174.67 3h82 s VAL 425 N -1.11 0.02 -0.16 3.43 0.11 -0.32 -4.99 120.40 117.38 3h82 s VAL 425 Ca 0.19 -0.15 -0.04 0.00 -2.93 0.00 0.00 61.98 59.05 3h82 s VAL 425 Cb -0.11 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.32 3h82 s VAL 425 CO 0.10 -0.08 -0.02 -0.32 -3.33 0.00 0.00 175.10 171.45 3h82 s MET 426 N -0.24 3.69 0.28 1.54 1.75 -1.26 -0.81 119.30 124.25 3h82 s MET 426 Ca -0.04 -0.49 -0.16 0.00 -1.25 0.00 0.00 55.69 53.75 3h82 s MET 426 Cb -0.03 -2.95 0.01 0.00 2.84 0.00 0.00 34.83 34.70 3h82 s MET 426 CO 0.01 0.26 0.61 -0.59 -0.65 0.00 0.00 175.02 174.66 3h82 s PHE 427 N 0.31 0.13 -0.23 4.11 -0.12 -0.25 -4.99 117.98 116.95 3h82 s PHE 427 Ca -0.03 -0.56 -0.10 0.00 -0.05 0.00 0.00 56.93 56.19 3h82 s PHE 427 Cb -0.14 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.66 3h82 s PHE 427 CO 0.03 -1.16 0.14 1.03 -0.05 0.00 0.00 175.22 175.21 3h82 s ARG 428 N -3.78 4.06 -0.11 1.99 0.52 -1.26 -0.17 118.95 120.19 3h82 s ARG 428 Ca 0.17 -0.28 -0.00 0.00 -0.52 0.00 0.00 55.73 55.10 3h82 s ARG 428 Cb -0.03 -3.48 -0.02 0.00 0.52 0.00 0.00 34.95 31.94 3h82 s ARG 428 CO 0.09 0.11 -0.11 0.12 0.02 0.00 0.00 175.30 175.53 3h82 s PHE 429 N 0.91 2.85 -0.37 -0.53 5.36 0.28 -1.09 117.98 125.38 3h82 s PHE 429 Ca 0.07 -0.41 -0.28 0.00 -0.96 0.00 0.00 56.93 55.35 3h82 s PHE 429 Cb -0.13 -1.81 0.02 0.00 -0.34 0.00 0.00 43.02 40.76 3h82 s PHE 429 CO 0.03 -0.04 1.05 0.50 -1.46 0.00 0.00 175.22 175.30 3h82 s ARG 430 N 0.02 3.92 0.99 10.12 3.52 0.11 -0.79 118.95 136.84 3h82 s ARG 430 Ca -0.03 0.82 -0.13 0.00 -0.13 0.00 0.00 55.73 56.25 3h82 s ARG 430 Cb -0.14 -3.80 0.18 0.00 -1.56 0.00 0.00 34.95 29.64 3h82 s ARG 430 CO 0.04 -1.04 1.13 -1.54 -0.81 0.00 0.00 175.30 173.08 3h82 s SER 431 N 1.92 2.74 0.36 -2.12 1.04 0.18 -4.86 113.70 112.96 3h82 s SER 431 Ca 0.44 0.96 0.06 0.00 0.48 0.00 0.00 55.95 57.89 3h82 s SER 431 Cb -0.11 -1.50 0.75 0.00 0.10 0.00 0.00 66.02 65.27 3h82 s SER 431 CO 0.20 -3.03 1.96 0.50 0.98 0.00 0.00 173.24 173.85 3h82 h LYS 432 N -1.83 0.72 -0.75 4.02 1.63 -1.13 0.13 116.57 119.36 3h82 h LYS 432 Ca -0.51 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.24 3h82 h LYS 432 Cb 1.32 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 3h82 h LYS 432 CO 0.55 0.48 0.00 -1.71 -3.45 0.00 0.00 179.45 175.32 3h82 n ASN 433 N -4.48 1.82 -1.92 4.20 5.15 -1.26 -4.87 115.26 113.89 3h82 n ASN 433 Ca 0.11 -2.17 -0.16 0.00 -0.60 0.00 0.00 54.58 51.77 3h82 n ASN 433 Cb 0.24 -0.45 0.01 0.00 -0.53 0.00 0.00 39.78 39.04 3h82 n ASN 433 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3h82 n GLN 434 N 0.11 -2.08 -4.70 1.20 1.13 0.46 -5.01 117.38 108.48 3h82 n GLN 434 Ca 0.06 0.71 -0.31 0.00 -1.94 0.00 0.00 57.00 55.52 3h82 n GLN 434 Cb 0.40 -5.05 -0.12 0.00 0.11 0.00 0.00 30.24 25.57 3h82 n GLN 434 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3h82 s GLU 435 N -4.99 2.23 -0.26 -1.09 2.02 -1.26 -4.88 118.70 110.47 3h82 s GLU 435 Ca 0.08 -0.88 -0.26 0.00 0.02 0.00 0.00 54.97 53.92 3h82 s GLU 435 Cb -0.04 -2.27 0.00 0.00 0.10 0.00 0.00 34.13 31.93 3h82 s GLU 435 CO 0.10 0.57 0.92 -1.58 0.02 0.00 0.00 175.26 175.29 3h82 s TRP 436 N -0.89 3.28 -0.12 1.61 0.52 -1.26 -0.65 118.94 121.43 3h82 s TRP 436 Ca 0.14 1.19 -0.02 0.00 0.02 0.00 0.00 56.10 57.43 3h82 s TRP 436 Cb -0.11 -3.24 -0.03 0.00 -1.15 0.00 0.00 33.47 28.94 3h82 s TRP 436 CO 0.05 -0.51 -0.04 -0.51 0.02 0.00 0.00 176.95 175.96 3h82 s LEU 437 N 3.09 3.28 -0.07 2.99 1.43 0.03 -4.87 118.68 124.56 3h82 s LEU 437 Ca 0.39 -0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.14 3h82 s LEU 437 Cb -0.15 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 3h82 s LEU 437 CO 0.09 0.26 1.32 0.26 0.23 0.00 0.00 176.35 178.51 3h82 s TRP 438 N -0.21 2.87 -0.05 0.29 0.52 -1.26 -0.56 118.94 120.54 3h82 s TRP 438 Ca 0.04 0.94 0.04 0.00 0.02 0.00 0.00 56.10 57.14 3h82 s TRP 438 Cb -0.13 -3.56 -0.02 0.00 -1.15 0.00 0.00 33.47 28.61 3h82 s TRP 438 CO 0.02 -1.99 -0.17 1.41 0.02 0.00 0.00 176.95 176.24 3h82 s MET 439 N 2.84 2.54 -0.24 4.98 1.75 0.76 -1.11 119.30 130.81 3h82 s MET 439 Ca 0.59 -0.76 -0.05 0.00 -1.25 0.00 0.00 55.69 54.23 3h82 s MET 439 Cb -0.26 -2.32 -0.00 0.00 2.84 0.00 0.00 34.83 35.08 3h82 s MET 439 CO 0.22 0.54 0.00 0.50 -0.65 0.00 0.00 175.02 175.63 3h82 s ARG 440 N -0.53 3.31 -0.21 4.11 3.52 0.15 -1.09 118.95 128.21 3h82 s ARG 440 Ca 0.07 -0.68 -0.06 0.00 -0.13 0.00 0.00 55.73 54.93 3h82 s ARG 440 Cb -0.11 -3.14 -0.03 0.00 -1.56 0.00 0.00 34.95 30.11 3h82 s ARG 440 CO 0.01 -0.27 0.02 0.99 -0.81 0.00 0.00 175.30 175.24 3h82 s THR 441 N 1.49 4.11 -0.20 4.11 2.01 0.01 -1.13 115.64 126.05 3h82 s THR 441 Ca 0.05 -0.26 -0.05 0.00 0.31 0.00 0.00 61.69 61.74 3h82 s THR 441 Cb -0.15 -2.87 -0.02 0.00 0.01 0.00 0.00 72.50 69.47 3h82 s THR 441 CO -0.01 0.42 -0.02 -0.44 -0.69 0.00 0.00 174.62 173.88 3h82 s SER 442 N 1.03 4.67 0.05 3.53 0.01 -0.35 -1.18 113.70 121.47 3h82 s SER 442 Ca 0.02 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.04 3h82 s SER 442 Cb -0.14 -1.80 -0.03 0.00 0.21 0.00 0.00 66.02 64.26 3h82 s SER 442 CO 0.02 0.05 -0.04 -0.94 0.41 0.00 0.00 173.24 172.74 3h82 s SER 443 N 1.08 0.57 0.06 2.44 1.04 0.39 -0.69 113.70 118.59 3h82 s SER 443 Ca 0.02 -0.74 -0.18 0.00 0.48 0.00 0.00 55.95 55.52 3h82 s SER 443 Cb -0.14 0.12 0.04 0.00 0.10 0.00 0.00 66.02 66.13 3h82 s SER 443 CO 0.01 -0.40 0.42 0.72 0.98 0.00 0.00 173.24 174.97 3h82 s PHE 444 N -2.54 -0.27 0.40 5.02 -0.71 -0.61 -0.68 117.98 118.59 3h82 s PHE 444 Ca -0.03 0.21 -0.09 0.00 -1.04 0.00 0.00 56.93 55.97 3h82 s PHE 444 Cb -0.02 0.24 -0.06 0.00 -1.21 0.00 0.00 43.02 41.97 3h82 s PHE 444 CO -0.04 -0.60 0.74 0.95 -1.34 0.00 0.00 175.22 174.93 3h82 s THR 445 N -2.65 4.85 -0.04 -4.49 -4.23 -1.26 -0.61 115.64 107.21 3h82 s THR 445 Ca -0.04 0.45 -0.09 0.00 -1.18 0.00 0.00 61.69 60.82 3h82 s THR 445 Cb -0.00 -3.76 0.01 0.00 1.34 0.00 0.00 72.50 70.09 3h82 s THR 445 CO -0.04 -0.54 0.21 0.12 -0.54 0.00 0.00 174.62 173.83 3h82 s PHE 446 N -2.39 -0.13 -0.04 3.99 5.36 0.65 -4.29 117.98 121.14 3h82 s PHE 446 Ca 0.49 0.26 -0.02 0.00 -0.96 0.00 0.00 56.93 56.71 3h82 s PHE 446 Cb -0.10 0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.64 3h82 s PHE 446 CO 0.33 -0.24 0.08 -1.14 -1.46 0.00 0.00 175.22 172.80 3h82 s GLN 447 N -0.75 0.04 0.08 10.12 0.74 -1.26 -1.71 119.66 126.92 3h82 s GLN 447 Ca -0.08 0.25 -0.34 0.00 0.05 0.00 0.00 55.36 55.24 3h82 s GLN 447 Cb -0.05 -0.17 -0.13 0.00 1.10 0.00 0.00 33.01 33.76 3h82 s GLN 447 CO 0.02 -0.14 1.67 -1.71 -0.55 0.00 0.00 175.29 174.58 3h82 n ASN 448 N 4.00 3.17 0.17 6.67 2.85 -1.26 -4.84 115.26 126.02 3h82 n ASN 448 Ca -0.25 1.05 0.13 0.00 -0.11 0.00 0.00 54.58 55.40 3h82 n ASN 448 Cb 0.52 -1.40 0.59 0.00 1.24 0.00 0.00 39.78 40.73 3h82 n ASN 448 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3h82 h PRO 449 N 6.96 0.00 -0.09 1.20 0.13 -2.02 -0.80 132.00 137.39 3h82 h PRO 449 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3h82 h PRO 449 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3h82 h PRO 449 CO 0.90 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.33 3h82 n TYR 450 N -2.39 0.11 -4.21 1.56 4.01 -1.26 -4.90 117.16 110.08 3h82 n TYR 450 Ca 0.01 -0.06 -0.12 0.00 -0.16 0.00 0.00 57.90 57.57 3h82 n TYR 450 Cb 0.17 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.10 3h82 n TYR 450 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3h82 s SER 451 N -1.38 0.66 -0.30 7.72 1.04 -0.31 -5.04 113.70 116.10 3h82 s SER 451 Ca 0.23 -1.26 0.08 0.00 0.48 0.00 0.00 55.95 55.48 3h82 s SER 451 Cb 0.11 0.24 0.46 0.00 0.10 0.00 0.00 66.02 66.93 3h82 s SER 451 CO 0.17 -0.70 1.33 -0.67 0.98 0.00 0.00 173.24 174.35 3h82 n ASP 452 N -0.22 3.60 -4.61 7.02 2.03 -1.26 -4.78 116.55 118.33 3h82 n ASP 452 Ca -0.04 -3.81 -0.39 0.00 0.52 0.00 0.00 54.79 51.07 3h82 n ASP 452 Cb 0.64 -0.51 0.04 0.00 -0.72 0.00 0.00 41.12 40.57 3h82 n ASP 452 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3h82 n GLU 453 N -0.94 1.06 -1.73 -0.67 0.28 -1.26 -4.91 120.64 112.47 3h82 n GLU 453 Ca 0.36 0.40 -0.42 0.00 -0.16 0.00 0.00 57.16 57.33 3h82 n GLU 453 Cb 0.88 -2.10 -0.02 0.00 1.43 0.00 0.00 31.44 31.63 3h82 n GLU 453 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 3h82 n ILE 454 N -1.27 0.81 -1.90 3.84 0.13 -1.26 -4.92 119.36 114.80 3h82 n ILE 454 Ca 0.12 -0.20 -0.38 0.00 -1.10 0.00 0.00 62.75 61.18 3h82 n ILE 454 Cb 0.44 -1.89 0.03 0.00 -0.84 0.00 0.00 39.64 37.38 3h82 n ILE 454 CO 0.00 0.00 0.00 -1.83 2.80 0.00 0.00 176.55 177.52 3h82 s GLU 455 N -0.18 3.26 0.45 9.51 -1.05 -1.26 -4.92 118.70 124.52 3h82 s GLU 455 Ca 0.67 2.11 0.05 0.00 -0.15 0.00 0.00 54.97 57.65 3h82 s GLU 455 Cb -0.52 -2.27 -0.04 0.00 -0.44 0.00 0.00 34.13 30.86 3h82 s GLU 455 CO 0.46 -1.05 0.08 1.52 0.95 0.00 0.00 175.26 177.21 3h82 s TYR 456 N -1.37 2.27 -0.14 4.83 1.13 -0.69 -4.57 117.35 118.81 3h82 s TYR 456 Ca 0.70 -0.75 0.00 0.00 -1.41 0.00 0.00 57.07 55.61 3h82 s TYR 456 Cb -0.37 -1.78 -0.01 0.00 -1.10 0.00 0.00 41.96 38.70 3h82 s TYR 456 CO 0.44 0.25 -0.14 0.42 -2.51 0.00 0.00 175.55 174.01 3h82 s ILE 457 N -2.74 2.91 -0.22 -3.49 1.01 -0.02 -0.25 121.20 118.39 3h82 s ILE 457 Ca 0.27 -0.70 -0.08 0.00 0.00 0.00 0.00 60.65 60.13 3h82 s ILE 457 Cb 0.05 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 3h82 s ILE 457 CO 0.15 0.52 0.10 -0.63 0.00 0.00 0.00 174.94 175.07 3h82 s ILE 458 N 0.53 4.86 -0.01 2.92 1.01 0.22 -0.94 121.20 129.80 3h82 s ILE 458 Ca -0.09 0.00 0.07 0.00 0.00 0.00 0.00 60.65 60.63 3h82 s ILE 458 Cb -0.16 -3.24 -0.02 0.00 0.01 0.00 0.00 42.46 39.05 3h82 s ILE 458 CO 0.04 0.39 -0.22 0.00 0.00 0.00 0.00 174.94 175.15 3h82 s THR 460 N -0.72 3.19 -0.28 0.00 2.01 0.14 -1.01 115.64 118.97 3h82 s THR 460 Ca 0.11 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.53 3h82 s THR 460 Cb -0.10 -2.42 0.04 0.00 0.01 0.00 0.00 72.50 70.03 3h82 s THR 460 CO 0.01 0.46 -0.03 0.20 -0.69 0.00 0.00 174.62 174.57 3h82 s ASN 461 N 1.13 4.64 -0.10 3.53 0.01 0.22 -1.21 114.94 123.16 3h82 s ASN 461 Ca 0.01 -1.15 0.03 0.00 -0.71 0.00 0.00 52.86 51.04 3h82 s ASN 461 Cb -0.14 -1.68 -0.01 0.00 0.41 0.00 0.00 41.25 39.83 3h82 s ASN 461 CO -0.02 -0.21 -0.21 -0.89 -1.51 0.00 0.00 177.10 174.27 3h82 s THR 462 N 1.26 2.39 -0.19 1.60 2.01 -0.28 -1.32 115.64 121.11 3h82 s THR 462 Ca -0.04 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 60.75 3h82 s THR 462 Cb -0.19 -1.93 -0.01 0.00 0.01 0.00 0.00 72.50 70.38 3h82 s THR 462 CO -0.03 0.55 1.30 0.21 -0.69 0.00 0.00 174.62 175.96 3h82 s ASN 463 N 0.16 6.86 0.34 3.53 2.47 -0.48 -0.67 114.94 127.15 3h82 s ASN 463 Ca -0.12 1.60 0.06 0.00 0.42 0.00 0.00 52.86 54.82 3h82 s ASN 463 Cb -0.16 -2.54 -0.07 0.00 -1.45 0.00 0.00 41.25 37.03 3h82 s ASN 463 CO 0.06 -0.85 0.02 0.68 -3.72 0.00 0.00 177.10 173.29 3h82 s VAL 464 N 3.76 1.57 0.26 -5.21 -7.23 -0.26 -4.55 120.40 108.74 3h82 s VAL 464 Ca 0.56 -2.03 -0.19 0.00 -1.81 0.00 0.00 61.98 58.51 3h82 s VAL 464 Cb -0.21 -2.80 -0.09 0.00 0.56 0.00 0.00 36.38 33.85 3h82 s VAL 464 CO 0.17 -0.06 0.76 -0.54 -0.31 0.00 0.00 175.10 175.12 3h82 s LYS 465 N -3.79 4.24 -0.01 4.82 1.02 -1.26 -4.43 119.74 120.32 3h82 s LYS 465 Ca 0.35 0.89 -0.29 0.00 0.02 0.00 0.00 55.97 56.93 3h82 s LYS 465 Cb 0.08 -2.76 0.10 0.00 -0.52 0.00 0.00 37.83 34.73 3h82 s LYS 465 CO 0.16 0.32 0.96 1.21 -0.92 0.00 0.00 175.35 177.08 3h82 s ASN 466 N -1.79 -0.29 0.00 2.83 2.47 -1.26 -5.10 114.94 111.81 3h82 s ASN 466 Ca 0.46 -0.06 0.02 0.00 0.42 0.00 0.00 52.86 53.71 3h82 s ASN 466 Cb -0.15 0.35 0.02 0.00 -1.45 0.00 0.00 41.25 40.02 3h82 s ASN 466 CO 0.20 -0.59 0.58 -1.54 -3.72 0.00 0.00 177.10 172.03