#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbv s ALA 361 N 0.00 -0.77 0.79 0.00 0.00 -1.26 -5.16 121.76 115.36 2wbv s ALA 361 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.82 2wbv s ALA 361 Cb 0.00 0.46 0.07 0.00 0.00 0.00 0.00 23.12 23.65 2wbv s ALA 361 CO 0.00 -0.51 1.10 -1.25 0.00 0.00 0.00 175.76 175.10 2wbv s PRO 362 N -3.10 2.14 -0.24 0.00 0.04 -1.26 -4.94 135.00 127.63 2wbv s PRO 362 Ca -0.01 0.62 -0.24 0.00 0.04 0.00 0.00 61.00 61.41 2wbv s PRO 362 Cb 0.01 -1.93 0.07 0.00 0.04 0.00 0.00 34.50 32.69 2wbv s PRO 362 CO -0.07 -1.58 0.67 -1.50 0.04 0.00 0.00 177.00 174.57 2wbv s ILE 363 N -3.17 0.00 -0.13 0.56 -1.16 -0.61 -5.00 121.20 111.68 2wbv s ILE 363 Ca 0.61 -0.00 0.02 0.00 -0.51 0.00 0.00 60.65 60.77 2wbv s ILE 363 Cb -0.14 -0.94 0.01 0.00 0.61 0.00 0.00 42.46 42.00 2wbv s ILE 363 CO 0.54 -0.00 -0.21 -0.89 -2.81 0.00 0.00 174.94 171.57 2wbv s THR 364 N 0.28 1.93 -0.10 4.00 2.01 -1.26 -0.45 115.64 122.06 2wbv s THR 364 Ca -0.01 -0.91 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 2wbv s THR 364 Cb -0.04 -1.71 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 2wbv s THR 364 CO 0.01 0.53 0.03 -0.76 -0.69 0.00 0.00 174.62 173.74 2wbv s LEU 365 N 0.81 3.75 0.27 4.42 1.43 -0.06 -0.86 118.68 128.44 2wbv s LEU 365 Ca -0.08 0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 53.02 2wbv s LEU 365 Cb -0.16 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.23 2wbv s LEU 365 CO -0.01 0.38 0.77 -1.66 0.23 0.00 0.00 176.35 176.06 2wbv s TRP 366 N -0.87 -0.13 -0.82 0.29 1.48 0.34 0.17 118.94 119.41 2wbv s TRP 366 Ca 0.13 -0.34 0.26 0.00 -1.06 0.00 0.00 56.10 55.10 2wbv s TRP 366 Cb -0.12 0.72 0.82 0.00 -1.16 0.00 0.00 33.47 33.73 2wbv s TRP 366 CO 0.03 -1.22 1.70 0.25 -4.06 0.00 0.00 176.95 173.65 2wbv n THR 367 N -0.48 0.32 0.00 0.66 -2.24 -0.66 -1.61 114.28 110.27 2wbv n THR 367 Ca -0.05 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2wbv n THR 367 Cb 0.59 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2wbv n THR 367 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wbv n GLY 368 N 1.39 -1.62 3.82 3.38 0.00 -1.26 -4.62 105.19 106.28 2wbv n GLY 368 Ca 0.06 -1.53 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 2wbv n GLY 368 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wbv s PRO 369 N -1.59 2.78 -1.19 1.61 0.05 -1.26 -4.26 135.00 131.14 2wbv s PRO 369 Ca 0.00 0.84 -0.20 0.00 0.05 0.00 0.00 61.00 61.69 2wbv s PRO 369 Cb 0.00 -1.98 -0.00 0.00 0.05 0.00 0.00 34.50 32.57 2wbv s PRO 369 CO 0.00 -1.18 0.73 0.41 0.05 0.00 0.00 177.00 177.01 2wbv n GLY 370 N -2.13 -0.86 3.75 0.56 0.00 -1.26 -4.91 105.19 100.35 2wbv n GLY 370 Ca 0.07 0.40 -0.36 0.00 0.00 0.00 0.00 46.02 46.13 2wbv n GLY 370 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wbv s PRO 371 N -6.24 2.86 0.97 1.61 0.04 -1.26 -5.03 135.00 127.95 2wbv s PRO 371 Ca 0.41 1.80 -0.16 0.00 0.04 0.00 0.00 61.00 63.09 2wbv s PRO 371 Cb -0.16 -1.92 0.24 0.00 0.04 0.00 0.00 34.50 32.71 2wbv s PRO 371 CO 0.88 -1.29 0.84 -1.13 0.04 0.00 0.00 177.00 176.34 2wbv n SER 372 N -1.76 -1.95 -4.55 6.66 3.41 -1.26 -4.84 113.62 109.32 2wbv n SER 372 Ca 0.14 -1.00 -0.39 0.00 -0.26 0.00 0.00 58.87 57.35 2wbv n SER 372 Cb 0.50 -0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 63.63 2wbv n SER 372 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wbv s ILE 373 N -2.50 3.68 -0.03 -1.33 1.01 -1.26 -4.24 121.20 116.53 2wbv s ILE 373 Ca 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.18 2wbv s ILE 373 Cb -0.06 -4.69 0.01 0.00 0.01 0.00 0.00 42.46 37.73 2wbv s ILE 373 CO 0.42 -1.62 0.97 -0.46 0.00 0.00 0.00 174.94 174.25 2wbv n ASN 374 N 10.32 1.94 -4.29 3.58 6.94 -1.00 -4.81 115.26 127.94 2wbv n ASN 374 Ca 0.18 -1.92 -0.36 0.00 -0.02 0.00 0.00 54.58 52.46 2wbv n ASN 374 Cb 0.50 -0.01 -0.13 0.00 -2.36 0.00 0.00 39.78 37.78 2wbv n ASN 374 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2wbv s GLY 375 N -0.92 1.74 -0.12 4.83 0.00 0.27 -4.33 107.32 108.79 2wbv s GLY 375 Ca 0.01 -1.47 -0.01 0.00 0.00 0.00 0.00 44.72 43.24 2wbv s GLY 375 CO 0.00 0.62 -0.09 -1.36 0.00 0.00 0.00 173.10 172.27 2wbv s PHE 376 N 1.44 2.89 -0.14 1.90 0.08 -0.18 -1.01 117.98 122.95 2wbv s PHE 376 Ca 0.01 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 56.68 2wbv s PHE 376 Cb -0.17 -1.85 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 2wbv s PHE 376 CO 0.00 -0.05 -0.19 0.42 -0.10 0.00 0.00 175.22 175.30 2wbv s ILE 377 N 0.11 1.88 -1.40 0.64 1.01 -0.56 -4.54 121.20 118.34 2wbv s ILE 377 Ca -0.04 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.72 2wbv s ILE 377 Cb -0.14 -1.69 0.02 0.00 0.01 0.00 0.00 42.46 40.66 2wbv s ILE 377 CO 0.04 0.51 0.62 0.59 0.00 0.00 0.00 174.94 176.70 2wbv n ASN 378 N 4.25 -1.36 -0.62 3.58 5.03 -1.26 -1.84 115.26 123.05 2wbv n ASN 378 Ca -0.20 -0.91 -0.07 0.00 0.87 0.00 0.00 54.58 54.28 2wbv n ASN 378 Cb 0.51 -3.54 -0.03 0.00 -1.02 0.00 0.00 39.78 35.71 2wbv n ASN 378 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2wbv n ASP 379 N -2.98 -4.83 -4.62 6.41 8.00 -1.26 -4.97 116.55 112.30 2wbv n ASP 379 Ca -0.24 0.18 -0.35 0.00 0.71 0.00 0.00 54.79 55.09 2wbv n ASP 379 Cb 0.65 -3.46 -0.10 0.00 -0.02 0.00 0.00 41.12 38.19 2wbv n ASP 379 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2wbv s THR 380 N -1.51 4.85 -0.24 -3.53 2.01 -0.76 -5.04 115.64 111.42 2wbv s THR 380 Ca 0.00 -0.01 -0.29 0.00 0.31 0.00 0.00 61.69 61.70 2wbv s THR 380 Cb 0.00 -3.21 -0.01 0.00 0.01 0.00 0.00 72.50 69.29 2wbv s THR 380 CO 0.00 0.43 1.34 -2.16 -0.69 0.00 0.00 174.62 173.54 2wbv s PRO 381 N 0.60 4.02 0.00 4.92 0.05 -1.26 -1.50 135.00 141.82 2wbv s PRO 381 Ca 0.04 1.47 0.00 0.00 0.05 0.00 0.00 61.00 62.57 2wbv s PRO 381 Cb -0.13 -3.86 0.00 0.00 0.05 0.00 0.00 34.50 30.56 2wbv s PRO 381 CO 0.01 -0.99 0.00 1.33 0.05 0.00 0.00 177.00 177.40 2wbv n VAL 382 N 5.93 0.00 -3.80 -0.36 0.24 -0.18 -4.92 118.33 115.24 2wbv n VAL 382 Ca 0.15 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.34 62.15 2wbv n VAL 382 Cb 0.46 0.67 -0.14 0.00 -1.47 0.00 0.00 33.84 33.36 2wbv n VAL 382 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2wbv s ILE 383 N -0.95 -0.03 -0.24 1.34 1.01 -0.99 -0.06 121.20 121.29 2wbv s ILE 383 Ca 0.00 0.11 -0.20 0.00 0.00 0.00 0.00 60.65 60.56 2wbv s ILE 383 Cb 0.00 -0.15 -0.02 0.00 0.01 0.00 0.00 42.46 42.30 2wbv s ILE 383 CO 0.00 0.04 0.60 -0.13 0.00 0.00 0.00 174.94 175.45 2wbv s ARG 384 N 0.65 4.14 -0.25 2.79 0.52 0.30 -0.56 118.95 126.54 2wbv s ARG 384 Ca -0.05 0.51 -0.01 0.00 -0.52 0.00 0.00 55.73 55.66 2wbv s ARG 384 Cb -0.07 -3.62 0.03 0.00 0.52 0.00 0.00 34.95 31.80 2wbv s ARG 384 CO -0.03 -0.33 -0.06 0.00 0.02 0.00 0.00 175.30 174.90 2wbv s PHE 386 N 1.32 3.30 -0.04 0.00 5.36 0.07 -4.79 117.98 123.20 2wbv s PHE 386 Ca -0.00 0.79 0.01 0.00 -0.96 0.00 0.00 56.93 56.77 2wbv s PHE 386 Cb -0.17 -2.79 0.02 0.00 -0.34 0.00 0.00 43.02 39.75 2wbv s PHE 386 CO -0.04 -0.27 -0.05 0.42 -1.46 0.00 0.00 175.22 173.81 2wbv s ILE 387 N 2.28 0.60 -0.08 3.12 1.01 -1.26 -1.27 121.20 125.59 2wbv s ILE 387 Ca 0.25 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.75 2wbv s ILE 387 Cb -0.16 -0.61 0.02 0.00 0.01 0.00 0.00 42.46 41.73 2wbv s ILE 387 CO 0.09 0.24 -0.09 0.00 0.00 0.00 0.00 174.94 175.18 2wbv s LEU 389 N 1.18 4.24 -0.24 0.00 1.43 0.13 -0.74 118.68 124.68 2wbv s LEU 389 Ca -0.05 -1.40 -0.04 0.00 -1.03 0.00 0.00 54.13 51.60 2wbv s LEU 389 Cb -0.14 -1.76 -0.00 0.00 0.03 0.00 0.00 46.19 44.32 2wbv s LEU 389 CO -0.02 -0.33 -0.02 -0.89 0.23 0.00 0.00 176.35 175.32 2wbv s THR 390 N 1.25 3.42 -0.26 5.49 2.01 -0.40 -0.88 115.64 126.28 2wbv s THR 390 Ca -0.02 -0.60 -0.13 0.00 0.31 0.00 0.00 61.69 61.26 2wbv s THR 390 Cb -0.20 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 2wbv s THR 390 CO -0.01 0.33 0.27 -0.60 -0.69 0.00 0.00 174.62 173.92 2wbv s ARG 391 N 1.46 4.02 0.00 4.92 6.06 0.41 -0.46 118.95 135.36 2wbv s ARG 391 Ca 0.04 -0.14 0.00 0.00 -2.50 0.00 0.00 55.73 53.14 2wbv s ARG 391 Cb -0.15 -3.62 0.00 0.00 0.06 0.00 0.00 34.95 31.24 2wbv s ARG 391 CO -0.02 -0.14 0.00 -0.25 -2.50 0.00 0.00 175.30 172.38 2wbv n ASP 392 N 4.92 0.00 -0.08 -2.12 8.00 -0.94 -1.57 116.55 124.76 2wbv n ASP 392 Ca -0.12 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.28 2wbv n ASP 392 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.59 2wbv n ASP 392 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2wbv h SER 393 N 0.00 0.34 0.00 -2.24 4.64 -1.97 -3.42 113.55 110.89 2wbv h SER 393 Ca 0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2wbv h SER 393 Cb 0.00 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2wbv h SER 393 CO 0.00 0.34 -0.27 -3.20 -0.87 0.00 0.00 176.83 172.83 2wbv n ASN 394 N -4.83 1.10 -4.93 4.97 5.15 -1.26 -5.06 115.26 110.40 2wbv n ASN 394 Ca -0.02 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.67 2wbv n ASN 394 Cb 0.09 0.01 -0.03 0.00 -0.53 0.00 0.00 39.78 39.31 2wbv n ASN 394 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2wbv s LEU 395 N -3.42 4.32 -0.16 1.20 1.43 -1.26 -0.83 118.68 119.96 2wbv s LEU 395 Ca 0.00 0.29 -0.04 0.00 -1.03 0.00 0.00 54.13 53.34 2wbv s LEU 395 Cb 0.00 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.18 2wbv s LEU 395 CO 0.00 0.07 -0.02 -0.69 0.23 0.00 0.00 176.35 175.94 2wbv s VAL 396 N -1.69 4.03 -0.25 -1.59 1.01 0.77 -2.21 120.40 120.48 2wbv s VAL 396 Ca 0.36 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 2wbv s VAL 396 Cb -0.12 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2wbv s VAL 396 CO 0.28 0.49 0.16 -0.89 0.00 0.00 0.00 175.10 175.14 2wbv s THR 397 N 0.37 5.26 -0.24 3.92 2.01 0.39 -1.65 115.64 125.70 2wbv s THR 397 Ca -0.03 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.93 2wbv s THR 397 Cb -0.14 -3.47 -0.03 0.00 0.01 0.00 0.00 72.50 68.88 2wbv s THR 397 CO 0.03 0.32 0.54 -0.69 -0.69 0.00 0.00 174.62 174.12 2wbv s VAL 398 N 1.26 5.07 -0.17 3.82 1.01 0.62 -1.27 120.40 130.74 2wbv s VAL 398 Ca 0.07 0.95 0.01 0.00 0.00 0.00 0.00 61.98 63.01 2wbv s VAL 398 Cb -0.14 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.41 2wbv s VAL 398 CO 0.06 0.11 -0.17 0.21 0.00 0.00 0.00 175.10 175.31 2wbv s ASN 399 N 1.38 2.98 0.02 3.32 3.84 0.09 -1.43 114.94 125.13 2wbv s ASN 399 Ca 0.23 -0.60 -0.10 0.00 0.21 0.00 0.00 52.86 52.60 2wbv s ASN 399 Cb -0.16 -1.35 0.01 0.00 -0.55 0.00 0.00 41.25 39.20 2wbv s ASN 399 CO 0.09 -0.03 0.19 0.00 -2.79 0.00 0.00 177.10 174.56 2wbv s ALA 400 N 1.37 -0.41 0.06 1.71 0.00 0.05 -0.41 121.76 124.12 2wbv s ALA 400 Ca 0.05 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.74 2wbv s ALA 400 Cb -0.13 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.19 2wbv s ALA 400 CO -0.12 -0.29 0.28 -1.54 0.00 0.00 0.00 175.76 174.09 2wbv s SER 401 N -1.73 -0.07 0.00 0.00 1.04 -0.40 0.42 113.70 112.97 2wbv s SER 401 Ca -0.10 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.02 2wbv s SER 401 Cb -0.04 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 2wbv s SER 401 CO -0.01 -0.66 -0.04 -0.36 0.98 0.00 0.00 173.24 173.16 2wbv s PHE 402 N -2.96 0.31 -0.15 5.02 0.08 -1.26 -0.75 117.98 118.27 2wbv s PHE 402 Ca -0.02 -0.13 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 2wbv s PHE 402 Cb 0.01 -0.20 0.04 0.00 -0.57 0.00 0.00 43.02 42.29 2wbv s PHE 402 CO -0.06 -0.03 -0.05 0.08 -0.10 0.00 0.00 175.22 175.07 2wbv s VAL 403 N -0.30 0.99 0.38 -0.44 1.01 -0.27 -1.05 120.40 120.72 2wbv s VAL 403 Ca -0.01 -0.48 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 2wbv s VAL 403 Cb -0.03 -1.15 -0.09 0.00 0.00 0.00 0.00 36.38 35.12 2wbv s VAL 403 CO -0.00 0.18 1.20 -0.83 0.00 0.00 0.00 175.10 175.65 2wbv s GLY 404 N 1.69 2.92 0.23 4.51 0.00 0.05 -0.54 107.32 116.19 2wbv s GLY 404 Ca 0.02 1.05 0.10 0.00 0.00 0.00 0.00 44.72 45.88 2wbv s GLY 404 CO -0.08 1.60 -0.17 -0.54 0.00 0.00 0.00 173.10 173.92 2wbv s GLU 405 N -2.11 1.46 5.27 2.90 0.41 0.92 -3.81 118.70 123.74 2wbv s GLU 405 Ca 0.54 -1.65 0.00 0.00 -0.41 0.00 0.00 54.97 53.46 2wbv s GLU 405 Cb -0.33 -1.40 0.00 0.00 -1.78 0.00 0.00 34.13 30.62 2wbv s GLU 405 CO 0.43 0.25 0.00 0.41 -0.49 0.00 0.00 175.26 175.86 2wbv n GLY 406 N -0.41 3.52 0.19 -1.39 0.00 -1.26 -0.57 105.19 105.26 2wbv n GLY 406 Ca -0.07 0.23 0.14 0.00 0.00 0.00 0.00 46.02 46.32 2wbv n GLY 406 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wbv h GLY 407 N 0.00 0.00 -1.80 -0.02 0.00 -1.95 -2.40 103.07 96.90 2wbv h GLY 407 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wbv h GLY 407 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 2wbv n TYR 408 N -2.46 0.49 -0.17 5.60 4.01 0.26 -4.52 117.16 120.38 2wbv n TYR 408 Ca -0.00 -0.34 -0.06 0.00 -0.16 0.00 0.00 57.90 57.34 2wbv n TYR 408 Cb 0.14 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.19 2wbv n TYR 408 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2wbv h ARG 409 N 3.23 0.59 -5.50 -0.72 2.43 -1.37 -3.35 114.38 109.69 2wbv h ARG 409 Ca 0.00 -0.04 -0.68 0.00 -0.81 0.00 0.00 59.98 58.46 2wbv h ARG 409 Cb 0.82 -0.13 -0.31 0.00 -0.42 0.00 0.00 29.97 29.92 2wbv h ARG 409 CO 0.00 0.39 -0.86 0.42 -1.51 0.00 0.00 179.97 178.41 2wbv s ILE 410 N -6.14 2.26 -0.01 1.20 1.01 -1.26 -0.71 121.20 117.55 2wbv s ILE 410 Ca -0.13 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.59 2wbv s ILE 410 Cb 0.13 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 2wbv s ILE 410 CO 0.74 0.56 -0.08 0.68 0.00 0.00 0.00 174.94 176.84 2wbv s VAL 411 N 0.21 3.59 0.33 2.92 -7.23 0.18 -4.90 120.40 115.50 2wbv s VAL 411 Ca -0.14 -0.75 0.08 0.00 -1.81 0.00 0.00 61.98 59.36 2wbv s VAL 411 Cb -0.17 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.21 2wbv s VAL 411 CO 0.07 0.43 0.25 -0.94 -0.31 0.00 0.00 175.10 174.60 2wbv s SER 412 N -1.30 5.17 0.63 4.85 1.04 -1.26 -0.75 113.70 122.07 2wbv s SER 412 Ca 0.16 -0.54 0.39 0.00 0.48 0.00 0.00 55.95 56.44 2wbv s SER 412 Cb -0.11 -0.95 2.15 0.00 0.10 0.00 0.00 66.02 67.21 2wbv s SER 412 CO 0.06 -0.32 2.21 -0.65 0.98 0.00 0.00 173.24 175.52 2wbv h PRO 413 N 1.33 0.00 -0.32 4.02 0.11 -1.77 -1.24 132.00 134.13 2wbv h PRO 413 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2wbv h PRO 413 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2wbv h PRO 413 CO 0.60 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.64 2wbv n THR 414 N -2.94 0.41 -1.67 -1.15 -2.24 -1.26 -2.36 114.28 103.07 2wbv n THR 414 Ca -0.03 -0.52 -0.46 0.00 -2.27 0.00 0.00 64.05 60.77 2wbv n THR 414 Cb 0.12 0.48 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 2wbv n THR 414 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2wbv n GLN 415 N 0.75 2.11 -2.39 -0.78 -0.06 -0.47 -4.94 117.38 111.59 2wbv n GLN 415 Ca 0.16 0.76 -0.40 0.00 -2.00 0.00 0.00 57.00 55.53 2wbv n GLN 415 Cb 0.41 -2.52 -0.04 0.00 -4.06 0.00 0.00 30.24 24.03 2wbv n GLN 415 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2wbv s SER 416 N 0.86 7.04 0.77 1.69 0.15 -1.26 -4.66 113.70 118.30 2wbv s SER 416 Ca 0.78 2.34 -0.14 0.00 0.70 0.00 0.00 55.95 59.63 2wbv s SER 416 Cb -0.69 -2.63 0.06 0.00 -1.71 0.00 0.00 66.02 61.06 2wbv s SER 416 CO 0.39 -0.31 1.21 0.00 1.20 0.00 0.00 173.24 175.73 2wbv s GLN 417 N -1.70 1.85 0.06 5.44 0.00 -1.26 -5.03 119.66 119.01 2wbv s GLN 417 Ca 0.48 1.77 -0.20 0.00 -0.00 0.00 0.00 55.36 57.41 2wbv s GLN 417 Cb -0.32 -1.80 0.04 0.00 0.00 0.00 0.00 33.01 30.93 2wbv s GLN 417 CO 0.42 -2.06 0.46 -0.59 0.00 0.00 0.00 175.29 173.53 2wbv s PHE 418 N -2.06 -0.34 -0.08 9.60 -0.12 -1.00 -5.01 117.98 118.97 2wbv s PHE 418 Ca 0.74 0.30 -0.01 0.00 -0.05 0.00 0.00 56.93 57.91 2wbv s PHE 418 Cb -0.29 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.35 2wbv s PHE 418 CO 0.48 -0.62 -0.04 -1.12 -0.05 0.00 0.00 175.22 173.86 2wbv s SER 419 N -2.10 4.83 -0.33 1.98 0.01 -1.26 -0.60 113.70 116.24 2wbv s SER 419 Ca -0.04 0.01 -0.06 0.00 1.31 0.00 0.00 55.95 57.16 2wbv s SER 419 Cb -0.00 -1.34 0.03 0.00 0.21 0.00 0.00 66.02 64.92 2wbv s SER 419 CO -0.03 0.34 0.10 -0.76 0.41 0.00 0.00 173.24 173.29 2wbv s LEU 420 N -0.67 4.19 -0.16 2.44 1.43 0.56 -4.95 118.68 121.52 2wbv s LEU 420 Ca 0.10 -1.04 -0.06 0.00 -1.03 0.00 0.00 54.13 52.10 2wbv s LEU 420 Cb -0.12 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 2wbv s LEU 420 CO 0.02 -0.29 0.04 -0.63 0.23 0.00 0.00 176.35 175.72 2wbv s ILE 421 N 1.42 4.64 -0.20 -0.59 1.01 -1.26 -0.76 121.20 125.46 2wbv s ILE 421 Ca -0.01 -0.09 -0.09 0.00 0.00 0.00 0.00 60.65 60.46 2wbv s ILE 421 Cb -0.19 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.17 2wbv s ILE 421 CO 0.03 0.49 0.11 -0.04 0.00 0.00 0.00 174.94 175.53 2wbv s MET 422 N 0.11 4.05 -0.16 2.79 -1.94 0.29 -0.79 119.30 123.64 2wbv s MET 422 Ca 0.04 -0.30 -0.03 0.00 -1.71 0.00 0.00 55.69 53.69 2wbv s MET 422 Cb -0.12 -3.36 -0.02 0.00 2.01 0.00 0.00 34.83 33.33 2wbv s MET 422 CO 0.01 0.21 -0.05 -1.21 -0.01 0.00 0.00 175.02 173.97 2wbv s GLU 423 N 0.59 3.61 0.04 2.03 2.02 -1.26 -2.09 118.70 123.63 2wbv s GLU 423 Ca 0.06 -0.55 0.09 0.00 0.02 0.00 0.00 54.97 54.58 2wbv s GLU 423 Cb -0.12 -2.90 -0.03 0.00 0.10 0.00 0.00 34.13 31.18 2wbv s GLU 423 CO 0.01 0.18 -0.25 -0.06 0.02 0.00 0.00 175.26 175.17 2wbv s PHE 424 N 0.50 2.16 0.98 1.61 0.08 -0.04 0.01 117.98 123.29 2wbv s PHE 424 Ca -0.04 -0.40 -0.16 0.00 0.12 0.00 0.00 56.93 56.45 2wbv s PHE 424 Cb -0.14 -1.30 0.22 0.00 -0.57 0.00 0.00 43.02 41.23 2wbv s PHE 424 CO 0.03 0.10 1.34 0.16 -0.10 0.00 0.00 175.22 176.75 2wbv s ASP 425 N -1.16 2.87 0.38 1.36 1.47 -0.46 -0.63 116.67 120.49 2wbv s ASP 425 Ca 0.10 0.11 0.26 0.00 1.18 0.00 0.00 52.55 54.20 2wbv s ASP 425 Cb -0.10 -0.06 1.35 0.00 -0.34 0.00 0.00 42.92 43.78 2wbv s ASP 425 CO 0.02 -2.87 1.80 0.06 0.68 0.00 0.00 175.17 174.86 2wbv h GLN 426 N -1.71 0.00 -0.47 2.11 3.07 -1.94 -2.00 115.11 114.17 2wbv h GLN 426 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.31 2wbv h GLN 426 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 2wbv h GLN 426 CO 0.32 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.43 2wbv n PHE 427 N -2.43 0.62 -0.94 0.06 3.72 -1.26 -4.95 117.46 112.28 2wbv n PHE 427 Ca -0.01 -0.37 0.00 0.00 -0.05 0.00 0.00 57.45 57.02 2wbv n PHE 427 Cb 0.09 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 2wbv n PHE 427 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wbv n GLY 428 N 1.28 0.46 3.72 1.37 0.00 -0.75 -3.14 105.19 108.12 2wbv n GLY 428 Ca 0.19 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 2wbv n GLY 428 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wbv s GLN 429 N -1.23 4.36 0.13 1.61 -0.21 -1.26 -4.71 119.66 118.35 2wbv s GLN 429 Ca 0.00 0.58 -0.31 0.00 0.02 0.00 0.00 55.36 55.65 2wbv s GLN 429 Cb 0.00 -3.45 -0.09 0.00 1.00 0.00 0.00 33.01 30.47 2wbv s GLN 429 CO 0.00 0.11 1.55 -1.17 -2.12 0.00 0.00 175.29 173.66 2wbv s LEU 430 N 0.73 4.37 0.55 2.90 2.96 -1.26 -1.36 118.68 127.57 2wbv s LEU 430 Ca 0.29 2.53 -0.04 0.00 -0.22 0.00 0.00 54.13 56.70 2wbv s LEU 430 Cb -0.16 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.95 2wbv s LEU 430 CO 0.13 -0.81 0.83 -0.04 -1.32 0.00 0.00 176.35 175.14 2wbv s MET 431 N 1.45 2.94 0.00 1.98 -1.94 0.10 -4.42 119.30 119.42 2wbv s MET 431 Ca 0.70 -0.17 0.30 0.00 -1.71 0.00 0.00 55.69 54.81 2wbv s MET 431 Cb -0.42 -2.36 1.58 0.00 2.01 0.00 0.00 34.83 35.65 2wbv s MET 431 CO 0.31 -0.58 2.06 -1.13 -0.01 0.00 0.00 175.02 175.67 2wbv n SER 432 N -2.43 0.20 -0.04 3.03 3.41 -1.26 -2.14 113.62 114.39 2wbv n SER 432 Ca 0.04 -0.67 0.06 0.00 -0.26 0.00 0.00 58.87 58.04 2wbv n SER 432 Cb 0.58 -0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.35 2wbv n SER 432 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2wbv n THR 433 N -1.00 0.00 -1.75 6.66 -2.24 -1.26 -4.64 114.28 110.04 2wbv n THR 433 Ca 0.18 -0.21 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 2wbv n THR 433 Cb 0.20 1.02 0.17 0.00 -2.10 0.00 0.00 70.33 69.62 2wbv n THR 433 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wbv s GLY 434 N -2.19 1.69 0.36 3.38 0.00 -1.26 -4.96 107.32 104.34 2wbv s GLY 434 Ca 0.06 -0.98 0.05 0.00 0.00 0.00 0.00 44.72 43.84 2wbv s GLY 434 CO 0.52 -0.27 1.95 3.43 0.00 0.00 0.00 173.10 178.73 2wbv h ASN 435 N -1.66 0.54 -3.28 1.64 4.21 -1.20 -3.38 115.58 112.45 2wbv h ASN 435 Ca -0.46 -0.06 -0.66 0.00 1.21 0.00 0.00 56.30 56.33 2wbv h ASN 435 Cb 1.27 -0.14 -0.30 0.00 -1.12 0.00 0.00 38.32 38.04 2wbv h ASN 435 CO 0.46 0.50 -0.79 -0.63 -1.29 0.00 0.00 177.43 175.68 2wbv s ILE 436 N -5.28 2.81 0.32 2.81 1.01 -1.08 -1.01 121.20 120.78 2wbv s ILE 436 Ca -0.08 -0.71 -0.08 0.00 0.00 0.00 0.00 60.65 59.78 2wbv s ILE 436 Cb 0.16 -2.21 0.01 0.00 0.01 0.00 0.00 42.46 40.44 2wbv s ILE 436 CO 0.76 0.50 0.54 0.54 0.00 0.00 0.00 174.94 177.27 2wbv s ASN 437 N 0.96 0.45 0.00 3.58 2.20 -1.26 -4.39 114.94 116.48 2wbv s ASN 437 Ca -0.02 -1.26 0.22 0.00 -0.94 0.00 0.00 52.86 50.86 2wbv s ASN 437 Cb -0.15 0.68 1.24 0.00 -2.00 0.00 0.00 41.25 41.02 2wbv s ASN 437 CO -0.02 -1.33 1.70 -1.54 -2.94 0.00 0.00 177.10 172.98 2wbv n SER 438 N -1.11 0.00 0.11 3.54 3.41 -0.91 -2.62 113.62 116.04 2wbv n SER 438 Ca -0.02 -0.44 0.12 0.00 -0.26 0.00 0.00 58.87 58.28 2wbv n SER 438 Cb 0.61 -0.11 0.46 0.00 -0.26 0.00 0.00 64.21 64.91 2wbv n SER 438 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2wbv n THR 439 N -1.11 0.71 -4.18 6.66 -2.24 -1.26 -4.78 114.28 108.07 2wbv n THR 439 Ca 0.14 0.01 -0.25 0.00 -2.27 0.00 0.00 64.05 61.68 2wbv n THR 439 Cb 0.11 -0.90 -0.08 0.00 -2.10 0.00 0.00 70.33 67.37 2wbv n THR 439 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2wbv s THR 440 N -3.21 2.24 0.07 4.28 -4.23 -1.08 -5.07 115.64 108.64 2wbv s THR 440 Ca 0.07 -1.72 -0.34 0.00 -1.18 0.00 0.00 61.69 58.52 2wbv s THR 440 Cb 0.11 -2.96 -0.13 0.00 1.34 0.00 0.00 72.50 70.86 2wbv s THR 440 CO 0.48 0.00 1.71 0.41 -0.54 0.00 0.00 174.62 176.68 2wbv n THR 441 N -1.23 0.25 -3.64 3.99 -1.04 -1.26 -4.95 114.28 106.40 2wbv n THR 441 Ca -0.02 -0.04 -0.07 0.00 -2.04 0.00 0.00 64.05 61.88 2wbv n THR 441 Cb 0.65 -1.71 -0.07 0.00 -1.82 0.00 0.00 70.33 67.37 2wbv n THR 441 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 2wbv s TRP 442 N 2.23 -0.87 -2.24 -1.42 -0.11 -1.26 -4.46 118.94 110.81 2wbv s TRP 442 Ca 0.84 1.80 0.00 0.00 1.22 0.00 0.00 56.10 59.96 2wbv s TRP 442 Cb -0.66 0.50 0.00 0.00 -1.50 0.00 0.00 33.47 31.81 2wbv s TRP 442 CO 0.43 -0.43 0.00 0.41 -4.62 0.00 0.00 176.95 172.74 2wbv n GLY 443 N 3.81 -0.97 3.77 5.86 0.00 -0.64 -4.58 105.19 112.45 2wbv n GLY 443 Ca -0.18 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.52 2wbv n GLY 443 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wbv s GLU 444 N -0.89 4.55 -0.35 1.61 2.12 -0.38 -0.50 118.70 124.85 2wbv s GLU 444 Ca 0.00 1.13 -0.20 0.00 0.36 0.00 0.00 54.97 56.26 2wbv s GLU 444 Cb 0.00 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 31.12 2wbv s GLU 444 CO 0.00 0.54 0.61 0.21 -0.54 0.00 0.00 175.26 176.08 2wbv s LYS 445 N -1.00 3.69 0.40 4.30 2.20 -0.04 -0.59 119.74 128.70 2wbv s LYS 445 Ca 0.36 0.03 -0.26 0.00 -0.36 0.00 0.00 55.97 55.75 2wbv s LYS 445 Cb -0.23 -3.80 -0.09 0.00 -1.51 0.00 0.00 37.83 32.21 2wbv s LYS 445 CO 0.26 -0.71 1.21 -2.14 -0.36 0.00 0.00 175.35 173.61 2wbv s PRO 446 N 2.64 4.04 0.16 4.03 0.02 -1.26 -4.55 135.00 140.08 2wbv s PRO 446 Ca 0.23 1.95 -0.31 0.00 0.02 0.00 0.00 61.00 62.89 2wbv s PRO 446 Cb -0.15 -2.72 -0.10 0.00 0.02 0.00 0.00 34.50 31.55 2wbv s PRO 446 CO 0.14 -0.37 1.68 -0.46 -0.33 0.00 0.00 177.00 177.67 2wbv s TRP 447 N -1.35 2.75 0.00 6.54 -0.00 -1.26 -2.96 118.94 122.67 2wbv s TRP 447 Ca 0.57 0.37 0.00 0.00 -0.00 0.00 0.00 56.10 57.04 2wbv s TRP 447 Cb -0.33 -4.05 0.00 0.00 -0.00 0.00 0.00 33.47 29.09 2wbv s TRP 447 CO 0.42 -4.04 0.00 0.41 -0.00 0.00 0.00 176.95 173.74 2wbv n GLY 448 N 3.95 0.36 3.46 5.86 0.00 -1.26 -5.06 105.19 112.49 2wbv n GLY 448 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 2wbv n GLY 448 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wbv s ASN 449 N -1.97 0.07 -0.37 1.61 2.20 -1.15 -5.06 114.94 110.27 2wbv s ASN 449 Ca 0.00 -1.12 0.07 0.00 -0.94 0.00 0.00 52.86 50.87 2wbv s ASN 449 Cb 0.00 0.53 0.65 0.00 -2.00 0.00 0.00 41.25 40.43 2wbv s ASN 449 CO 0.00 -1.06 1.77 0.59 -2.94 0.00 0.00 177.10 175.46 2wbv n ASN 450 N -0.44 3.71 -4.91 3.54 3.02 -1.26 -4.46 115.26 114.45 2wbv n ASN 450 Ca -0.00 -3.54 -0.27 0.00 -0.03 0.00 0.00 54.58 50.74 2wbv n ASN 450 Cb 0.63 -0.76 0.08 0.00 -0.61 0.00 0.00 39.78 39.12 2wbv n ASN 450 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wbv s THR 451 N -3.20 2.24 -0.23 3.41 -4.23 -1.26 -4.59 115.64 107.78 2wbv s THR 451 Ca 0.53 -0.11 0.01 0.00 -1.18 0.00 0.00 61.69 60.94 2wbv s THR 451 Cb 0.45 -3.03 0.05 0.00 1.34 0.00 0.00 72.50 71.31 2wbv s THR 451 CO 0.09 -0.04 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.35 2wbv s VAL 452 N -3.39 1.77 -0.41 2.29 1.01 -1.26 -4.32 120.40 116.09 2wbv s VAL 452 Ca 0.61 -1.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 2wbv s VAL 452 Cb -0.11 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.39 2wbv s VAL 452 CO 0.47 0.04 0.52 -1.10 0.00 0.00 0.00 175.10 175.03 2wbv s GLN 453 N 1.31 3.29 0.21 2.72 -1.52 0.25 -4.82 119.66 121.10 2wbv s GLN 453 Ca -0.05 -0.49 0.26 0.00 -1.95 0.00 0.00 55.36 53.14 2wbv s GLN 453 Cb -0.18 -3.92 0.82 0.00 -0.22 0.00 0.00 33.01 29.51 2wbv s GLN 453 CO -0.07 -0.84 1.78 -0.35 -0.25 0.00 0.00 175.29 175.56 2wbv n PRO 454 N 5.84 0.26 -2.53 2.91 -0.04 -1.26 -1.25 135.00 138.92 2wbv n PRO 454 Ca -0.05 0.22 -0.43 0.00 -0.04 0.00 0.00 63.50 63.20 2wbv n PRO 454 Cb 0.48 -1.80 -0.02 0.00 -0.04 0.00 0.00 33.50 32.11 2wbv n PRO 454 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2wbv s ARG 455 N -3.11 3.90 0.62 0.54 0.52 -1.26 -4.96 118.95 115.21 2wbv s ARG 455 Ca 0.10 1.02 -0.19 0.00 -0.52 0.00 0.00 55.73 56.14 2wbv s ARG 455 Cb 0.12 -3.84 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 2wbv s ARG 455 CO 0.59 -1.13 1.29 -2.14 0.02 0.00 0.00 175.30 173.92 2wbv s PRO 456 N 4.10 2.76 0.18 3.54 0.02 -1.26 -4.93 135.00 139.41 2wbv s PRO 456 Ca 0.51 2.04 0.08 0.00 0.02 0.00 0.00 61.00 63.65 2wbv s PRO 456 Cb -0.13 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.41 2wbv s PRO 456 CO 0.23 -1.43 -0.15 0.45 -0.33 0.00 0.00 177.00 175.77 2wbv s SER 457 N -1.36 2.49 0.50 2.53 0.15 -1.26 -5.02 113.70 111.73 2wbv s SER 457 Ca 0.79 -0.96 0.19 0.00 0.70 0.00 0.00 55.95 56.67 2wbv s SER 457 Cb -0.37 -0.13 1.25 0.00 -1.71 0.00 0.00 66.02 65.07 2wbv s SER 457 CO 0.40 -0.15 2.03 1.12 1.20 0.00 0.00 173.24 177.84 2wbv h HIS 458 N 2.81 0.14 0.00 3.44 2.07 -1.97 -2.45 115.15 119.19 2wbv h HIS 458 Ca -0.39 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.13 2wbv h HIS 458 Cb 1.21 -0.04 0.00 0.00 2.57 0.00 0.00 27.41 31.15 2wbv h HIS 458 CO 0.70 0.07 0.00 1.79 -3.07 0.00 0.00 177.93 177.42 2wbv h THR 459 N 0.13 0.00 0.00 6.12 1.35 -1.95 -2.85 112.91 115.71 2wbv h THR 459 Ca 0.20 -0.12 -0.02 0.00 -0.55 0.00 0.00 66.41 65.92 2wbv h THR 459 Cb 0.61 0.97 -0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2wbv h THR 459 CO -0.02 0.00 -0.09 -0.50 -0.25 0.00 0.00 175.52 174.65 2wbv h TRP 460 N 0.00 0.00 0.00 4.73 4.06 -1.67 -1.87 115.95 121.20 2wbv h TRP 460 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2wbv h TRP 460 Cb 0.13 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.29 2wbv h TRP 460 CO 0.00 0.09 -0.05 -0.22 -3.56 0.00 0.00 178.44 174.70 2wbv h LYS 461 N 0.00 0.00 0.00 0.49 3.64 -1.45 -2.66 116.57 116.60 2wbv h LYS 461 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wbv h LYS 461 Cb 0.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2wbv h LYS 461 CO 0.01 0.05 0.00 -0.07 -2.27 0.00 0.00 179.45 177.17 2wbv h LEU 462 N 0.00 0.00 -0.19 5.20 3.38 -1.57 -1.78 115.31 120.36 2wbv h LEU 462 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wbv h LEU 462 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2wbv h LEU 462 CO 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 178.48 2wbv s MET 464 N -2.38 4.01 -0.19 0.00 -1.94 -0.67 -4.90 119.30 113.24 2wbv s MET 464 Ca 0.33 0.68 -0.29 0.00 -1.71 0.00 0.00 55.69 54.70 2wbv s MET 464 Cb 0.20 -2.43 -0.03 0.00 2.01 0.00 0.00 34.83 34.59 2wbv s MET 464 CO 0.44 0.15 1.65 -1.25 -0.01 0.00 0.00 175.02 176.01 2wbv s PRO 465 N -2.98 3.85 -0.44 2.03 0.04 -1.26 -0.22 135.00 136.00 2wbv s PRO 465 Ca 0.54 1.79 -0.40 0.00 0.04 0.00 0.00 61.00 62.97 2wbv s PRO 465 Cb -0.10 -4.04 -0.17 0.00 0.04 0.00 0.00 34.50 30.23 2wbv s PRO 465 CO 0.17 -1.24 1.67 -1.71 0.04 0.00 0.00 177.00 175.94 2wbv n ASN 466 N 8.31 0.86 0.12 6.66 2.85 -0.50 -4.71 115.26 128.85 2wbv n ASN 466 Ca 0.19 0.82 0.01 0.00 -0.11 0.00 0.00 54.58 55.48 2wbv n ASN 466 Cb 0.45 -0.79 0.32 0.00 1.24 0.00 0.00 39.78 40.99 2wbv n ASN 466 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 2wbv h ARG 467 N 6.31 0.18 0.05 1.20 2.43 -1.90 0.15 114.38 122.80 2wbv h ARG 467 Ca -0.23 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 58.61 2wbv h ARG 467 Cb 1.24 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.79 2wbv h ARG 467 CO 0.92 0.47 -1.09 1.49 -1.51 0.00 0.00 179.97 180.25 2wbv h GLU 468 N 0.16 0.54 -0.46 0.20 4.81 -1.98 -2.24 114.58 115.62 2wbv h GLU 468 Ca 0.02 -0.65 -0.14 0.00 -0.13 0.00 0.00 59.36 58.47 2wbv h GLU 468 Cb 0.61 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 2wbv h GLU 468 CO 0.04 1.26 -0.25 0.28 -0.73 0.00 0.00 179.01 179.61 2wbv h VAL 469 N 0.28 1.27 -2.06 0.32 2.07 -1.86 -3.29 116.25 112.97 2wbv h VAL 469 Ca -0.13 -1.42 -0.68 0.00 0.82 0.00 0.00 66.70 65.28 2wbv h VAL 469 Cb 1.75 1.18 -0.35 0.00 -1.52 0.00 0.00 31.29 32.35 2wbv h VAL 469 CO 0.20 0.49 0.12 -1.22 0.02 0.00 0.00 177.57 177.18 2wbv n TYR 470 N -4.10 3.37 0.17 1.57 4.01 0.51 -4.71 117.16 117.98 2wbv n TYR 470 Ca -0.00 -3.11 0.06 0.00 -0.16 0.00 0.00 57.90 54.69 2wbv n TYR 470 Cb 0.48 -0.73 0.12 0.00 -0.31 0.00 0.00 39.34 38.89 2wbv n TYR 470 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2wbv h SER 471 N 3.24 0.00 -2.85 7.72 4.64 -1.47 -3.43 113.55 121.40 2wbv h SER 471 Ca 0.36 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 61.05 2wbv h SER 471 Cb 0.45 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.38 2wbv h SER 471 CO 1.04 0.32 -0.79 0.42 -0.87 0.00 0.00 176.83 176.95 2wbv s THR 472 N -3.11 2.53 0.35 2.95 -4.23 -1.26 -5.08 115.64 107.79 2wbv s THR 472 Ca 0.05 -2.09 -0.29 0.00 -1.18 0.00 0.00 61.69 58.18 2wbv s THR 472 Cb 0.07 -2.26 -0.11 0.00 1.34 0.00 0.00 72.50 71.54 2wbv s THR 472 CO 0.71 -0.21 1.48 -2.65 -0.54 0.00 0.00 174.62 173.41 2wbv n PRO 473 N -0.06 2.58 -4.40 3.99 -0.02 -1.26 -4.95 135.00 130.88 2wbv n PRO 473 Ca -0.10 0.91 -0.24 0.00 -2.02 0.00 0.00 63.50 62.05 2wbv n PRO 473 Cb 0.57 -2.63 -0.09 0.00 -0.02 0.00 0.00 33.50 31.33 2wbv n PRO 473 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wbv s ALA 474 N -0.83 3.02 0.01 3.55 0.00 -0.73 -4.96 121.76 121.83 2wbv s ALA 474 Ca 0.56 -1.89 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 2wbv s ALA 474 Cb -0.50 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.26 2wbv s ALA 474 CO 0.60 0.18 0.33 0.00 0.00 0.00 0.00 175.76 176.86 2wbv s ALA 475 N -2.48 -0.79 -0.12 0.00 0.00 -1.26 0.20 121.76 117.31 2wbv s ALA 475 Ca 0.32 0.23 -0.02 0.00 0.00 0.00 0.00 51.96 52.50 2wbv s ALA 475 Cb -0.03 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.32 2wbv s ALA 475 CO 0.18 -0.34 0.01 0.99 0.00 0.00 0.00 175.76 176.60 2wbv s THR 476 N -1.88 0.46 -0.23 0.00 2.01 -0.13 -5.00 115.64 110.87 2wbv s THR 476 Ca -0.10 -0.14 -0.10 0.00 0.31 0.00 0.00 61.69 61.67 2wbv s THR 476 Cb -0.03 -0.74 -0.05 0.00 0.01 0.00 0.00 72.50 71.70 2wbv s THR 476 CO 0.01 0.10 0.14 -0.51 -0.69 0.00 0.00 174.62 173.67 2wbv s ILE 477 N 1.92 5.17 0.09 1.82 2.07 -1.26 -1.17 121.20 129.84 2wbv s ILE 477 Ca 0.03 0.11 0.04 0.00 -1.41 0.00 0.00 60.65 59.42 2wbv s ILE 477 Cb -0.14 -3.40 -0.04 0.00 0.13 0.00 0.00 42.46 39.01 2wbv s ILE 477 CO -0.06 0.36 -0.10 -0.44 -1.91 0.00 0.00 174.94 172.78 2wbv s SER 478 N 1.05 1.41 0.35 4.50 0.01 -0.96 -4.99 113.70 115.07 2wbv s SER 478 Ca 0.07 -0.81 -0.26 0.00 1.31 0.00 0.00 55.95 56.26 2wbv s SER 478 Cb -0.14 0.01 -0.12 0.00 0.21 0.00 0.00 66.02 65.98 2wbv s SER 478 CO 0.04 -0.27 0.97 -1.14 0.41 0.00 0.00 173.24 173.25 2wbv n ARG 479 N 0.58 1.29 -3.68 12.44 0.63 -1.26 -1.33 116.66 125.33 2wbv n ARG 479 Ca -0.16 0.46 -0.30 0.00 -0.92 0.00 0.00 57.85 56.93 2wbv n ARG 479 Cb 0.58 -1.90 -0.14 0.00 0.45 0.00 0.00 32.46 31.46 2wbv n ARG 479 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wbv s GLY 481 N 0.86 2.76 -0.11 0.00 0.00 -1.26 -1.03 107.32 108.53 2wbv s GLY 481 Ca 0.15 1.33 -0.00 0.00 0.00 0.00 0.00 44.72 46.20 2wbv s GLY 481 CO -0.07 2.09 -0.09 1.08 0.00 0.00 0.00 173.10 176.11 2wbv s LEU 482 N -1.34 3.00 -1.46 0.66 1.43 -0.73 -0.97 118.68 119.26 2wbv s LEU 482 Ca 0.53 -0.16 -0.11 0.00 -1.03 0.00 0.00 54.13 53.36 2wbv s LEU 482 Cb -0.41 -1.67 0.08 0.00 0.03 0.00 0.00 46.19 44.21 2wbv s LEU 482 CO 0.51 0.25 0.74 -0.67 0.23 0.00 0.00 176.35 177.42 2wbv n ASP 483 N 2.94 -4.52 -0.16 2.29 2.03 0.10 -4.82 116.55 114.41 2wbv n ASP 483 Ca -0.18 -0.58 0.01 0.00 0.52 0.00 0.00 54.79 54.56 2wbv n ASP 483 Cb 0.53 -3.66 0.28 0.00 -0.72 0.00 0.00 41.12 37.54 2wbv n ASP 483 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2wbv h SER 484 N -1.54 0.77 -0.07 1.67 0.02 -1.84 -1.35 113.55 111.21 2wbv h SER 484 Ca -0.52 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.39 2wbv h SER 484 Cb 1.34 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 2wbv h SER 484 CO 0.61 0.58 -0.00 0.40 -1.14 0.00 0.00 176.83 177.29 2wbv h ILE 485 N 0.90 1.25 0.00 3.27 2.04 -1.96 0.15 117.51 123.17 2wbv h ILE 485 Ca 0.24 -0.78 -0.10 0.00 1.00 0.00 0.00 64.86 65.22 2wbv h ILE 485 Cb -0.06 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2wbv h ILE 485 CO -0.05 0.22 -0.46 0.00 0.00 0.00 0.00 178.15 177.86 2wbv h ALA 486 N 0.72 1.15 -0.64 1.87 0.00 -1.80 -2.63 119.26 117.95 2wbv h ALA 486 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2wbv h ALA 486 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2wbv h ALA 486 CO 0.00 0.57 0.00 1.33 0.00 0.00 0.00 179.25 181.15 2wbv n VAL 487 N -3.86 1.61 -4.24 0.00 0.24 -0.56 -4.97 118.33 106.54 2wbv n VAL 487 Ca -0.01 -1.17 -0.30 0.00 -2.04 0.00 0.00 64.34 60.82 2wbv n VAL 487 Cb 0.50 0.22 -0.10 0.00 -1.47 0.00 0.00 33.84 33.00 2wbv n VAL 487 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2wbv n ASP 488 N 1.15 0.88 -2.35 -1.34 2.03 -0.62 -1.96 116.55 114.34 2wbv n ASP 488 Ca 0.24 -1.22 -0.19 0.00 0.52 0.00 0.00 54.79 54.14 2wbv n ASP 488 Cb 0.80 -1.52 -0.01 0.00 -0.72 0.00 0.00 41.12 39.67 2wbv n ASP 488 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wbv n GLY 489 N -2.50 -0.35 3.60 0.27 0.00 0.44 -4.92 105.19 101.73 2wbv n GLY 489 Ca -0.31 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.20 2wbv n GLY 489 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbv n ALA 490 N -1.85 -0.70 -0.31 4.61 0.00 -0.83 -4.84 120.51 116.59 2wbv n ALA 490 Ca -0.23 0.50 0.15 0.00 0.00 0.00 0.00 53.44 53.87 2wbv n ALA 490 Cb 0.67 -2.10 0.40 0.00 0.00 0.00 0.00 19.45 18.42 2wbv n ALA 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2wbv h PRO 491 N 4.58 0.61 -0.49 0.00 0.11 -1.92 -1.94 132.00 132.94 2wbv h PRO 491 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2wbv h PRO 491 Cb 1.33 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2wbv h PRO 491 CO 0.78 0.40 0.00 -1.13 -0.21 0.00 0.00 178.00 177.84 2wbv n SER 492 N -4.63 1.51 -0.64 -2.05 3.41 -1.26 -3.40 113.62 106.55 2wbv n SER 492 Ca 0.21 -2.10 0.08 0.00 -0.26 0.00 0.00 58.87 56.81 2wbv n SER 492 Cb 0.61 -0.31 0.21 0.00 -0.26 0.00 0.00 64.21 64.47 2wbv n SER 492 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2wbv n ARG 493 N 0.09 2.52 -4.34 4.33 5.12 -0.73 -1.24 116.66 122.41 2wbv n ARG 493 Ca 0.07 -2.67 -0.33 0.00 -1.93 0.00 0.00 57.85 52.98 2wbv n ARG 493 Cb 0.30 -1.69 -0.09 0.00 -1.16 0.00 0.00 32.46 29.82 2wbv n ARG 493 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2wbv s SER 494 N -2.06 5.12 0.00 0.55 0.01 -1.22 -1.78 113.70 114.32 2wbv s SER 494 Ca 0.37 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.66 2wbv s SER 494 Cb 0.30 -1.36 0.00 0.00 0.21 0.00 0.00 66.02 65.16 2wbv s SER 494 CO 0.08 0.31 0.00 2.30 0.41 0.00 0.00 173.24 176.34 2wbv n ILE 495 N 1.67 0.00 -4.59 1.44 -5.35 -0.20 -4.44 119.36 107.88 2wbv n ILE 495 Ca -0.16 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.02 2wbv n ILE 495 Cb 0.53 -0.47 -0.12 0.00 -1.74 0.00 0.00 39.64 37.84 2wbv n ILE 495 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2wbv s ASP 496 N -0.68 3.81 -0.14 7.28 1.01 -0.57 -0.12 116.67 127.25 2wbv s ASP 496 Ca 0.00 -0.45 0.00 0.00 0.71 0.00 0.00 52.55 52.81 2wbv s ASP 496 Cb 0.00 -0.59 0.02 0.00 1.01 0.00 0.00 42.92 43.36 2wbv s ASP 496 CO 0.00 0.24 -0.13 0.00 0.21 0.00 0.00 175.17 175.49 2wbv s MET 498 N 1.50 3.85 -0.15 0.00 1.75 0.97 -2.27 119.30 124.94 2wbv s MET 498 Ca 0.05 -0.39 -0.25 0.00 -1.25 0.00 0.00 55.69 53.85 2wbv s MET 498 Cb -0.13 -3.36 -0.02 0.00 2.84 0.00 0.00 34.83 34.16 2wbv s MET 498 CO -0.10 -0.01 0.80 -1.17 -0.65 0.00 0.00 175.02 173.90 2wbv s LEU 499 N 1.16 4.20 -0.15 4.11 2.96 -0.32 -0.57 118.68 130.07 2wbv s LEU 499 Ca 0.05 1.16 -0.04 0.00 -0.22 0.00 0.00 54.13 55.09 2wbv s LEU 499 Cb -0.14 -3.20 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 2wbv s LEU 499 CO 0.04 -0.35 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.08 2wbv s ILE 500 N 1.93 4.11 -0.24 6.68 1.01 -0.11 -0.96 121.20 133.61 2wbv s ILE 500 Ca 0.38 -0.29 -0.07 0.00 0.00 0.00 0.00 60.65 60.67 2wbv s ILE 500 Cb -0.17 -2.80 -0.03 0.00 0.01 0.00 0.00 42.46 39.48 2wbv s ILE 500 CO 0.13 0.50 0.05 -0.63 0.00 0.00 0.00 174.94 175.00 2wbv s ILE 501 N 0.20 4.17 -1.52 2.92 1.01 0.13 -1.18 121.20 126.94 2wbv s ILE 501 Ca -0.01 -0.22 -0.04 0.00 0.00 0.00 0.00 60.65 60.39 2wbv s ILE 501 Cb -0.13 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.40 2wbv s ILE 501 CO 0.02 0.35 0.53 0.59 0.00 0.00 0.00 174.94 176.44 2wbv n ASN 502 N 4.89 -5.95 -4.71 3.58 3.02 -0.08 -1.77 115.26 114.23 2wbv n ASN 502 Ca -0.16 -0.25 -0.42 0.00 -0.03 0.00 0.00 54.58 53.71 2wbv n ASN 502 Cb 0.51 -4.79 -0.03 0.00 -0.61 0.00 0.00 39.78 34.87 2wbv n ASN 502 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2wbv s LYS 503 N -5.59 4.30 0.28 3.52 2.20 -1.26 -4.27 119.74 118.91 2wbv s LYS 503 Ca 0.27 2.10 -0.30 0.00 -0.36 0.00 0.00 55.97 57.68 2wbv s LYS 503 Cb -0.12 -3.32 -0.13 0.00 -1.51 0.00 0.00 37.83 32.75 2wbv s LYS 503 CO 0.33 -0.50 1.32 -2.30 -0.36 0.00 0.00 175.35 173.84 2wbv n PRO 504 N 4.31 1.99 -3.67 4.03 -0.02 -1.26 -4.70 135.00 135.69 2wbv n PRO 504 Ca 0.12 0.70 -0.09 0.00 -2.02 0.00 0.00 63.50 62.22 2wbv n PRO 504 Cb 0.42 -2.30 -0.09 0.00 -0.02 0.00 0.00 33.50 31.51 2wbv n PRO 504 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2wbv s LYS 505 N -1.10 0.38 4.39 -0.52 2.36 -1.26 -5.11 119.74 118.89 2wbv s LYS 505 Ca 0.62 1.00 0.00 0.00 -2.55 0.00 0.00 55.97 55.04 2wbv s LYS 505 Cb -0.63 0.25 0.00 0.00 -1.05 0.00 0.00 37.83 36.40 2wbv s LYS 505 CO 0.56 -0.21 0.00 0.41 1.55 0.00 0.00 175.35 177.65 2wbv n GLY 506 N 4.99 3.16 1.04 5.54 0.00 -1.26 -1.83 105.19 116.83 2wbv n GLY 506 Ca -0.14 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.90 2wbv n GLY 506 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wbv n VAL 507 N 0.00 2.40 -1.98 1.61 0.24 -1.26 -5.03 118.33 114.31 2wbv n VAL 507 Ca 0.00 -2.05 -0.40 0.00 -2.04 0.00 0.00 64.34 59.85 2wbv n VAL 507 Cb 0.00 -0.28 -0.00 0.00 -1.47 0.00 0.00 33.84 32.09 2wbv n VAL 507 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wbv s ALA 508 N -2.94 3.32 -0.03 2.33 0.00 -0.76 -4.95 121.76 118.74 2wbv s ALA 508 Ca 0.44 1.32 -0.10 0.00 0.00 0.00 0.00 51.96 53.62 2wbv s ALA 508 Cb 0.36 -3.52 -0.31 0.00 0.00 0.00 0.00 23.12 19.66 2wbv s ALA 508 CO 0.07 -0.90 0.73 1.15 0.00 0.00 0.00 175.76 176.82 2wbv h THR 509 N 2.57 1.01 -4.17 0.00 2.02 -1.14 -3.44 112.91 109.76 2wbv h THR 509 Ca -0.50 -2.58 -0.54 0.00 0.77 0.00 0.00 66.41 63.56 2wbv h THR 509 Cb 1.25 2.80 -0.26 0.00 -1.74 0.00 0.00 68.15 70.19 2wbv h THR 509 CO 0.63 0.85 -0.83 -0.31 0.37 0.00 0.00 175.52 176.23 2wbv s TYR 510 N -2.59 1.63 0.01 3.16 2.02 -0.91 -5.01 117.35 115.67 2wbv s TYR 510 Ca -0.14 -0.35 0.01 0.00 -0.37 0.00 0.00 57.07 56.22 2wbv s TYR 510 Cb 0.05 -0.99 -0.01 0.00 -0.40 0.00 0.00 41.96 40.62 2wbv s TYR 510 CO 0.87 0.06 -0.05 0.95 -1.57 0.00 0.00 175.55 175.80 2wbv s THR 511 N -0.73 0.35 -0.11 -0.71 -4.23 -1.26 -0.86 115.64 108.08 2wbv s THR 511 Ca 0.06 -0.54 0.01 0.00 -1.18 0.00 0.00 61.69 60.04 2wbv s THR 511 Cb -0.08 -0.37 0.02 0.00 1.34 0.00 0.00 72.50 73.41 2wbv s THR 511 CO 0.01 -0.13 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.05 2wbv s LEU 512 N -0.73 1.68 -0.13 4.79 1.43 -0.89 -0.90 118.68 123.93 2wbv s LEU 512 Ca -0.04 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2wbv s LEU 512 Cb -0.05 -1.08 -0.00 0.00 0.03 0.00 0.00 46.19 45.09 2wbv s LEU 512 CO -0.00 -0.00 -0.18 -0.89 0.23 0.00 0.00 176.35 175.50 2wbv s THR 513 N 1.10 2.50 -0.45 5.49 2.01 -0.32 -0.55 115.64 125.42 2wbv s THR 513 Ca -0.04 -0.85 -0.16 0.00 0.31 0.00 0.00 61.69 60.95 2wbv s THR 513 Cb -0.14 -2.02 0.05 0.00 0.01 0.00 0.00 72.50 70.40 2wbv s THR 513 CO -0.03 0.54 0.38 -0.36 -0.69 0.00 0.00 174.62 174.45 2wbv s PHE 514 N 0.51 3.23 -0.23 4.92 0.08 0.06 -0.94 117.98 125.61 2wbv s PHE 514 Ca -0.12 -0.78 -0.06 0.00 0.12 0.00 0.00 56.93 56.08 2wbv s PHE 514 Cb -0.16 -2.99 -0.02 0.00 -0.57 0.00 0.00 43.02 39.27 2wbv s PHE 514 CO 0.05 -0.74 0.04 0.50 -0.10 0.00 0.00 175.22 174.96 2wbv s ARG 515 N 1.72 3.62 -0.25 0.44 3.52 0.27 -0.32 118.95 127.93 2wbv s ARG 515 Ca 0.05 -0.50 -0.10 0.00 -0.13 0.00 0.00 55.73 55.04 2wbv s ARG 515 Cb -0.22 -3.21 -0.05 0.00 -1.56 0.00 0.00 34.95 29.91 2wbv s ARG 515 CO 0.08 -0.12 0.16 -0.06 -0.81 0.00 0.00 175.30 174.54 2wbv s PHE 516 N 1.40 3.25 0.09 5.12 0.08 0.24 -0.02 117.98 128.13 2wbv s PHE 516 Ca 0.05 0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.21 2wbv s PHE 516 Cb -0.15 -2.30 -0.04 0.00 -0.57 0.00 0.00 43.02 39.96 2wbv s PHE 516 CO 0.02 -0.06 -0.02 -0.51 -0.10 0.00 0.00 175.22 174.54 2wbv s LEU 517 N 1.35 2.35 -1.15 -0.37 1.43 -0.49 -2.37 118.68 119.43 2wbv s LEU 517 Ca 0.07 -1.05 -0.07 0.00 -1.03 0.00 0.00 54.13 52.05 2wbv s LEU 517 Cb -0.15 0.11 0.01 0.00 0.03 0.00 0.00 46.19 46.20 2wbv s LEU 517 CO 0.07 -0.58 1.01 0.59 0.23 0.00 0.00 176.35 177.67 2wbv n ASN 518 N 0.00 -5.49 0.27 2.29 3.02 -1.26 -1.51 115.26 112.58 2wbv n ASN 518 Ca -0.11 -0.47 0.12 0.00 -0.03 0.00 0.00 54.58 54.08 2wbv n ASN 518 Cb 0.62 -4.40 0.77 0.00 -0.61 0.00 0.00 39.78 36.16 2wbv n ASN 518 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2wbv h PHE 519 N -2.28 0.00 0.00 3.10 0.04 -1.83 -2.33 116.94 113.64 2wbv h PHE 519 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2wbv h PHE 519 Cb 1.32 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.47 2wbv h PHE 519 CO 0.42 0.04 0.00 0.27 -0.60 0.00 0.00 178.31 178.44 2wbv n ASN 520 N -4.07 0.00 0.15 2.17 0.23 -1.00 -1.04 115.26 111.70 2wbv n ASN 520 Ca -0.03 0.13 0.13 0.00 -0.53 0.00 0.00 54.58 54.28 2wbv n ASN 520 Cb 0.12 -0.30 0.40 0.00 -2.08 0.00 0.00 39.78 37.92 2wbv n ASN 520 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2wbv h ARG 521 N 0.00 0.00 -6.86 -3.83 3.08 -1.71 -3.46 114.38 101.60 2wbv h ARG 521 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 2wbv h ARG 521 Cb 0.14 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.24 2wbv h ARG 521 CO 0.00 0.00 0.59 -0.51 -1.07 0.00 0.00 179.97 178.98 2wbv s LEU 522 N -4.99 4.46 0.50 3.04 1.43 -0.20 -4.75 118.68 118.17 2wbv s LEU 522 Ca 0.08 2.57 0.29 0.00 -1.03 0.00 0.00 54.13 56.04 2wbv s LEU 522 Cb 0.10 -3.64 0.93 0.00 0.03 0.00 0.00 46.19 43.61 2wbv s LEU 522 CO 0.57 -0.42 1.83 0.77 0.23 0.00 0.00 176.35 179.32 2wbv h SER 523 N 3.50 0.00 -0.66 2.29 4.64 -1.50 -3.43 113.55 118.39 2wbv h SER 523 Ca -0.48 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 60.90 2wbv h SER 523 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2wbv h SER 523 CO 0.66 0.01 0.18 0.61 -0.87 0.00 0.00 176.83 177.42 2wbv n GLY 524 N 0.47 0.66 3.61 -0.77 0.00 -1.26 -5.01 105.19 102.90 2wbv n GLY 524 Ca 0.02 -0.90 -0.47 0.00 0.00 0.00 0.00 46.02 44.67 2wbv n GLY 524 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbv n GLY 525 N -0.19 0.33 2.85 -0.02 0.00 -1.26 -4.42 105.19 102.48 2wbv n GLY 525 Ca 0.01 0.52 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 2wbv n GLY 525 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wbv s THR 526 N -0.13 -0.02 0.08 2.61 2.01 0.07 -4.96 115.64 115.29 2wbv s THR 526 Ca 0.71 0.06 -0.31 0.00 0.31 0.00 0.00 61.69 62.47 2wbv s THR 526 Cb -0.77 -0.04 -0.08 0.00 0.01 0.00 0.00 72.50 71.61 2wbv s THR 526 CO 0.51 0.02 1.59 -0.22 -0.69 0.00 0.00 174.62 175.84 2wbv s LEU 527 N 0.30 4.36 -1.37 4.42 2.96 -1.26 -0.64 118.68 127.45 2wbv s LEU 527 Ca -0.02 2.45 -0.14 0.00 -0.22 0.00 0.00 54.13 56.20 2wbv s LEU 527 Cb -0.04 -3.57 0.09 0.00 0.50 0.00 0.00 46.19 43.17 2wbv s LEU 527 CO -0.01 -0.84 1.99 0.33 -1.32 0.00 0.00 176.35 176.50 2wbv n PHE 528 N 5.25 3.73 -3.81 5.38 7.35 0.12 -3.94 117.46 131.55 2wbv n PHE 528 Ca 0.15 -2.94 -0.30 0.00 -0.76 0.00 0.00 57.45 53.60 2wbv n PHE 528 Cb 0.41 -2.41 -0.14 0.00 0.35 0.00 0.00 39.48 37.70 2wbv n PHE 528 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2wbv s LYS 529 N 2.62 1.47 0.53 -4.13 2.20 -1.26 -0.77 119.74 120.40 2wbv s LYS 529 Ca 0.46 -2.12 -0.18 0.00 -0.36 0.00 0.00 55.97 53.78 2wbv s LYS 529 Cb 0.10 -2.67 -0.07 0.00 -1.51 0.00 0.00 37.83 33.68 2wbv s LYS 529 CO -0.03 -1.12 1.03 0.95 -0.36 0.00 0.00 175.35 175.83 2wbv s THR 530 N 0.29 3.93 1.07 3.43 -4.23 -0.22 0.01 115.64 119.93 2wbv s THR 530 Ca 0.16 1.05 -0.15 0.00 -1.18 0.00 0.00 61.69 61.57 2wbv s THR 530 Cb -0.24 -3.47 0.13 0.00 1.34 0.00 0.00 72.50 70.26 2wbv s THR 530 CO -0.02 -0.41 0.38 0.47 -0.54 0.00 0.00 174.62 174.50 2wbv n ASP 531 N -1.46 -1.98 -4.66 3.99 8.00 -0.15 -4.51 116.55 115.78 2wbv n ASP 531 Ca 0.09 0.03 -0.43 0.00 0.71 0.00 0.00 54.79 55.18 2wbv n ASP 531 Cb 0.53 -1.12 -0.02 0.00 -0.02 0.00 0.00 41.12 40.49 2wbv n ASP 531 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wbv s VAL 532 N -2.34 4.12 -0.03 2.53 1.01 -1.26 -4.50 120.40 119.93 2wbv s VAL 532 Ca 0.59 1.34 -0.01 0.00 0.00 0.00 0.00 61.98 63.91 2wbv s VAL 532 Cb -0.18 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2wbv s VAL 532 CO 0.66 -0.14 0.04 -0.76 0.00 0.00 0.00 175.10 174.89 2wbv s LEU 533 N 3.70 3.72 -0.03 3.92 1.43 0.17 -4.95 118.68 126.64 2wbv s LEU 533 Ca 0.59 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.83 2wbv s LEU 533 Cb -0.24 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.92 2wbv s LEU 533 CO 0.18 0.31 -0.11 -0.89 0.23 0.00 0.00 176.35 176.07 2wbv s THR 534 N -1.07 0.92 0.16 5.49 2.01 -1.26 -0.77 115.64 121.12 2wbv s THR 534 Ca 0.19 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.75 2wbv s THR 534 Cb -0.12 -0.81 -0.04 0.00 0.01 0.00 0.00 72.50 71.54 2wbv s THR 534 CO 0.09 0.28 0.03 -0.36 -0.69 0.00 0.00 174.62 173.97 2wbv s PHE 535 N 0.11 1.08 -0.03 4.92 0.08 -0.52 -4.99 117.98 118.64 2wbv s PHE 535 Ca -0.02 -1.12 -0.03 0.00 0.12 0.00 0.00 56.93 55.87 2wbv s PHE 535 Cb -0.09 -0.61 0.01 0.00 -0.57 0.00 0.00 43.02 41.76 2wbv s PHE 535 CO 0.01 -0.35 0.09 0.99 -0.10 0.00 0.00 175.22 175.85 2wbv s THR 536 N -3.83 0.02 0.17 0.64 2.01 -1.26 -0.27 115.64 113.12 2wbv s THR 536 Ca 0.25 -0.16 -0.13 0.00 0.31 0.00 0.00 61.69 61.96 2wbv s THR 536 Cb 0.07 -0.18 0.01 0.00 0.01 0.00 0.00 72.50 72.41 2wbv s THR 536 CO 0.03 -0.09 0.39 -0.72 -0.69 0.00 0.00 174.62 173.55 2wbv s TYR 537 N -0.24 0.12 -0.01 4.92 -0.85 -0.66 -4.99 117.35 115.62 2wbv s TYR 537 Ca -0.03 -0.48 -0.30 0.00 -0.52 0.00 0.00 57.07 55.74 2wbv s TYR 537 Cb -0.02 0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.44 2wbv s TYR 537 CO 0.00 -0.79 1.14 0.08 -1.52 0.00 0.00 175.55 174.46 2wbv s VAL 538 N -3.91 4.36 0.57 -3.49 1.01 -1.26 -0.17 120.40 117.52 2wbv s VAL 538 Ca 0.12 1.69 -0.15 0.00 0.00 0.00 0.00 61.98 63.63 2wbv s VAL 538 Cb 0.01 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 2wbv s VAL 538 CO -0.03 0.06 1.03 -0.83 0.00 0.00 0.00 175.10 175.33 2wbv s GLY 539 N 1.22 2.02 0.65 4.51 0.00 -0.01 -1.42 107.32 114.29 2wbv s GLY 539 Ca 0.55 0.24 -0.16 0.00 0.00 0.00 0.00 44.72 45.35 2wbv s GLY 539 CO 0.25 0.54 1.13 1.85 0.00 0.00 0.00 173.10 176.87 2wbv s GLU 540 N -4.26 2.81 0.17 2.90 2.56 0.69 -4.24 118.70 119.34 2wbv s GLU 540 Ca 0.61 1.50 -0.19 0.00 0.00 0.00 0.00 54.97 56.89 2wbv s GLU 540 Cb -0.13 -1.94 -0.08 0.00 2.00 0.00 0.00 34.13 33.98 2wbv s GLU 540 CO 0.38 -1.26 0.66 -0.80 -0.56 0.00 0.00 175.26 173.68 2wbv s ASN 541 N -2.32 7.02 0.00 -1.70 0.01 -1.26 -4.53 114.94 112.16 2wbv s ASN 541 Ca 0.69 1.32 0.00 0.00 -0.71 0.00 0.00 52.86 54.17 2wbv s ASN 541 Cb -0.23 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.05 2wbv s ASN 541 CO 0.39 0.10 0.32 1.67 -1.51 0.00 0.00 177.10 178.07