#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbv h PRO 358 N 0.00 0.49 0.00 1.43 0.11 -2.04 0.15 132.00 132.15 2wbv h PRO 358 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2wbv h PRO 358 Cb 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 2wbv h PRO 358 CO 0.00 0.33 0.00 -0.35 -0.21 0.00 0.00 178.00 177.77 2wbv n PRO 359 N -4.94 0.07 0.08 1.05 -0.04 -1.26 -1.36 135.00 128.61 2wbv n PRO 359 Ca 0.26 0.57 0.13 0.00 -0.04 0.00 0.00 63.50 64.42 2wbv n PRO 359 Cb 0.75 -1.74 0.42 0.00 -0.04 0.00 0.00 33.50 32.89 2wbv n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wbv n ALA 360 N -1.64 2.36 0.35 0.55 0.00 0.04 -4.35 120.51 117.81 2wbv n ALA 360 Ca -0.01 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.49 2wbv n ALA 360 Cb 0.02 -1.44 -0.06 0.00 0.00 0.00 0.00 19.45 17.97 2wbv n ALA 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wbv n ALA 361 N -1.74 3.19 -1.79 0.00 0.00 -0.46 -4.96 120.51 114.75 2wbv n ALA 361 Ca 0.06 -0.43 -0.34 0.00 0.00 0.00 0.00 53.44 52.73 2wbv n ALA 361 Cb 0.42 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 2wbv n ALA 361 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wbv s PRO 362 N -3.31 3.81 -0.10 0.00 0.04 -1.26 -4.89 135.00 129.29 2wbv s PRO 362 Ca -0.00 1.28 -0.15 0.00 0.04 0.00 0.00 61.00 62.17 2wbv s PRO 362 Cb 0.14 -2.10 0.03 0.00 0.04 0.00 0.00 34.50 32.61 2wbv s PRO 362 CO 0.84 -0.41 0.37 -1.50 0.04 0.00 0.00 177.00 176.34 2wbv s ILE 363 N -2.12 0.02 -0.10 0.56 2.07 -0.77 -5.01 121.20 115.85 2wbv s ILE 363 Ca 0.65 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.76 2wbv s ILE 363 Cb -0.15 -0.58 0.01 0.00 0.13 0.00 0.00 42.46 41.87 2wbv s ILE 363 CO 0.22 -0.09 -0.21 -0.89 -1.91 0.00 0.00 174.94 172.06 2wbv s THR 364 N -0.38 1.86 -0.08 4.00 2.01 -1.26 -0.37 115.64 121.41 2wbv s THR 364 Ca -0.05 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.07 2wbv s THR 364 Cb -0.03 -1.63 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2wbv s THR 364 CO 0.02 0.51 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.62 2wbv s LEU 365 N 0.55 3.05 0.26 4.42 1.43 -0.23 -1.04 118.68 127.12 2wbv s LEU 365 Ca -0.15 -0.09 -0.21 0.00 -1.03 0.00 0.00 54.13 52.64 2wbv s LEU 365 Cb -0.17 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.42 2wbv s LEU 365 CO 0.05 0.32 0.77 -1.66 0.23 0.00 0.00 176.35 176.06 2wbv s TRP 366 N -0.56 -0.16 -0.81 0.29 1.48 0.46 -0.22 118.94 119.42 2wbv s TRP 366 Ca 0.08 -0.29 0.27 0.00 -1.06 0.00 0.00 56.10 55.10 2wbv s TRP 366 Cb -0.12 0.71 0.86 0.00 -1.16 0.00 0.00 33.47 33.76 2wbv s TRP 366 CO 0.02 -1.19 1.75 0.25 -4.06 0.00 0.00 176.95 173.72 2wbv n THR 367 N -0.47 0.37 -0.14 0.66 -2.24 -0.79 -1.81 114.28 109.86 2wbv n THR 367 Ca -0.05 -0.19 0.02 0.00 -2.27 0.00 0.00 64.05 61.56 2wbv n THR 367 Cb 0.59 -0.47 -0.01 0.00 -2.10 0.00 0.00 70.33 68.35 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 1.38 -1.86 3.80 3.38 0.00 -1.26 -4.61 105.19 106.01 2wbv n GLY 368 Ca 0.06 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 2wbv n GLY 368 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wbv s PRO 369 N -1.90 2.38 -1.25 1.61 0.02 -1.26 -4.25 135.00 130.34 2wbv s PRO 369 Ca 0.00 0.82 -0.10 0.00 0.02 0.00 0.00 61.00 61.73 2wbv s PRO 369 Cb 0.00 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.58 2wbv s PRO 369 CO 0.00 -1.46 0.66 0.41 -0.33 0.00 0.00 177.00 176.28 2wbv n GLY 370 N -1.92 -0.62 3.74 0.52 0.00 -1.26 -4.91 105.19 100.73 2wbv n GLY 370 Ca 0.07 0.30 -0.34 0.00 0.00 0.00 0.00 46.02 46.06 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 -6.13 2.33 1.22 1.61 0.04 -1.26 -5.03 135.00 127.78 2wbv s PRO 371 Ca 0.24 1.64 -0.21 0.00 0.04 0.00 0.00 61.00 62.72 2wbv s PRO 371 Cb -0.08 -1.87 0.30 0.00 0.04 0.00 0.00 34.50 32.89 2wbv s PRO 371 CO 0.86 -1.66 1.15 -1.54 0.04 0.00 0.00 177.00 175.84 2wbv s SER 372 N -2.21 0.78 -0.91 6.66 1.04 -1.26 -4.82 113.70 112.98 2wbv s SER 372 Ca 0.72 0.44 -0.24 0.00 0.48 0.00 0.00 55.95 57.35 2wbv s SER 372 Cb -0.26 -0.55 0.01 0.00 0.10 0.00 0.00 66.02 65.32 2wbv s SER 372 CO 0.44 -4.19 1.60 -0.63 0.98 0.00 0.00 173.24 171.44 2wbv s ILE 373 N -3.14 3.71 -0.41 -1.02 1.01 -1.26 -4.18 121.20 115.92 2wbv s ILE 373 Ca 0.73 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 61.03 2wbv s ILE 373 Cb -0.07 -4.65 0.06 0.00 0.01 0.00 0.00 42.46 37.82 2wbv s ILE 373 CO 0.55 -1.56 0.82 -0.46 0.00 0.00 0.00 174.94 174.29 2wbv n ASN 374 N 10.71 1.75 -4.44 3.58 6.94 -0.90 -4.76 115.26 128.14 2wbv n ASN 374 Ca 0.29 -1.52 -0.38 0.00 -0.02 0.00 0.00 54.58 52.95 2wbv n ASN 374 Cb 0.50 -0.03 -0.12 0.00 -2.36 0.00 0.00 39.78 37.77 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 -0.61 1.86 -0.11 4.83 0.00 0.61 -4.39 107.32 109.51 2wbv s GLY 375 Ca 0.06 -1.38 -0.02 0.00 0.00 0.00 0.00 44.72 43.38 2wbv s GLY 375 CO 0.05 0.69 -0.02 -1.36 0.00 0.00 0.00 173.10 172.46 2wbv s PHE 376 N 1.61 3.08 -0.12 1.90 0.08 -0.05 -1.00 117.98 123.49 2wbv s PHE 376 Ca 0.05 0.01 0.00 0.00 0.12 0.00 0.00 56.93 57.11 2wbv s PHE 376 Cb -0.17 -1.84 0.02 0.00 -0.57 0.00 0.00 43.02 40.46 2wbv s PHE 376 CO 0.06 0.27 -0.11 0.42 -0.10 0.00 0.00 175.22 175.76 2wbv s ILE 377 N -0.42 1.28 -1.44 0.64 1.01 -0.62 -4.59 121.20 117.07 2wbv s ILE 377 Ca 0.07 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.15 2wbv s ILE 377 Cb -0.12 -1.23 0.05 0.00 0.01 0.00 0.00 42.46 41.17 2wbv s ILE 377 CO 0.02 0.41 1.04 0.59 0.00 0.00 0.00 174.94 177.00 2wbv n ASN 378 N 4.64 -4.98 -1.13 3.58 3.02 -1.26 -2.05 115.26 117.08 2wbv n ASN 378 Ca -0.16 -0.69 -0.15 0.00 -0.03 0.00 0.00 54.58 53.55 2wbv n ASN 378 Cb 0.50 -4.38 -0.06 0.00 -0.61 0.00 0.00 39.78 35.23 2wbv n ASN 378 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2wbv n ASP 379 N -2.93 -5.28 -4.44 6.41 8.00 -1.26 -5.00 116.55 112.04 2wbv n ASP 379 Ca -0.01 0.36 -0.34 0.00 0.71 0.00 0.00 54.79 55.51 2wbv n ASP 379 Cb 0.56 -4.08 -0.13 0.00 -0.02 0.00 0.00 41.12 37.45 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 -2.38 3.75 -0.21 -3.53 2.01 -0.87 -5.07 115.64 109.34 2wbv s THR 380 Ca 0.00 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.31 2wbv s THR 380 Cb 0.00 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 2wbv s THR 380 CO 0.00 0.47 1.47 -2.16 -0.69 0.00 0.00 174.62 173.71 2wbv s PRO 381 N 0.69 3.96 0.00 4.92 0.04 -1.26 -1.59 135.00 141.76 2wbv s PRO 381 Ca -0.02 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.64 2wbv s PRO 381 Cb -0.14 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.46 2wbv s PRO 381 CO 0.02 -1.07 0.00 1.33 0.04 0.00 0.00 177.00 177.32 2wbv n VAL 382 N 6.03 0.00 -4.30 -0.36 0.24 -0.17 -4.91 118.33 114.85 2wbv n VAL 382 Ca 0.17 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.28 2wbv n VAL 382 Cb 0.45 0.03 -0.15 0.00 -1.47 0.00 0.00 33.84 32.70 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 -1.58 0.64 -0.29 1.34 1.01 -0.96 -0.42 121.20 120.95 2wbv s ILE 383 Ca 0.00 -0.30 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 2wbv s ILE 383 Cb 0.00 -0.57 -0.01 0.00 0.01 0.00 0.00 42.46 41.89 2wbv s ILE 383 CO 0.00 0.20 0.68 -0.13 0.00 0.00 0.00 174.94 175.69 2wbv s ARG 384 N 0.10 3.97 -0.24 2.79 0.52 0.51 -0.29 118.95 126.31 2wbv s ARG 384 Ca -0.01 0.45 -0.02 0.00 -0.52 0.00 0.00 55.73 55.62 2wbv s ARG 384 Cb -0.06 -3.71 0.02 0.00 0.52 0.00 0.00 34.95 31.72 2wbv s ARG 384 CO -0.00 -0.56 -0.05 0.00 0.02 0.00 0.00 175.30 174.70 2wbv s PHE 386 N 1.37 3.19 -0.08 0.00 5.36 0.35 -4.77 117.98 123.41 2wbv s PHE 386 Ca 0.02 0.14 0.02 0.00 -0.96 0.00 0.00 56.93 56.14 2wbv s PHE 386 Cb -0.16 -2.83 0.02 0.00 -0.34 0.00 0.00 43.02 39.71 2wbv s PHE 386 CO -0.04 -0.49 -0.11 0.42 -1.46 0.00 0.00 175.22 173.54 2wbv s ILE 387 N 2.26 1.09 -0.09 3.12 -1.09 -1.26 -1.09 121.20 124.14 2wbv s ILE 387 Ca 0.16 -0.42 0.00 0.00 -2.23 0.00 0.00 60.65 58.17 2wbv s ILE 387 Cb -0.16 -1.02 0.02 0.00 -1.58 0.00 0.00 42.46 39.72 2wbv s ILE 387 CO 0.12 0.35 -0.07 0.00 -1.23 0.00 0.00 174.94 174.11 2wbv s LEU 389 N 1.38 4.01 -0.27 0.00 1.43 0.70 -0.92 118.68 125.00 2wbv s LEU 389 Ca -0.02 -1.18 -0.05 0.00 -1.03 0.00 0.00 54.13 51.86 2wbv s LEU 389 Cb -0.14 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.32 2wbv s LEU 389 CO -0.04 -0.27 0.02 -0.89 0.23 0.00 0.00 176.35 175.39 2wbv s THR 390 N 1.32 3.54 -0.21 5.49 2.01 -0.34 -1.07 115.64 126.38 2wbv s THR 390 Ca -0.03 -0.77 -0.18 0.00 0.31 0.00 0.00 61.69 61.02 2wbv s THR 390 Cb -0.19 -2.79 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 2wbv s THR 390 CO 0.00 0.17 0.49 -0.60 -0.69 0.00 0.00 174.62 173.99 2wbv s ARG 391 N 1.44 4.16 0.00 4.92 6.06 0.50 -0.83 118.95 135.20 2wbv s ARG 391 Ca 0.02 0.35 0.00 0.00 -2.50 0.00 0.00 55.73 53.60 2wbv s ARG 391 Cb -0.17 -3.58 0.00 0.00 0.06 0.00 0.00 34.95 31.27 2wbv s ARG 391 CO -0.01 -0.17 0.00 -0.25 -2.50 0.00 0.00 175.30 172.37 2wbv n ASP 392 N 4.89 0.00 -0.16 -2.12 8.00 -0.99 -1.84 116.55 124.33 2wbv n ASP 392 Ca -0.05 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.34 2wbv n ASP 392 Cb 0.50 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.60 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 0.84 0.00 -2.24 4.64 -1.93 -3.42 113.55 111.44 2wbv h SER 393 Ca 0.00 -0.33 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2wbv h SER 393 Cb 0.00 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.86 2wbv h SER 393 CO 0.00 0.97 -0.13 -3.20 -0.87 0.00 0.00 176.83 173.60 2wbv n ASN 394 N -4.32 0.31 -4.90 4.97 5.15 -1.26 -5.06 115.26 110.14 2wbv n ASN 394 Ca 0.00 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.68 2wbv n ASN 394 Cb 0.34 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.55 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 -3.98 4.19 -0.16 1.20 1.43 -1.26 -0.72 118.68 119.38 2wbv s LEU 395 Ca 0.00 0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 53.66 2wbv s LEU 395 Cb 0.00 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 2wbv s LEU 395 CO 0.00 -0.05 0.02 -0.69 0.23 0.00 0.00 176.35 175.86 2wbv s VAL 396 N -1.83 4.44 -0.22 -1.59 1.01 0.57 -2.35 120.40 120.43 2wbv s VAL 396 Ca 0.42 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.15 2wbv s VAL 396 Cb -0.11 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2wbv s VAL 396 CO 0.27 0.49 0.11 -0.89 0.00 0.00 0.00 175.10 175.08 2wbv s THR 397 N 0.23 5.07 -0.20 3.92 2.01 -0.01 -1.46 115.64 125.21 2wbv s THR 397 Ca 0.01 0.07 -0.16 0.00 0.31 0.00 0.00 61.69 61.93 2wbv s THR 397 Cb -0.13 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 2wbv s THR 397 CO 0.01 0.39 0.40 -0.69 -0.69 0.00 0.00 174.62 174.05 2wbv s VAL 398 N 0.80 5.20 -0.15 3.82 1.01 0.71 -1.20 120.40 130.59 2wbv s VAL 398 Ca 0.06 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.76 2wbv s VAL 398 Cb -0.13 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.54 2wbv s VAL 398 CO 0.02 0.25 -0.15 0.21 0.00 0.00 0.00 175.10 175.44 2wbv s ASN 399 N 1.03 2.72 -0.01 3.32 3.84 -0.10 -1.45 114.94 124.29 2wbv s ASN 399 Ca 0.19 -0.50 -0.06 0.00 0.21 0.00 0.00 52.86 52.70 2wbv s ASN 399 Cb -0.15 -1.21 0.00 0.00 -0.55 0.00 0.00 41.25 39.34 2wbv s ASN 399 CO 0.08 -0.04 0.12 0.00 -2.79 0.00 0.00 177.10 174.46 2wbv s ALA 400 N 1.43 -0.28 0.05 1.71 0.00 -0.30 -0.61 121.76 123.76 2wbv s ALA 400 Ca 0.04 -0.02 -0.18 0.00 0.00 0.00 0.00 51.96 51.80 2wbv s ALA 400 Cb -0.13 0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2wbv s ALA 400 CO -0.10 -0.16 0.41 -1.54 0.00 0.00 0.00 175.76 174.37 2wbv s SER 401 N -0.94 -0.28 -0.00 0.00 1.04 -0.25 -0.26 113.70 113.02 2wbv s SER 401 Ca -0.10 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2wbv s SER 401 Cb -0.06 0.43 -0.00 0.00 0.10 0.00 0.00 66.02 66.49 2wbv s SER 401 CO 0.01 -0.68 -0.01 -0.36 0.98 0.00 0.00 173.24 173.18 2wbv s PHE 402 N -2.58 0.09 -0.11 5.02 0.08 -1.26 -0.49 117.98 118.71 2wbv s PHE 402 Ca -0.05 -0.02 -0.00 0.00 0.12 0.00 0.00 56.93 56.99 2wbv s PHE 402 Cb -0.01 -0.05 0.02 0.00 -0.57 0.00 0.00 43.02 42.41 2wbv s PHE 402 CO -0.03 -0.00 -0.09 0.08 -0.10 0.00 0.00 175.22 175.08 2wbv s VAL 403 N -0.03 1.12 0.35 -0.44 1.01 -0.38 -1.16 120.40 120.87 2wbv s VAL 403 Ca 0.00 -0.36 -0.27 0.00 0.00 0.00 0.00 61.98 61.36 2wbv s VAL 403 Cb -0.00 -1.11 -0.09 0.00 0.00 0.00 0.00 36.38 35.18 2wbv s VAL 403 CO -0.00 0.38 1.13 -0.83 0.00 0.00 0.00 175.10 175.78 2wbv s GLY 404 N 1.57 2.93 0.26 4.51 0.00 0.22 -0.36 107.32 116.44 2wbv s GLY 404 Ca 0.03 0.91 0.04 0.00 0.00 0.00 0.00 44.72 45.70 2wbv s GLY 404 CO -0.07 1.45 -0.01 -0.54 0.00 0.00 0.00 173.10 173.92 2wbv s GLU 405 N -1.98 1.45 6.54 2.90 0.41 0.44 -3.92 118.70 124.55 2wbv s GLU 405 Ca 0.52 -1.75 0.00 0.00 -0.41 0.00 0.00 54.97 53.33 2wbv s GLU 405 Cb -0.30 -0.81 0.00 0.00 -1.78 0.00 0.00 34.13 31.24 2wbv s GLU 405 CO 0.38 -0.07 0.00 0.41 -0.49 0.00 0.00 175.26 175.49 2wbv n GLY 406 N -0.51 3.57 0.11 -1.39 0.00 -1.26 -0.72 105.19 104.98 2wbv n GLY 406 Ca -0.05 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.06 2wbv n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbv n GLY 407 N 0.00 -1.12 1.22 -0.02 0.00 -1.26 -2.44 105.19 101.57 2wbv n GLY 407 Ca 0.00 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.22 2wbv n GLY 407 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wbv n TYR 408 N -2.09 0.74 -0.20 1.61 4.01 0.10 -4.44 117.16 116.88 2wbv n TYR 408 Ca 0.02 -0.37 -0.07 0.00 -0.16 0.00 0.00 57.90 57.32 2wbv n TYR 408 Cb 0.17 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.23 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 4.22 0.80 -5.72 -0.72 2.43 -1.42 -3.35 114.38 110.62 2wbv h ARG 409 Ca 0.00 -0.11 -0.68 0.00 -0.81 0.00 0.00 59.98 58.38 2wbv h ARG 409 Cb 0.95 -0.15 -0.31 0.00 -0.42 0.00 0.00 29.97 30.04 2wbv h ARG 409 CO 0.00 0.64 -0.86 0.42 -1.51 0.00 0.00 179.97 178.65 2wbv s ILE 410 N -5.78 2.24 -0.02 1.20 1.01 -1.26 -0.96 121.20 117.64 2wbv s ILE 410 Ca -0.13 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 59.58 2wbv s ILE 410 Cb 0.12 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 2wbv s ILE 410 CO 0.77 0.56 -0.13 0.68 0.00 0.00 0.00 174.94 176.82 2wbv s VAL 411 N 0.04 3.17 0.38 2.92 -7.23 -0.03 -4.89 120.40 114.75 2wbv s VAL 411 Ca -0.09 -0.82 0.07 0.00 -1.81 0.00 0.00 61.98 59.34 2wbv s VAL 411 Cb -0.15 -2.30 -0.01 0.00 0.56 0.00 0.00 36.38 34.49 2wbv s VAL 411 CO 0.06 0.49 0.48 -0.94 -0.31 0.00 0.00 175.10 174.87 2wbv s SER 412 N -1.04 5.63 0.62 4.85 1.04 -1.26 -1.15 113.70 122.38 2wbv s SER 412 Ca 0.13 -0.40 0.33 0.00 0.48 0.00 0.00 55.95 56.50 2wbv s SER 412 Cb -0.11 -0.87 1.93 0.00 0.10 0.00 0.00 66.02 67.07 2wbv s SER 412 CO 0.03 -0.59 2.22 -0.65 0.98 0.00 0.00 173.24 175.24 2wbv h PRO 413 N 0.85 0.00 -0.15 4.02 0.11 -1.76 -1.88 132.00 133.19 2wbv h PRO 413 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2wbv h PRO 413 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2wbv h PRO 413 CO 0.51 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.55 2wbv n THR 414 N -3.57 0.19 -1.67 -1.15 -2.24 -1.26 -2.52 114.28 102.06 2wbv n THR 414 Ca -0.02 -0.34 -0.46 0.00 -2.27 0.00 0.00 64.05 60.96 2wbv n THR 414 Cb 0.16 0.41 -0.04 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.34 2.08 -2.52 -0.78 -0.06 -0.71 -4.95 117.38 110.78 2wbv n GLN 415 Ca 0.17 0.75 -0.38 0.00 -2.00 0.00 0.00 57.00 55.53 2wbv n GLN 415 Cb 0.34 -2.48 -0.04 0.00 -4.06 0.00 0.00 30.24 24.00 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 0.73 6.96 0.74 1.69 0.15 -1.26 -4.66 113.70 118.04 2wbv s SER 416 Ca 0.76 2.13 -0.15 0.00 0.70 0.00 0.00 55.95 59.38 2wbv s SER 416 Cb -0.68 -2.60 0.04 0.00 -1.71 0.00 0.00 66.02 61.07 2wbv s SER 416 CO 0.41 -0.36 1.25 0.00 1.20 0.00 0.00 173.24 175.75 2wbv s GLN 417 N -2.08 2.03 0.03 5.44 0.00 -1.26 -5.02 119.66 118.81 2wbv s GLN 417 Ca 0.53 1.90 -0.19 0.00 -0.00 0.00 0.00 55.36 57.60 2wbv s GLN 417 Cb -0.26 -1.80 0.04 0.00 0.00 0.00 0.00 33.01 30.99 2wbv s GLN 417 CO 0.33 -1.95 0.42 -0.59 0.00 0.00 0.00 175.29 173.50 2wbv s PHE 418 N -1.80 -0.29 -0.10 9.60 -0.12 -1.00 -5.01 117.98 119.26 2wbv s PHE 418 Ca 0.78 0.29 -0.01 0.00 -0.05 0.00 0.00 56.93 57.93 2wbv s PHE 418 Cb -0.33 0.22 -0.03 0.00 -0.63 0.00 0.00 43.02 42.26 2wbv s PHE 418 CO 0.46 -0.56 -0.04 -1.12 -0.05 0.00 0.00 175.22 173.91 2wbv s SER 419 N -1.90 4.87 -0.38 1.98 0.01 -1.26 -0.81 113.70 116.21 2wbv s SER 419 Ca -0.06 -0.00 -0.07 0.00 1.31 0.00 0.00 55.95 57.13 2wbv s SER 419 Cb -0.01 -1.43 0.07 0.00 0.21 0.00 0.00 66.02 64.85 2wbv s SER 419 CO -0.01 0.31 0.17 -0.76 0.41 0.00 0.00 173.24 173.36 2wbv s LEU 420 N -0.51 4.74 -0.20 2.44 1.43 0.34 -4.94 118.68 121.98 2wbv s LEU 420 Ca 0.08 -1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 51.65 2wbv s LEU 420 Cb -0.12 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 2wbv s LEU 420 CO 0.02 -0.43 0.17 -0.63 0.23 0.00 0.00 176.35 175.71 2wbv s ILE 421 N 1.36 5.38 -0.22 -0.59 1.01 -1.26 -1.03 121.20 125.85 2wbv s ILE 421 Ca 0.01 0.26 -0.09 0.00 0.00 0.00 0.00 60.65 60.83 2wbv s ILE 421 Cb -0.21 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 2wbv s ILE 421 CO 0.01 0.41 0.11 -0.04 0.00 0.00 0.00 174.94 175.43 2wbv s MET 422 N 0.53 3.97 -0.18 2.79 -1.94 0.27 -0.65 119.30 124.09 2wbv s MET 422 Ca 0.10 -0.33 -0.07 0.00 -1.71 0.00 0.00 55.69 53.68 2wbv s MET 422 Cb -0.12 -3.39 -0.04 0.00 2.01 0.00 0.00 34.83 33.29 2wbv s MET 422 CO 0.00 0.10 0.04 -1.21 -0.01 0.00 0.00 175.02 173.94 2wbv s GLU 423 N 0.91 3.91 0.02 2.03 2.02 -1.26 -2.00 118.70 124.33 2wbv s GLU 423 Ca 0.06 -0.38 0.07 0.00 0.02 0.00 0.00 54.97 54.74 2wbv s GLU 423 Cb -0.13 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 30.93 2wbv s GLU 423 CO 0.03 0.27 -0.22 -0.06 0.02 0.00 0.00 175.26 175.31 2wbv s PHE 424 N 0.35 1.91 0.54 1.61 0.08 -0.23 0.09 117.98 122.33 2wbv s PHE 424 Ca 0.01 -0.37 -0.07 0.00 0.12 0.00 0.00 56.93 56.62 2wbv s PHE 424 Cb -0.13 -1.17 0.12 0.00 -0.57 0.00 0.00 43.02 41.28 2wbv s PHE 424 CO 0.01 0.06 0.74 -0.40 -0.10 0.00 0.00 175.22 175.52 2wbv n ASP 425 N 2.07 0.26 0.08 1.36 5.68 -0.54 -0.98 116.55 124.49 2wbv n ASP 425 Ca -0.16 -1.39 0.10 0.00 -0.50 0.00 0.00 54.79 52.84 2wbv n ASP 425 Cb 0.53 -0.55 0.43 0.00 -1.14 0.00 0.00 41.12 40.39 2wbv n ASP 425 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wbv n GLN 426 N -2.53 0.13 -0.42 0.11 10.64 -1.26 -2.01 117.38 122.04 2wbv n GLN 426 Ca 0.10 0.34 0.10 0.00 -1.83 0.00 0.00 57.00 55.71 2wbv n GLN 426 Cb 0.35 -1.74 0.31 0.00 -0.86 0.00 0.00 30.24 28.30 2wbv n GLN 426 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2wbv n PHE 427 N -1.98 1.07 -1.06 2.61 3.72 -1.26 -4.92 117.46 115.64 2wbv n PHE 427 Ca 0.03 -0.54 -0.02 0.00 -0.05 0.00 0.00 57.45 56.87 2wbv n PHE 427 Cb 0.23 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.67 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 1.30 0.54 3.67 1.37 0.00 -0.85 -2.99 105.19 108.22 2wbv n GLY 428 Ca 0.23 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.03 4.25 0.12 1.61 -0.21 -1.26 -4.64 119.66 117.50 2wbv s GLN 429 Ca 0.00 0.61 -0.31 0.00 0.02 0.00 0.00 55.36 55.68 2wbv s GLN 429 Cb 0.00 -3.55 -0.10 0.00 1.00 0.00 0.00 33.01 30.36 2wbv s GLN 429 CO 0.00 -0.16 1.68 -1.17 -2.12 0.00 0.00 175.29 173.52 2wbv s LEU 430 N 1.65 4.38 0.65 2.90 2.96 -1.26 -1.46 118.68 128.50 2wbv s LEU 430 Ca 0.29 2.63 -0.09 0.00 -0.22 0.00 0.00 54.13 56.74 2wbv s LEU 430 Cb -0.16 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.97 2wbv s LEU 430 CO 0.11 -0.91 1.00 -0.04 -1.32 0.00 0.00 176.35 175.19 2wbv s MET 431 N 2.13 2.85 0.00 1.98 -1.94 0.11 -4.44 119.30 119.99 2wbv s MET 431 Ca 0.75 0.20 0.30 0.00 -1.71 0.00 0.00 55.69 55.23 2wbv s MET 431 Cb -0.43 -2.15 1.42 0.00 2.01 0.00 0.00 34.83 35.68 2wbv s MET 431 CO 0.33 -0.89 1.95 -1.13 -0.01 0.00 0.00 175.02 175.27 2wbv n SER 432 N -2.80 0.73 -0.33 3.03 3.41 -1.26 -1.90 113.62 114.50 2wbv n SER 432 Ca 0.06 -1.15 0.06 0.00 -0.26 0.00 0.00 58.87 57.58 2wbv n SER 432 Cb 0.58 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.53 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 -0.49 0.00 -2.03 6.66 -2.24 -1.26 -4.62 114.28 110.31 2wbv n THR 433 Ca 0.20 -0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 61.29 2wbv n THR 433 Cb 0.24 1.17 0.18 0.00 -2.10 0.00 0.00 70.33 69.83 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 -1.46 1.79 0.28 3.38 0.00 -1.26 -4.97 107.32 105.08 2wbv s GLY 434 Ca 0.11 -1.32 0.02 0.00 0.00 0.00 0.00 44.72 43.53 2wbv s GLY 434 CO 0.28 -0.56 1.73 3.43 0.00 0.00 0.00 173.10 177.97 2wbv h ASN 435 N -1.53 0.51 -3.32 1.64 4.21 -1.13 -3.38 115.58 112.58 2wbv h ASN 435 Ca -0.43 -0.17 -0.66 0.00 1.21 0.00 0.00 56.30 56.25 2wbv h ASN 435 Cb 1.23 -0.14 -0.28 0.00 -1.12 0.00 0.00 38.32 38.01 2wbv h ASN 435 CO 0.36 0.74 -0.76 -0.63 -1.29 0.00 0.00 177.43 175.86 2wbv s ILE 436 N -4.55 3.08 0.30 2.81 1.01 -1.06 -0.87 121.20 121.92 2wbv s ILE 436 Ca -0.07 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.88 2wbv s ILE 436 Cb 0.14 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 40.26 2wbv s ILE 436 CO 0.79 0.48 0.50 0.54 0.00 0.00 0.00 174.94 177.25 2wbv s ASN 437 N 1.03 0.37 0.00 3.58 2.20 -1.26 -4.38 114.94 116.48 2wbv s ASN 437 Ca -0.00 -1.22 0.20 0.00 -0.94 0.00 0.00 52.86 50.90 2wbv s ASN 437 Cb -0.15 0.64 1.19 0.00 -2.00 0.00 0.00 41.25 40.94 2wbv s ASN 437 CO -0.01 -1.26 1.74 -1.54 -2.94 0.00 0.00 177.10 173.09 2wbv n SER 438 N -0.94 0.00 0.04 3.54 3.41 -0.80 -2.82 113.62 116.06 2wbv n SER 438 Ca -0.01 -1.29 0.11 0.00 -0.26 0.00 0.00 58.87 57.42 2wbv n SER 438 Cb 0.62 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 65.02 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 -0.83 0.60 -4.66 6.66 -2.24 -1.26 -4.81 114.28 107.74 2wbv n THR 439 Ca 0.15 0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.70 2wbv n THR 439 Cb 0.07 -0.81 -0.08 0.00 -2.10 0.00 0.00 70.33 67.40 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 -3.08 1.46 0.14 4.28 -4.23 -1.13 -5.09 115.64 107.99 2wbv s THR 440 Ca 0.09 -1.97 -0.32 0.00 -1.18 0.00 0.00 61.69 58.32 2wbv s THR 440 Cb 0.13 -2.42 -0.11 0.00 1.34 0.00 0.00 72.50 71.43 2wbv s THR 440 CO 0.43 0.00 1.81 0.41 -0.54 0.00 0.00 174.62 176.73 2wbv n THR 441 N -1.20 0.28 -3.64 3.99 -1.04 -1.26 -4.96 114.28 106.44 2wbv n THR 441 Ca -0.14 -0.05 -0.06 0.00 -2.04 0.00 0.00 64.05 61.76 2wbv n THR 441 Cb 0.67 -2.08 -0.07 0.00 -1.82 0.00 0.00 70.33 67.03 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 2.38 -0.71 -1.87 -1.42 -0.11 -1.26 -4.45 118.94 111.49 2wbv s TRP 442 Ca 0.81 1.49 0.00 0.00 1.22 0.00 0.00 56.10 59.62 2wbv s TRP 442 Cb -0.49 0.42 0.00 0.00 -1.50 0.00 0.00 33.47 31.90 2wbv s TRP 442 CO 0.36 -0.35 0.00 0.41 -4.62 0.00 0.00 176.95 172.75 2wbv n GLY 443 N 3.50 -0.84 3.77 5.86 0.00 -0.75 -4.47 105.19 112.26 2wbv n GLY 443 Ca -0.17 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.75 4.60 -0.33 1.61 2.12 -0.37 -0.41 118.70 125.17 2wbv s GLU 444 Ca 0.00 1.20 -0.20 0.00 0.36 0.00 0.00 54.97 56.33 2wbv s GLU 444 Cb 0.00 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 31.10 2wbv s GLU 444 CO 0.00 0.50 0.60 0.21 -0.54 0.00 0.00 175.26 176.03 2wbv s LYS 445 N -0.92 3.77 0.34 4.30 2.20 -0.20 -0.50 119.74 128.73 2wbv s LYS 445 Ca 0.37 0.11 -0.28 0.00 -0.36 0.00 0.00 55.97 55.81 2wbv s LYS 445 Cb -0.23 -3.77 -0.10 0.00 -1.51 0.00 0.00 37.83 32.22 2wbv s LYS 445 CO 0.27 -0.63 1.26 -2.14 -0.36 0.00 0.00 175.35 173.75 2wbv s PRO 446 N 2.58 4.33 0.18 4.03 0.02 -1.26 -4.52 135.00 140.36 2wbv s PRO 446 Ca 0.23 2.12 -0.32 0.00 0.02 0.00 0.00 61.00 63.05 2wbv s PRO 446 Cb -0.15 -3.02 -0.12 0.00 0.02 0.00 0.00 34.50 31.23 2wbv s PRO 446 CO 0.13 -0.17 1.72 1.87 -0.33 0.00 0.00 177.00 180.22 2wbv n TRP 447 N 0.73 2.66 0.00 6.54 -0.00 -1.26 -2.81 117.44 123.30 2wbv n TRP 447 Ca 0.01 0.04 0.00 0.00 -0.00 0.00 0.00 57.50 57.54 2wbv n TRP 447 Cb 0.43 -2.67 0.00 0.00 -0.00 0.00 0.00 31.31 29.07 2wbv n TRP 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2wbv n GLY 448 N 3.94 0.27 3.56 5.87 0.00 -1.26 -5.06 105.19 112.51 2wbv n GLY 448 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.10 0.03 -0.38 1.61 2.20 -1.12 -5.06 114.94 110.11 2wbv s ASN 449 Ca 0.00 -1.02 0.07 0.00 -0.94 0.00 0.00 52.86 50.97 2wbv s ASN 449 Cb 0.00 0.59 0.65 0.00 -2.00 0.00 0.00 41.25 40.49 2wbv s ASN 449 CO 0.00 -1.16 1.79 0.59 -2.94 0.00 0.00 177.10 175.38 2wbv n ASN 450 N -0.52 3.72 -4.91 3.54 3.02 -1.26 -4.45 115.26 114.41 2wbv n ASN 450 Ca -0.01 -3.54 -0.28 0.00 -0.03 0.00 0.00 54.58 50.71 2wbv n ASN 450 Cb 0.62 -0.77 0.07 0.00 -0.61 0.00 0.00 39.78 39.10 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 -3.21 2.40 -0.19 3.41 -4.23 -1.26 -4.65 115.64 107.92 2wbv s THR 451 Ca 0.54 0.02 0.01 0.00 -1.18 0.00 0.00 61.69 61.07 2wbv s THR 451 Cb 0.45 -3.10 0.03 0.00 1.34 0.00 0.00 72.50 71.22 2wbv s THR 451 CO 0.09 -0.13 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.20 2wbv s VAL 452 N -3.43 1.82 -0.45 2.29 1.01 -1.26 -4.36 120.40 116.02 2wbv s VAL 452 Ca 0.60 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 2wbv s VAL 452 Cb -0.11 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.56 2wbv s VAL 452 CO 0.48 0.35 0.36 -1.10 0.00 0.00 0.00 175.10 175.20 2wbv s GLN 453 N 1.35 2.98 0.05 2.72 -1.52 0.35 -4.84 119.66 120.75 2wbv s GLN 453 Ca 0.02 -1.20 0.28 0.00 -1.95 0.00 0.00 55.36 52.50 2wbv s GLN 453 Cb -0.15 -4.07 1.05 0.00 -0.22 0.00 0.00 33.01 29.63 2wbv s GLN 453 CO -0.10 -0.91 1.83 -0.35 -0.25 0.00 0.00 175.29 175.51 2wbv n PRO 454 N 5.20 0.07 -2.48 2.91 -0.04 -1.26 -1.24 135.00 138.16 2wbv n PRO 454 Ca -0.12 0.05 -0.43 0.00 -0.04 0.00 0.00 63.50 62.97 2wbv n PRO 454 Cb 0.45 -1.58 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 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 -3.03 3.93 0.37 0.54 0.52 -1.26 -4.92 118.95 115.10 2wbv s ARG 455 Ca 0.13 1.16 -0.28 0.00 -0.52 0.00 0.00 55.73 56.22 2wbv s ARG 455 Cb 0.17 -3.85 -0.11 0.00 0.52 0.00 0.00 34.95 31.68 2wbv s ARG 455 CO 0.57 -1.09 1.48 -2.14 0.02 0.00 0.00 175.30 174.14 2wbv s PRO 456 N 4.08 4.12 0.18 3.54 0.02 -1.26 -4.94 135.00 140.73 2wbv s PRO 456 Ca 0.53 2.56 0.11 0.00 0.02 0.00 0.00 61.00 64.23 2wbv s PRO 456 Cb -0.15 -2.97 -0.04 0.00 0.02 0.00 0.00 34.50 31.35 2wbv s PRO 456 CO 0.22 -0.53 -0.24 0.45 -0.33 0.00 0.00 177.00 176.57 2wbv s SER 457 N -0.15 3.39 0.59 2.53 0.15 -1.26 -5.03 113.70 113.92 2wbv s SER 457 Ca 0.53 -0.85 0.34 0.00 0.70 0.00 0.00 55.95 56.67 2wbv s SER 457 Cb -0.46 -0.25 1.83 0.00 -1.71 0.00 0.00 66.02 65.43 2wbv s SER 457 CO 0.63 0.13 2.20 0.45 1.20 0.00 0.00 173.24 177.84 2wbv h HIS 458 N 3.33 0.00 0.00 3.44 3.86 -1.96 -2.31 115.15 121.51 2wbv h HIS 458 Ca -0.47 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 2wbv h HIS 458 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 2wbv h HIS 458 CO 0.67 0.04 0.00 1.79 0.86 0.00 0.00 177.93 181.29 2wbv h THR 459 N 0.00 0.00 -0.01 2.45 1.35 -1.96 -2.91 112.91 111.83 2wbv h THR 459 Ca -0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2wbv h THR 459 Cb 0.18 1.05 -0.00 0.00 -1.73 0.00 0.00 68.15 67.65 2wbv h THR 459 CO 0.01 0.00 0.01 -0.50 -0.25 0.00 0.00 175.52 174.78 2wbv h TRP 460 N 0.00 0.00 -0.25 4.73 4.06 -1.63 -1.30 115.95 121.56 2wbv h TRP 460 Ca 0.00 0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.02 2wbv h TRP 460 Cb 0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 2wbv h TRP 460 CO 0.00 0.00 0.19 -0.22 -3.56 0.00 0.00 178.44 174.85 2wbv h LYS 461 N 0.00 0.00 0.00 0.49 3.64 -1.41 -2.38 116.57 116.91 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 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2wbv h LYS 461 CO -0.00 0.00 0.00 -0.07 -2.27 0.00 0.00 179.45 177.11 2wbv h LEU 462 N 0.00 0.00 -0.42 5.20 3.38 -1.47 -1.50 115.31 120.51 2wbv h LEU 462 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2wbv h LEU 462 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2wbv h LEU 462 CO -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.49 2wbv s MET 464 N -2.14 3.81 -0.27 0.00 -1.94 -0.57 -4.88 119.30 113.31 2wbv s MET 464 Ca 0.39 0.48 -0.29 0.00 -1.71 0.00 0.00 55.69 54.56 2wbv s MET 464 Cb 0.21 -2.41 -0.00 0.00 2.01 0.00 0.00 34.83 34.64 2wbv s MET 464 CO 0.39 0.01 1.33 -1.25 -0.01 0.00 0.00 175.02 175.49 2wbv s PRO 465 N -3.70 3.95 -0.42 2.03 0.04 -1.26 -0.29 135.00 135.34 2wbv s PRO 465 Ca 0.51 1.36 -0.39 0.00 0.04 0.00 0.00 61.00 62.52 2wbv s PRO 465 Cb -0.10 -3.88 -0.17 0.00 0.04 0.00 0.00 34.50 30.39 2wbv s PRO 465 CO 0.29 -1.08 1.44 -1.71 0.04 0.00 0.00 177.00 175.98 2wbv n ASN 466 N 7.58 0.94 0.02 6.66 2.85 -0.47 -4.75 115.26 128.08 2wbv n ASN 466 Ca 0.15 0.92 0.01 0.00 -0.11 0.00 0.00 54.58 55.54 2wbv n ASN 466 Cb 0.46 -0.75 0.32 0.00 1.24 0.00 0.00 39.78 41.06 2wbv n ASN 466 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2wbv h ARG 467 N 4.90 0.49 0.16 1.20 3.08 -1.91 0.63 114.38 122.92 2wbv h ARG 467 Ca -0.31 -0.09 -0.24 0.00 0.07 0.00 0.00 59.98 59.40 2wbv h ARG 467 Cb 1.16 -0.08 0.03 0.00 0.08 0.00 0.00 29.97 31.16 2wbv h ARG 467 CO 0.84 0.51 -1.04 1.49 -1.07 0.00 0.00 179.97 180.70 2wbv h GLU 468 N 0.47 0.42 -0.61 0.04 4.81 -1.98 -1.99 114.58 115.74 2wbv h GLU 468 Ca 0.10 -0.67 -0.03 0.00 -0.13 0.00 0.00 59.36 58.64 2wbv h GLU 468 Cb 0.29 0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 2wbv h GLU 468 CO 0.01 1.31 0.28 0.28 -0.73 0.00 0.00 179.01 180.16 2wbv h VAL 469 N -0.12 1.22 -2.14 0.32 2.07 -1.91 -3.23 116.25 112.45 2wbv h VAL 469 Ca -0.18 -0.63 -0.67 0.00 0.82 0.00 0.00 66.70 66.05 2wbv h VAL 469 Cb 1.80 0.50 -0.37 0.00 -1.52 0.00 0.00 31.29 31.71 2wbv h VAL 469 CO 0.20 0.25 -0.04 -1.22 0.02 0.00 0.00 177.57 176.78 2wbv n TYR 470 N -4.50 3.52 0.29 1.57 4.01 0.20 -4.73 117.16 117.52 2wbv n TYR 470 Ca 0.04 -3.33 0.13 0.00 -0.16 0.00 0.00 57.90 54.58 2wbv n TYR 470 Cb 0.13 -0.69 0.32 0.00 -0.31 0.00 0.00 39.34 38.80 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 3.27 0.00 -3.48 7.72 4.64 -1.38 -3.43 113.55 120.89 2wbv h SER 471 Ca 0.31 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.09 2wbv h SER 471 Cb 0.47 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.38 2wbv h SER 471 CO 0.98 0.00 -0.78 0.42 -0.87 0.00 0.00 176.83 176.57 2wbv s THR 472 N -3.30 1.88 0.41 2.95 -4.23 -1.26 -5.07 115.64 107.01 2wbv s THR 472 Ca 0.06 -1.95 -0.26 0.00 -1.18 0.00 0.00 61.69 58.36 2wbv s THR 472 Cb 0.07 -1.88 -0.10 0.00 1.34 0.00 0.00 72.50 71.92 2wbv s THR 472 CO 0.62 -0.31 1.35 -2.65 -0.54 0.00 0.00 174.62 173.10 2wbv n PRO 473 N 0.25 2.18 -4.45 3.99 -0.02 -1.26 -4.95 135.00 130.73 2wbv n PRO 473 Ca -0.13 0.77 -0.23 0.00 -2.02 0.00 0.00 63.50 61.90 2wbv n PRO 473 Cb 0.57 -2.49 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 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 -1.17 2.60 0.01 3.55 0.00 -0.66 -4.97 121.76 121.13 2wbv s ALA 474 Ca 0.59 -1.86 -0.10 0.00 0.00 0.00 0.00 51.96 50.59 2wbv s ALA 474 Cb -0.50 -0.18 0.01 0.00 0.00 0.00 0.00 23.12 22.45 2wbv s ALA 474 CO 0.60 0.20 0.20 0.00 0.00 0.00 0.00 175.76 176.75 2wbv s ALA 475 N -2.64 -0.44 -0.13 0.00 0.00 -1.26 -0.23 121.76 117.06 2wbv s ALA 475 Ca 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 51.96 52.13 2wbv s ALA 475 Cb -0.03 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.30 2wbv s ALA 475 CO 0.13 -0.28 0.02 0.99 0.00 0.00 0.00 175.76 176.62 2wbv s THR 476 N -1.84 0.44 -0.21 0.00 2.01 -0.28 -5.00 115.64 110.76 2wbv s THR 476 Ca -0.11 -0.18 -0.11 0.00 0.31 0.00 0.00 61.69 61.60 2wbv s THR 476 Cb -0.05 -0.76 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 2wbv s THR 476 CO 0.00 0.05 0.19 -0.51 -0.69 0.00 0.00 174.62 173.66 2wbv s ILE 477 N 1.92 5.35 0.06 1.82 2.07 -1.26 -1.18 121.20 129.98 2wbv s ILE 477 Ca 0.02 0.28 0.00 0.00 -1.41 0.00 0.00 60.65 59.55 2wbv s ILE 477 Cb -0.14 -3.53 -0.04 0.00 0.13 0.00 0.00 42.46 38.88 2wbv s ILE 477 CO -0.07 0.37 -0.05 -0.44 -1.91 0.00 0.00 174.94 172.85 2wbv s SER 478 N 0.77 0.72 0.50 4.50 0.01 -0.81 -4.99 113.70 114.40 2wbv s SER 478 Ca 0.10 -0.91 -0.22 0.00 1.31 0.00 0.00 55.95 56.23 2wbv s SER 478 Cb -0.13 0.14 -0.07 0.00 0.21 0.00 0.00 66.02 66.17 2wbv s SER 478 CO 0.03 -0.48 1.21 -1.14 0.41 0.00 0.00 173.24 173.26 2wbv n ARG 479 N 0.35 1.56 -3.57 12.44 0.63 -1.26 -0.90 116.66 125.90 2wbv n ARG 479 Ca -0.15 0.57 -0.29 0.00 -0.92 0.00 0.00 57.85 57.05 2wbv n ARG 479 Cb 0.60 -2.37 -0.13 0.00 0.45 0.00 0.00 32.46 31.01 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 0.98 2.90 -0.11 0.00 0.00 -1.26 -1.04 107.32 108.79 2wbv s GLY 481 Ca 0.16 1.57 0.01 0.00 0.00 0.00 0.00 44.72 46.46 2wbv s GLY 481 CO -0.05 2.27 -0.13 1.08 0.00 0.00 0.00 173.10 176.28 2wbv s LEU 482 N -2.00 2.76 -1.59 0.66 1.43 -0.36 -0.76 118.68 118.84 2wbv s LEU 482 Ca 0.53 -0.27 -0.15 0.00 -1.03 0.00 0.00 54.13 53.21 2wbv s LEU 482 Cb -0.46 -1.61 0.11 0.00 0.03 0.00 0.00 46.19 44.26 2wbv s LEU 482 CO 0.62 0.22 0.91 -0.67 0.23 0.00 0.00 176.35 177.66 2wbv n ASP 483 N 3.16 -4.20 -0.31 2.29 2.03 0.93 -4.80 116.55 115.64 2wbv n ASP 483 Ca -0.18 -0.86 -0.04 0.00 0.52 0.00 0.00 54.79 54.23 2wbv n ASP 483 Cb 0.53 -3.50 0.08 0.00 -0.72 0.00 0.00 41.12 37.50 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 -1.89 1.08 -0.14 1.67 0.02 -1.85 -0.78 113.55 111.66 2wbv h SER 484 Ca -0.59 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.24 2wbv h SER 484 Cb 1.38 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 2wbv h SER 484 CO 0.71 0.88 0.05 0.40 -1.14 0.00 0.00 176.83 177.73 2wbv h ILE 485 N 1.19 1.17 -0.08 3.27 2.04 -1.96 -0.63 117.51 122.52 2wbv h ILE 485 Ca 0.30 -0.51 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 2wbv h ILE 485 Cb 0.06 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2wbv h ILE 485 CO -0.04 0.15 -0.46 0.00 0.00 0.00 0.00 178.15 177.80 2wbv h ALA 486 N 0.88 1.09 -0.51 1.87 0.00 -1.80 -2.63 119.26 118.16 2wbv h ALA 486 Ca 0.05 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2wbv h ALA 486 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2wbv h ALA 486 CO -0.00 0.61 0.00 1.33 0.00 0.00 0.00 179.25 181.19 2wbv n VAL 487 N -3.99 0.67 -4.24 0.00 0.24 -0.35 -4.96 118.33 105.71 2wbv n VAL 487 Ca -0.02 -0.74 -0.31 0.00 -2.04 0.00 0.00 64.34 61.23 2wbv n VAL 487 Cb 0.51 0.51 -0.07 0.00 -1.47 0.00 0.00 33.84 33.32 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 1.19 -0.15 -2.53 -1.34 2.03 -0.58 -2.33 116.55 112.84 2wbv n ASP 488 Ca 0.19 -1.17 -0.21 0.00 0.52 0.00 0.00 54.79 54.12 2wbv n ASP 488 Cb 0.50 -2.11 0.01 0.00 -0.72 0.00 0.00 41.12 38.80 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 -2.11 -0.47 3.65 0.27 0.00 -0.35 -4.92 105.19 101.26 2wbv n GLY 489 Ca -0.23 0.02 -0.48 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.53 0.63 -0.19 4.61 0.00 -0.98 -4.85 120.51 117.20 2wbv n ALA 490 Ca -0.19 0.45 0.20 0.00 0.00 0.00 0.00 53.44 53.89 2wbv n ALA 490 Cb 0.66 -2.29 0.56 0.00 0.00 0.00 0.00 19.45 18.38 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 5.96 0.30 -0.81 0.00 0.11 -1.93 -1.74 132.00 133.90 2wbv h PRO 491 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wbv h PRO 491 Cb 1.28 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2wbv h PRO 491 CO 0.87 0.20 0.00 -1.13 -0.21 0.00 0.00 178.00 177.72 2wbv n SER 492 N -4.45 2.58 -0.25 -2.05 3.41 -1.26 -3.46 113.62 108.13 2wbv n SER 492 Ca 0.17 -2.30 0.09 0.00 -0.26 0.00 0.00 58.87 56.57 2wbv n SER 492 Cb 0.69 -0.54 0.17 0.00 -0.26 0.00 0.00 64.21 64.27 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 0.22 1.61 -4.45 4.33 5.12 -0.65 -1.40 116.66 121.44 2wbv n ARG 493 Ca 0.10 -2.66 -0.33 0.00 -1.93 0.00 0.00 57.85 53.03 2wbv n ARG 493 Cb 0.56 -1.57 -0.10 0.00 -1.16 0.00 0.00 32.46 30.18 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 -2.70 4.84 0.00 0.55 0.01 -1.22 -1.22 113.70 113.95 2wbv s SER 494 Ca 0.34 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2wbv s SER 494 Cb 0.30 -1.22 0.00 0.00 0.21 0.00 0.00 66.02 65.30 2wbv s SER 494 CO 0.04 0.32 0.00 2.30 0.41 0.00 0.00 173.24 176.31 2wbv n ILE 495 N 1.78 0.00 -4.41 1.44 -5.35 -0.20 -4.46 119.36 108.16 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 -0.52 -0.12 0.00 -1.74 0.00 0.00 39.64 37.79 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 -0.56 3.71 -0.13 7.28 1.01 -0.57 -0.75 116.67 126.66 2wbv s ASP 496 Ca 0.00 -0.58 0.01 0.00 0.71 0.00 0.00 52.55 52.69 2wbv s ASP 496 Cb 0.00 -0.47 0.02 0.00 1.01 0.00 0.00 42.92 43.48 2wbv s ASP 496 CO 0.00 0.19 -0.16 0.00 0.21 0.00 0.00 175.17 175.41 2wbv s MET 498 N 1.10 3.77 -0.18 0.00 1.75 0.67 -1.93 119.30 124.48 2wbv s MET 498 Ca -0.03 -0.43 -0.24 0.00 -1.25 0.00 0.00 55.69 53.74 2wbv s MET 498 Cb -0.14 -3.26 -0.02 0.00 2.84 0.00 0.00 34.83 34.25 2wbv s MET 498 CO -0.04 0.00 0.77 -1.17 -0.65 0.00 0.00 175.02 173.92 2wbv s LEU 499 N 1.10 4.16 -0.15 4.11 2.96 -0.33 -0.73 118.68 129.81 2wbv s LEU 499 Ca 0.04 1.07 -0.05 0.00 -0.22 0.00 0.00 54.13 54.97 2wbv s LEU 499 Cb -0.14 -3.13 -0.03 0.00 0.50 0.00 0.00 46.19 43.39 2wbv s LEU 499 CO 0.03 -0.36 0.02 -0.63 -1.32 0.00 0.00 176.35 174.09 2wbv s ILE 500 N 2.08 4.39 -0.23 6.68 1.01 -0.07 -1.13 121.20 133.94 2wbv s ILE 500 Ca 0.35 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.77 2wbv s ILE 500 Cb -0.16 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.36 2wbv s ILE 500 CO 0.12 0.51 -0.02 -0.63 0.00 0.00 0.00 174.94 174.92 2wbv s ILE 501 N 0.05 3.58 -1.58 2.92 1.01 0.68 -0.96 121.20 126.90 2wbv s ILE 501 Ca 0.03 -0.42 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 2wbv s ILE 501 Cb -0.13 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.71 2wbv s ILE 501 CO 0.02 0.41 0.41 0.59 0.00 0.00 0.00 174.94 176.37 2wbv n ASN 502 N 4.80 -5.94 -4.70 3.58 3.02 -0.28 -1.65 115.26 114.09 2wbv n ASN 502 Ca -0.18 -0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 53.75 2wbv n ASN 502 Cb 0.51 -4.82 -0.03 0.00 -0.61 0.00 0.00 39.78 34.83 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 -5.46 4.31 0.42 3.52 2.20 -1.26 -4.16 119.74 119.30 2wbv s LYS 503 Ca 0.20 2.02 -0.26 0.00 -0.36 0.00 0.00 55.97 57.58 2wbv s LYS 503 Cb -0.09 -3.42 -0.10 0.00 -1.51 0.00 0.00 37.83 32.71 2wbv s LYS 503 CO 0.25 -0.50 1.29 -2.30 -0.36 0.00 0.00 175.35 173.73 2wbv n PRO 504 N 4.67 1.98 -3.53 4.03 -0.02 -1.26 -4.69 135.00 136.17 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 0.43 -2.40 -0.09 0.00 -0.02 0.00 0.00 33.50 31.42 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 -2.20 0.33 5.97 -0.52 2.47 -1.26 -5.10 119.74 119.42 2wbv s LYS 505 Ca 0.60 0.82 0.00 0.00 -1.56 0.00 0.00 55.97 55.84 2wbv s LYS 505 Cb -0.51 -0.00 0.00 0.00 -1.46 0.00 0.00 37.83 35.86 2wbv s LYS 505 CO 0.58 -0.41 0.00 0.41 0.16 0.00 0.00 175.35 176.09 2wbv n GLY 506 N 5.38 3.58 0.84 5.54 0.00 -1.26 -1.87 105.19 117.40 2wbv n GLY 506 Ca -0.06 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 2.28 -1.90 1.61 0.24 -1.26 -5.02 118.33 114.28 2wbv n VAL 507 Ca 0.00 -2.04 -0.41 0.00 -2.04 0.00 0.00 64.34 59.85 2wbv n VAL 507 Cb 0.00 -0.26 -0.02 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 -2.90 3.67 0.05 2.33 0.00 -0.78 -4.92 121.76 119.21 2wbv s ALA 508 Ca 0.41 1.45 -0.10 0.00 0.00 0.00 0.00 51.96 53.73 2wbv s ALA 508 Cb 0.34 -3.60 -0.32 0.00 0.00 0.00 0.00 23.12 19.55 2wbv s ALA 508 CO 0.07 -0.87 1.06 1.15 0.00 0.00 0.00 175.76 177.17 2wbv h THR 509 N 3.40 1.38 -4.05 0.00 2.02 -1.32 -3.44 112.91 110.90 2wbv h THR 509 Ca -0.47 -2.88 -0.52 0.00 0.77 0.00 0.00 66.41 63.31 2wbv h THR 509 Cb 1.22 2.98 -0.24 0.00 -1.74 0.00 0.00 68.15 70.37 2wbv h THR 509 CO 0.77 0.85 -0.82 -0.31 0.37 0.00 0.00 175.52 176.38 2wbv s TYR 510 N -2.63 1.58 0.02 3.16 2.02 -0.78 -5.01 117.35 115.72 2wbv s TYR 510 Ca -0.07 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.25 2wbv s TYR 510 Cb 0.06 -0.92 -0.01 0.00 -0.40 0.00 0.00 41.96 40.69 2wbv s TYR 510 CO 0.91 0.10 -0.04 0.95 -1.57 0.00 0.00 175.55 175.90 2wbv s THR 511 N -0.95 0.23 -0.10 -0.71 -4.23 -1.26 -1.07 115.64 107.55 2wbv s THR 511 Ca 0.05 -0.68 0.00 0.00 -1.18 0.00 0.00 61.69 59.88 2wbv s THR 511 Cb -0.09 -0.31 0.02 0.00 1.34 0.00 0.00 72.50 73.47 2wbv s THR 511 CO 0.02 -0.29 -0.09 -0.76 -0.54 0.00 0.00 174.62 172.96 2wbv s LEU 512 N -1.02 1.36 -0.15 4.79 1.43 -0.85 -1.12 118.68 123.12 2wbv s LEU 512 Ca -0.09 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2wbv s LEU 512 Cb -0.07 -0.86 0.00 0.00 0.03 0.00 0.00 46.19 45.29 2wbv s LEU 512 CO -0.00 -0.07 -0.18 -0.89 0.23 0.00 0.00 176.35 175.43 2wbv s THR 513 N 1.38 2.41 -0.47 5.49 2.01 -0.14 -0.57 115.64 125.75 2wbv s THR 513 Ca -0.01 -0.86 -0.17 0.00 0.31 0.00 0.00 61.69 60.96 2wbv s THR 513 Cb -0.14 -1.99 0.06 0.00 0.01 0.00 0.00 72.50 70.44 2wbv s THR 513 CO -0.05 0.53 0.47 -0.36 -0.69 0.00 0.00 174.62 174.52 2wbv s PHE 514 N 0.78 3.17 -0.29 4.92 0.08 -0.20 -0.89 117.98 125.56 2wbv s PHE 514 Ca -0.07 -0.69 -0.07 0.00 0.12 0.00 0.00 56.93 56.22 2wbv s PHE 514 Cb -0.16 -3.20 -0.00 0.00 -0.57 0.00 0.00 43.02 39.10 2wbv s PHE 514 CO -0.00 -0.84 0.08 0.50 -0.10 0.00 0.00 175.22 174.86 2wbv s ARG 515 N 2.04 3.23 -0.22 0.44 3.52 0.09 -0.50 118.95 127.55 2wbv s ARG 515 Ca 0.09 -0.76 -0.16 0.00 -0.13 0.00 0.00 55.73 54.76 2wbv s ARG 515 Cb -0.21 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 2wbv s ARG 515 CO 0.10 -0.39 0.43 -0.06 -0.81 0.00 0.00 175.30 174.57 2wbv s PHE 516 N 1.53 3.34 0.09 5.12 0.08 0.01 -0.24 117.98 127.91 2wbv s PHE 516 Ca 0.04 0.61 0.00 0.00 0.12 0.00 0.00 56.93 57.70 2wbv s PHE 516 Cb -0.17 -2.59 -0.04 0.00 -0.57 0.00 0.00 43.02 39.66 2wbv s PHE 516 CO 0.03 -0.10 -0.02 -0.51 -0.10 0.00 0.00 175.22 174.51 2wbv s LEU 517 N 1.64 2.35 -1.07 -0.37 1.43 -0.46 -2.37 118.68 119.82 2wbv s LEU 517 Ca 0.20 -1.05 -0.05 0.00 -1.03 0.00 0.00 54.13 52.19 2wbv s LEU 517 Cb -0.15 0.11 0.01 0.00 0.03 0.00 0.00 46.19 46.18 2wbv s LEU 517 CO 0.09 -0.58 0.93 0.59 0.23 0.00 0.00 176.35 177.61 2wbv n ASN 518 N -0.00 -4.45 0.30 2.29 3.02 -1.26 -1.51 115.26 113.64 2wbv n ASN 518 Ca -0.11 -0.47 0.17 0.00 -0.03 0.00 0.00 54.58 54.14 2wbv n ASN 518 Cb 0.62 -4.26 0.95 0.00 -0.61 0.00 0.00 39.78 36.48 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 -2.02 0.00 0.00 3.10 0.04 -1.83 -2.45 116.94 113.78 2wbv h PHE 519 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 2wbv h PHE 519 Cb 1.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.45 2wbv h PHE 519 CO 0.39 0.03 0.00 0.27 -0.60 0.00 0.00 178.31 178.40 2wbv n ASN 520 N -3.56 0.00 0.26 2.17 6.94 -1.05 -1.48 115.26 118.54 2wbv n ASN 520 Ca -0.03 0.28 0.14 0.00 -0.02 0.00 0.00 54.58 54.95 2wbv n ASN 520 Cb 0.12 -0.37 0.60 0.00 -2.36 0.00 0.00 39.78 37.77 2wbv n ASN 520 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 2wbv h ARG 521 N 0.00 0.00 -6.84 -3.83 3.08 -1.73 -3.46 114.38 101.60 2wbv h ARG 521 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.54 2wbv h ARG 521 Cb 0.13 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.21 2wbv h ARG 521 CO 0.00 0.09 0.51 -0.51 -1.07 0.00 0.00 179.97 178.99 2wbv s LEU 522 N -6.45 4.50 0.40 3.04 1.43 -0.55 -4.69 118.68 116.36 2wbv s LEU 522 Ca 0.01 2.37 0.26 0.00 -1.03 0.00 0.00 54.13 55.74 2wbv s LEU 522 Cb 0.09 -3.67 0.75 0.00 0.03 0.00 0.00 46.19 43.40 2wbv s LEU 522 CO 0.58 -0.27 1.74 0.77 0.23 0.00 0.00 176.35 179.40 2wbv h SER 523 N 3.62 0.00 -0.51 2.29 4.64 -1.57 -3.43 113.55 118.60 2wbv h SER 523 Ca -0.47 0.00 0.05 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 0.00 0.14 0.61 -0.87 0.00 0.00 176.83 177.38 2wbv n GLY 524 N 0.77 0.61 3.66 -0.77 0.00 -1.26 -5.02 105.19 103.19 2wbv n GLY 524 Ca 0.03 -0.87 -0.46 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.15 0.92 2.93 -0.02 0.00 -1.26 -4.37 105.19 103.24 2wbv n GLY 525 Ca 0.01 0.60 -0.14 0.00 0.00 0.00 0.00 46.02 46.49 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 0.51 0.22 0.19 2.61 2.01 -0.30 -4.97 115.64 115.91 2wbv s THR 526 Ca 0.75 -0.22 -0.32 0.00 0.31 0.00 0.00 61.69 62.22 2wbv s THR 526 Cb -0.70 -0.21 -0.11 0.00 0.01 0.00 0.00 72.50 71.49 2wbv s THR 526 CO 0.43 -0.00 1.67 -0.76 -0.69 0.00 0.00 174.62 175.27 2wbv s LEU 527 N -0.24 4.37 -1.37 4.42 1.43 -1.26 -0.85 118.68 125.18 2wbv s LEU 527 Ca -0.01 2.77 -0.14 0.00 -1.03 0.00 0.00 54.13 55.72 2wbv s LEU 527 Cb -0.02 -3.60 0.08 0.00 0.03 0.00 0.00 46.19 42.69 2wbv s LEU 527 CO -0.00 -0.92 2.01 0.33 0.23 0.00 0.00 176.35 178.00 2wbv n PHE 528 N 4.10 3.72 -3.90 0.29 7.35 -0.13 -4.06 117.46 124.84 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 0.37 -2.42 -0.14 0.00 0.35 0.00 0.00 39.48 37.64 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 2.67 1.53 0.57 -4.13 2.20 -1.26 -0.61 119.74 120.72 2wbv s LYS 529 Ca 0.46 -2.08 -0.15 0.00 -0.36 0.00 0.00 55.97 53.84 2wbv s LYS 529 Cb 0.10 -2.93 -0.05 0.00 -1.51 0.00 0.00 37.83 33.44 2wbv s LYS 529 CO -0.03 -1.05 1.02 0.95 -0.36 0.00 0.00 175.35 175.88 2wbv s THR 530 N 0.43 4.22 1.10 3.43 -4.23 -0.31 -0.05 115.64 120.24 2wbv s THR 530 Ca 0.14 0.99 -0.13 0.00 -1.18 0.00 0.00 61.69 61.51 2wbv s THR 530 Cb -0.23 -3.57 0.21 0.00 1.34 0.00 0.00 72.50 70.25 2wbv s THR 530 CO -0.05 -0.68 0.77 0.47 -0.54 0.00 0.00 174.62 174.59 2wbv n ASP 531 N -2.01 -1.54 -4.67 3.99 9.92 0.06 -4.55 116.55 117.75 2wbv n ASP 531 Ca 0.07 -0.01 -0.42 0.00 -0.53 0.00 0.00 54.79 53.90 2wbv n ASP 531 Cb 0.53 -1.23 -0.03 0.00 -0.64 0.00 0.00 41.12 39.76 2wbv n ASP 531 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2wbv s VAL 532 N -2.41 3.77 -0.09 2.53 1.01 -1.26 -4.55 120.40 119.40 2wbv s VAL 532 Ca 0.65 0.99 -0.02 0.00 0.00 0.00 0.00 61.98 63.59 2wbv s VAL 532 Cb -0.22 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2wbv s VAL 532 CO 0.64 -0.07 0.01 -0.76 0.00 0.00 0.00 175.10 174.93 2wbv s LEU 533 N 3.58 3.64 -0.03 3.92 1.43 0.64 -4.95 118.68 126.90 2wbv s LEU 533 Ca 0.67 0.17 0.05 0.00 -1.03 0.00 0.00 54.13 53.98 2wbv s LEU 533 Cb -0.30 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 2wbv s LEU 533 CO 0.25 0.38 -0.17 -0.89 0.23 0.00 0.00 176.35 176.15 2wbv s THR 534 N -0.90 1.37 0.14 5.49 2.01 -1.26 -1.15 115.64 121.35 2wbv s THR 534 Ca 0.14 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.44 2wbv s THR 534 Cb -0.11 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 2wbv s THR 534 CO 0.03 0.39 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.98 2wbv s PHE 535 N -0.09 1.05 0.00 4.92 0.08 -0.53 -4.98 117.98 118.43 2wbv s PHE 535 Ca -0.00 -1.03 0.01 0.00 0.12 0.00 0.00 56.93 56.03 2wbv s PHE 535 Cb -0.10 -0.60 -0.00 0.00 -0.57 0.00 0.00 43.02 41.74 2wbv s PHE 535 CO 0.01 -0.25 -0.03 0.99 -0.10 0.00 0.00 175.22 175.85 2wbv s THR 536 N -3.72 0.21 0.16 0.64 2.01 -1.26 -0.21 115.64 113.47 2wbv s THR 536 Ca 0.20 -0.17 -0.11 0.00 0.31 0.00 0.00 61.69 61.93 2wbv s THR 536 Cb 0.06 -0.19 -0.00 0.00 0.01 0.00 0.00 72.50 72.38 2wbv s THR 536 CO 0.01 0.02 0.32 -0.72 -0.69 0.00 0.00 174.62 173.56 2wbv s TYR 537 N -0.15 0.27 -0.02 4.92 -0.85 -0.53 -5.00 117.35 115.99 2wbv s TYR 537 Ca 0.00 -0.63 -0.30 0.00 -0.52 0.00 0.00 57.07 55.61 2wbv s TYR 537 Cb -0.02 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 2wbv s TYR 537 CO -0.00 -0.73 1.28 0.08 -1.52 0.00 0.00 175.55 174.66 2wbv s VAL 538 N -3.94 4.00 0.56 -3.49 1.01 -1.26 -0.32 120.40 116.97 2wbv s VAL 538 Ca 0.14 1.36 -0.17 0.00 0.00 0.00 0.00 61.98 63.32 2wbv s VAL 538 Cb 0.03 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 2wbv s VAL 538 CO -0.02 0.01 1.04 -0.83 0.00 0.00 0.00 175.10 175.31 2wbv s GLY 539 N 1.57 2.18 0.61 4.51 0.00 0.11 -1.37 107.32 114.92 2wbv s GLY 539 Ca 0.59 0.39 -0.17 0.00 0.00 0.00 0.00 44.72 45.54 2wbv s GLY 539 CO 0.25 0.70 1.11 1.85 0.00 0.00 0.00 173.10 177.01 2wbv s GLU 540 N -3.94 3.06 0.19 2.90 2.56 0.60 -4.26 118.70 119.81 2wbv s GLU 540 Ca 0.63 1.46 -0.25 0.00 0.00 0.00 0.00 54.97 56.81 2wbv s GLU 540 Cb -0.15 -1.98 -0.08 0.00 2.00 0.00 0.00 34.13 33.92 2wbv s GLU 540 CO 0.33 -1.05 0.80 -0.80 -0.56 0.00 0.00 175.26 173.98 2wbv s ASN 541 N -2.28 7.36 0.00 -1.70 0.01 -1.26 -4.52 114.94 112.54 2wbv s ASN 541 Ca 0.69 1.66 0.00 0.00 -0.71 0.00 0.00 52.86 54.50 2wbv s ASN 541 Cb -0.21 -2.50 0.00 0.00 0.41 0.00 0.00 41.25 38.94 2wbv s ASN 541 CO 0.35 0.16 0.41 1.67 -1.51 0.00 0.00 177.10 178.18