#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j1k s PRO 362 N 0.00 2.68 -0.19 0.00 0.04 -1.26 -4.95 135.00 131.31 2j1k s PRO 362 Ca 0.00 0.74 -0.20 0.00 0.04 0.00 0.00 61.00 61.58 2j1k s PRO 362 Cb 0.00 -1.98 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2j1k s PRO 362 CO 0.00 -1.22 0.56 -1.50 0.04 0.00 0.00 177.00 174.87 2j1k s ILE 363 N -3.15 0.00 -0.12 0.56 2.07 -0.42 -5.02 121.20 115.12 2j1k s ILE 363 Ca 0.59 -0.02 0.03 0.00 -1.41 0.00 0.00 60.65 59.84 2j1k s ILE 363 Cb -0.13 -0.78 0.01 0.00 0.13 0.00 0.00 42.46 41.68 2j1k s ILE 363 CO 0.54 -0.01 -0.22 -0.89 -1.91 0.00 0.00 174.94 172.45 2j1k s THR 364 N 0.16 2.02 -0.13 4.00 2.01 -1.26 -0.31 115.64 122.13 2j1k s THR 364 Ca -0.01 -0.97 -0.05 0.00 0.31 0.00 0.00 61.69 60.98 2j1k s THR 364 Cb -0.04 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 2j1k s THR 364 CO 0.01 0.54 0.04 -0.76 -0.69 0.00 0.00 174.62 173.77 2j1k s LEU 365 N 0.65 3.78 0.29 4.42 1.43 0.15 -0.97 118.68 128.42 2j1k s LEU 365 Ca -0.11 0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 52.95 2j1k s LEU 365 Cb -0.16 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2j1k s LEU 365 CO 0.02 0.31 0.71 -1.66 0.23 0.00 0.00 176.35 175.96 2j1k s TRP 366 N -0.46 -0.13 -0.93 0.29 1.48 0.36 0.41 118.94 119.97 2j1k s TRP 366 Ca 0.09 -0.34 0.27 0.00 -1.06 0.00 0.00 56.10 55.06 2j1k s TRP 366 Cb -0.12 0.68 0.88 0.00 -1.16 0.00 0.00 33.47 33.76 2j1k s TRP 366 CO 0.02 -1.25 1.70 0.25 -4.06 0.00 0.00 176.95 173.61 2j1k n THR 367 N -0.46 0.11 0.00 0.66 -2.24 -0.61 -1.98 114.28 109.76 2j1k n THR 367 Ca -0.04 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2j1k n THR 367 Cb 0.59 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 2j1k n THR 367 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j1k n GLY 368 N 1.46 -1.42 3.84 3.38 0.00 -1.26 -4.67 105.19 106.51 2j1k n GLY 368 Ca 0.06 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 2j1k n GLY 368 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j1k s PRO 369 N -2.13 2.35 -1.16 1.61 0.04 -1.26 -4.08 135.00 130.36 2j1k s PRO 369 Ca 0.00 0.53 -0.14 0.00 0.04 0.00 0.00 61.00 61.43 2j1k s PRO 369 Cb 0.00 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2j1k s PRO 369 CO 0.00 -1.41 0.78 0.41 0.04 0.00 0.00 177.00 176.82 2j1k n GLY 370 N -2.52 -0.88 3.73 0.56 0.00 -1.26 -4.89 105.19 99.94 2j1k n GLY 370 Ca 0.07 0.41 -0.33 0.00 0.00 0.00 0.00 46.02 46.17 2j1k n GLY 370 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j1k s PRO 371 N -5.77 2.17 0.84 1.61 0.04 -1.26 -5.03 135.00 127.61 2j1k s PRO 371 Ca 0.38 1.56 -0.13 0.00 0.04 0.00 0.00 61.00 62.85 2j1k s PRO 371 Cb -0.12 -1.86 0.10 0.00 0.04 0.00 0.00 34.50 32.67 2j1k s PRO 371 CO 0.84 -1.77 1.20 -1.54 0.04 0.00 0.00 177.00 175.77 2j1k s SER 372 N -2.43 4.23 -0.58 6.66 1.04 -1.26 -4.86 113.70 116.49 2j1k s SER 372 Ca 0.70 0.71 -0.28 0.00 0.48 0.00 0.00 55.95 57.55 2j1k s SER 372 Cb -0.24 -1.13 0.02 0.00 0.10 0.00 0.00 66.02 64.77 2j1k s SER 372 CO 0.47 -2.07 1.34 -0.63 0.98 0.00 0.00 173.24 173.33 2j1k s ILE 373 N -3.62 3.84 0.00 -1.02 1.01 -1.26 -3.91 121.20 116.25 2j1k s ILE 373 Ca 0.64 0.71 0.00 0.00 0.00 0.00 0.00 60.65 62.00 2j1k s ILE 373 Cb -0.10 -4.57 0.00 0.00 0.01 0.00 0.00 42.46 37.80 2j1k s ILE 373 CO 0.50 -1.29 0.36 -0.46 0.00 0.00 0.00 174.94 174.05 2j1k n ASN 374 N 9.25 0.63 -4.30 3.58 0.23 -0.70 -4.81 115.26 119.15 2j1k n ASN 374 Ca 0.10 -1.10 -0.39 0.00 -0.53 0.00 0.00 54.58 52.66 2j1k n ASN 374 Cb 0.49 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.08 2j1k n ASN 374 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 2j1k s GLY 375 N -0.10 1.92 0.11 4.83 0.00 0.03 -4.19 107.32 109.91 2j1k s GLY 375 Ca 0.00 -1.91 -0.30 0.00 0.00 0.00 0.00 44.72 42.51 2j1k s GLY 375 CO 0.00 0.87 0.99 -1.36 0.00 0.00 0.00 173.10 173.60 2j1k s PHE 376 N 1.45 3.77 -0.15 1.90 0.08 0.81 -1.45 117.98 124.39 2j1k s PHE 376 Ca 0.01 1.76 0.00 0.00 0.12 0.00 0.00 56.93 58.82 2j1k s PHE 376 Cb -0.21 -3.10 0.02 0.00 -0.57 0.00 0.00 43.02 39.17 2j1k s PHE 376 CO 0.03 0.06 -0.12 0.42 -0.10 0.00 0.00 175.22 175.51 2j1k s ILE 377 N 0.08 1.46 -1.36 0.64 1.01 -0.08 -4.82 121.20 118.13 2j1k s ILE 377 Ca 0.48 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 2j1k s ILE 377 Cb -0.24 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 40.84 2j1k s ILE 377 CO 0.30 0.42 0.66 0.59 0.00 0.00 0.00 174.94 176.90 2j1k n ASN 378 N 4.80 -1.29 -0.35 3.58 3.02 -1.26 -2.68 115.26 121.08 2j1k n ASN 378 Ca -0.16 -0.86 -0.05 0.00 -0.03 0.00 0.00 54.58 53.48 2j1k n ASN 378 Cb 0.50 -3.78 -0.02 0.00 -0.61 0.00 0.00 39.78 35.87 2j1k n ASN 378 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2j1k n ASP 379 N -3.01 -4.32 -4.06 6.41 8.00 -1.26 -5.00 116.55 113.30 2j1k n ASP 379 Ca -0.27 0.11 -0.24 0.00 0.71 0.00 0.00 54.79 55.10 2j1k n ASP 379 Cb 0.66 -2.23 -0.16 0.00 -0.02 0.00 0.00 41.12 39.38 2j1k n ASP 379 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2j1k s THR 380 N -1.91 1.18 -0.27 -3.53 2.01 -1.09 -5.10 115.64 106.93 2j1k s THR 380 Ca 0.00 -0.54 -0.29 0.00 0.31 0.00 0.00 61.69 61.17 2j1k s THR 380 Cb 0.00 -1.05 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 2j1k s THR 380 CO 0.00 0.36 1.35 -2.16 -0.69 0.00 0.00 174.62 173.48 2j1k s PRO 381 N 0.38 3.93 0.00 4.92 0.04 -1.26 -0.90 135.00 142.10 2j1k s PRO 381 Ca -0.09 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.31 2j1k s PRO 381 Cb -0.13 -3.89 0.00 0.00 0.04 0.00 0.00 34.50 30.51 2j1k s PRO 381 CO 0.03 -1.11 0.00 1.33 0.04 0.00 0.00 177.00 177.29 2j1k n VAL 382 N 6.15 0.00 -4.06 -0.36 0.24 -0.53 -4.90 118.33 114.88 2j1k n VAL 382 Ca 0.15 0.00 -0.35 0.00 -2.04 0.00 0.00 64.34 62.10 2j1k n VAL 382 Cb 0.46 -0.14 -0.09 0.00 -1.47 0.00 0.00 33.84 32.60 2j1k n VAL 382 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2j1k s ILE 383 N -1.30 4.83 -0.43 1.34 -1.09 -0.84 -0.97 121.20 122.73 2j1k s ILE 383 Ca 0.00 -0.03 -0.17 0.00 -2.23 0.00 0.00 60.65 58.22 2j1k s ILE 383 Cb 0.00 -3.13 0.03 0.00 -1.58 0.00 0.00 42.46 37.78 2j1k s ILE 383 CO 0.00 0.52 0.41 -0.60 -1.23 0.00 0.00 174.94 174.04 2j1k s ARG 384 N -0.16 3.05 -0.23 2.79 3.52 0.27 -0.79 118.95 127.39 2j1k s ARG 384 Ca 0.07 -0.91 -0.04 0.00 -0.13 0.00 0.00 55.73 54.72 2j1k s ARG 384 Cb -0.12 -4.00 -0.01 0.00 -1.56 0.00 0.00 34.95 29.26 2j1k s ARG 384 CO 0.01 -0.87 -0.02 0.00 -0.81 0.00 0.00 175.30 173.61 2j1k s PHE 386 N 1.50 3.26 -0.04 0.00 5.36 0.49 -4.79 117.98 123.76 2j1k s PHE 386 Ca 0.06 0.78 0.02 0.00 -0.96 0.00 0.00 56.93 56.83 2j1k s PHE 386 Cb -0.14 -2.91 0.01 0.00 -0.34 0.00 0.00 43.02 39.64 2j1k s PHE 386 CO -0.02 -0.38 -0.08 0.42 -1.46 0.00 0.00 175.22 173.70 2j1k s ILE 387 N 2.57 0.77 -0.09 3.12 1.01 -1.26 -1.29 121.20 126.04 2j1k s ILE 387 Ca 0.27 -0.31 -0.01 0.00 0.00 0.00 0.00 60.65 60.59 2j1k s ILE 387 Cb -0.15 -0.71 0.03 0.00 0.01 0.00 0.00 42.46 41.64 2j1k s ILE 387 CO 0.09 0.26 -0.01 0.00 0.00 0.00 0.00 174.94 175.28 2j1k s LEU 389 N 1.91 4.89 -0.28 0.00 1.43 0.17 -1.23 118.68 125.57 2j1k s LEU 389 Ca 0.05 -1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 51.74 2j1k s LEU 389 Cb -0.13 -1.97 -0.00 0.00 0.03 0.00 0.00 46.19 44.12 2j1k s LEU 389 CO -0.06 -0.46 0.07 -0.89 0.23 0.00 0.00 176.35 175.24 2j1k s THR 390 N 1.44 4.04 -0.26 5.49 2.01 -0.33 -0.67 115.64 127.35 2j1k s THR 390 Ca 0.02 -0.51 -0.11 0.00 0.31 0.00 0.00 61.69 61.40 2j1k s THR 390 Cb -0.21 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.25 2j1k s THR 390 CO 0.03 0.19 0.17 -0.60 -0.69 0.00 0.00 174.62 173.72 2j1k s ARG 391 N 1.54 4.00 0.00 4.92 6.06 0.57 -0.53 118.95 135.51 2j1k s ARG 391 Ca 0.04 -0.30 0.00 0.00 -2.50 0.00 0.00 55.73 52.97 2j1k s ARG 391 Cb -0.16 -3.60 0.00 0.00 0.06 0.00 0.00 34.95 31.25 2j1k s ARG 391 CO 0.02 -0.07 0.00 -0.25 -2.50 0.00 0.00 175.30 172.51 2j1k n ASP 392 N 4.69 0.00 -0.05 -2.12 8.00 -0.93 -1.30 116.55 124.84 2j1k n ASP 392 Ca -0.15 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.25 2j1k n ASP 392 Cb 0.52 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 2j1k n ASP 392 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2j1k h SER 393 N 0.00 0.25 0.00 -2.24 4.64 -1.97 -3.43 113.55 110.80 2j1k h SER 393 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2j1k h SER 393 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2j1k h SER 393 CO 0.00 0.32 -0.43 -3.20 -0.87 0.00 0.00 176.83 172.65 2j1k n ASN 394 N -4.86 1.01 -4.91 4.97 5.15 -1.26 -5.04 115.26 110.33 2j1k n ASN 394 Ca -0.04 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.64 2j1k n ASN 394 Cb 0.11 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.31 2j1k n ASN 394 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2j1k s LEU 395 N -4.49 4.25 -0.23 1.20 1.43 -1.26 -0.87 118.68 118.70 2j1k s LEU 395 Ca 0.00 0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 53.54 2j1k s LEU 395 Cb 0.00 -3.27 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 2j1k s LEU 395 CO 0.00 0.02 0.12 -0.69 0.23 0.00 0.00 176.35 176.02 2j1k s VAL 396 N -1.73 4.95 -0.15 -1.59 1.01 -0.06 -2.20 120.40 120.62 2j1k s VAL 396 Ca 0.40 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 62.24 2j1k s VAL 396 Cb -0.12 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2j1k s VAL 396 CO 0.26 0.36 0.49 -0.89 0.00 0.00 0.00 175.10 175.33 2j1k s THR 397 N 1.08 5.16 -0.21 3.92 2.01 0.31 -1.90 115.64 126.01 2j1k s THR 397 Ca 0.06 0.95 -0.16 0.00 0.31 0.00 0.00 61.69 62.85 2j1k s THR 397 Cb -0.14 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 2j1k s THR 397 CO 0.04 0.27 0.38 -0.69 -0.69 0.00 0.00 174.62 173.93 2j1k s VAL 398 N 1.04 5.20 -0.15 3.82 1.01 0.82 -1.19 120.40 130.96 2j1k s VAL 398 Ca 0.25 0.67 -0.00 0.00 0.00 0.00 0.00 61.98 62.90 2j1k s VAL 398 Cb -0.15 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.54 2j1k s VAL 398 CO 0.10 0.25 -0.09 0.21 0.00 0.00 0.00 175.10 175.57 2j1k s ASN 399 N 1.09 2.64 0.03 3.32 3.84 -0.37 -1.13 114.94 124.36 2j1k s ASN 399 Ca 0.18 -0.52 -0.09 0.00 0.21 0.00 0.00 52.86 52.63 2j1k s ASN 399 Cb -0.15 -0.98 0.00 0.00 -0.55 0.00 0.00 41.25 39.57 2j1k s ASN 399 CO 0.08 -0.13 0.19 0.00 -2.79 0.00 0.00 177.10 174.45 2j1k s ALA 400 N 1.60 -0.38 0.04 1.71 0.00 -0.14 -0.81 121.76 123.78 2j1k s ALA 400 Ca 0.03 -0.22 -0.19 0.00 0.00 0.00 0.00 51.96 51.58 2j1k s ALA 400 Cb -0.14 0.23 0.04 0.00 0.00 0.00 0.00 23.12 23.25 2j1k s ALA 400 CO -0.09 -0.32 0.44 -1.54 0.00 0.00 0.00 175.76 174.25 2j1k s SER 401 N -1.89 -0.33 -0.01 0.00 1.04 -0.41 0.09 113.70 112.19 2j1k s SER 401 Ca -0.08 0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.43 2j1k s SER 401 Cb -0.03 0.44 0.01 0.00 0.10 0.00 0.00 66.02 66.54 2j1k s SER 401 CO -0.02 -0.67 -0.03 -0.36 0.98 0.00 0.00 173.24 173.14 2j1k s PHE 402 N -2.39 0.35 -0.16 5.02 0.08 -1.26 -0.38 117.98 119.24 2j1k s PHE 402 Ca -0.06 -0.06 0.00 0.00 0.12 0.00 0.00 56.93 56.94 2j1k s PHE 402 Cb -0.01 -0.29 0.03 0.00 -0.57 0.00 0.00 43.02 42.18 2j1k s PHE 402 CO -0.02 -0.05 -0.11 0.08 -0.10 0.00 0.00 175.22 175.03 2j1k s VAL 403 N 0.24 1.47 0.40 -0.44 1.01 -0.26 -0.97 120.40 121.85 2j1k s VAL 403 Ca -0.02 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 2j1k s VAL 403 Cb -0.05 -1.48 -0.08 0.00 0.00 0.00 0.00 36.38 34.76 2j1k s VAL 403 CO -0.00 0.30 1.20 -0.83 0.00 0.00 0.00 175.10 175.77 2j1k s GLY 404 N 1.50 2.88 0.09 4.51 0.00 -0.18 -0.57 107.32 115.57 2j1k s GLY 404 Ca 0.02 1.03 0.04 0.00 0.00 0.00 0.00 44.72 45.81 2j1k s GLY 404 CO -0.09 1.57 -0.10 -0.54 0.00 0.00 0.00 173.10 173.93 2j1k s GLU 405 N -2.28 0.84 7.79 2.90 0.41 -0.14 -3.77 118.70 124.45 2j1k s GLU 405 Ca 0.57 -1.13 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 2j1k s GLU 405 Cb -0.33 -0.55 0.00 0.00 -1.78 0.00 0.00 34.13 31.48 2j1k s GLU 405 CO 0.41 0.09 0.00 0.41 -0.49 0.00 0.00 175.26 175.68 2j1k n GLY 406 N 0.63 3.43 0.00 -1.39 0.00 -1.26 -2.06 105.19 104.54 2j1k n GLY 406 Ca -0.17 -0.11 0.05 0.00 0.00 0.00 0.00 46.02 45.79 2j1k n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j1k n GLY 407 N 0.00 -0.66 0.68 -0.02 0.00 -1.26 -2.30 105.19 101.64 2j1k n GLY 407 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.04 2j1k n GLY 407 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j1k n TYR 408 N -1.35 0.39 -0.29 1.61 4.01 -0.87 -4.62 117.16 116.03 2j1k n TYR 408 Ca 0.04 -0.36 -0.05 0.00 -0.16 0.00 0.00 57.90 57.37 2j1k n TYR 408 Cb 0.08 -0.02 0.08 0.00 -0.31 0.00 0.00 39.34 39.18 2j1k n TYR 408 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2j1k h ARG 409 N 2.43 1.19 -5.07 -0.72 2.43 -1.55 -3.35 114.38 109.74 2j1k h ARG 409 Ca 0.00 -0.19 -0.63 0.00 -0.81 0.00 0.00 59.98 58.34 2j1k h ARG 409 Cb 0.71 -0.20 -0.34 0.00 -0.42 0.00 0.00 29.97 29.72 2j1k h ARG 409 CO 0.00 0.94 -0.86 0.42 -1.51 0.00 0.00 179.97 178.96 2j1k s ILE 410 N -5.61 1.80 0.06 1.20 1.01 -1.26 -0.95 121.20 117.45 2j1k s ILE 410 Ca -0.12 -0.85 0.05 0.00 0.00 0.00 0.00 60.65 59.73 2j1k s ILE 410 Cb 0.16 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 2j1k s ILE 410 CO 0.83 0.50 -0.07 0.68 0.00 0.00 0.00 174.94 176.89 2j1k s VAL 411 N 0.62 3.59 0.36 2.92 -7.23 0.92 -4.89 120.40 116.70 2j1k s VAL 411 Ca -0.13 -1.01 0.08 0.00 -1.81 0.00 0.00 61.98 59.10 2j1k s VAL 411 Cb -0.17 -2.63 -0.04 0.00 0.56 0.00 0.00 36.38 34.10 2j1k s VAL 411 CO 0.04 0.24 0.21 -0.94 -0.31 0.00 0.00 175.10 174.33 2j1k s SER 412 N -1.88 4.79 0.22 4.85 1.04 -1.26 0.17 113.70 121.63 2j1k s SER 412 Ca 0.20 -0.78 0.16 0.00 0.48 0.00 0.00 55.95 56.01 2j1k s SER 412 Cb -0.11 -0.70 0.83 0.00 0.10 0.00 0.00 66.02 66.14 2j1k s SER 412 CO 0.12 -0.40 1.48 -2.65 0.98 0.00 0.00 173.24 172.77 2j1k n PRO 413 N -1.26 0.10 -0.23 4.02 -0.02 -1.26 -1.55 135.00 134.81 2j1k n PRO 413 Ca -0.01 0.58 0.11 0.00 -2.02 0.00 0.00 63.50 62.15 2j1k n PRO 413 Cb 0.62 -1.82 0.26 0.00 -0.02 0.00 0.00 33.50 32.54 2j1k n PRO 413 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2j1k n THR 414 N -2.03 0.60 -1.87 3.45 -2.24 -1.26 -2.84 114.28 108.08 2j1k n THR 414 Ca -0.01 -0.75 -0.41 0.00 -2.27 0.00 0.00 64.05 60.61 2j1k n THR 414 Cb 0.04 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 68.97 2j1k n THR 414 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2j1k s GLN 415 N -1.40 4.18 0.22 -0.78 2.00 -0.59 -4.96 119.66 118.33 2j1k s GLN 415 Ca 0.40 2.47 -0.30 0.00 -2.00 0.00 0.00 55.36 55.93 2j1k s GLN 415 Cb 0.22 -3.04 -0.09 0.00 0.80 0.00 0.00 33.01 30.91 2j1k s GLN 415 CO 0.30 -0.52 0.97 -1.12 -0.50 0.00 0.00 175.29 174.42 2j1k s SER 416 N 0.24 7.57 0.60 6.67 0.01 -1.26 -4.64 113.70 122.89 2j1k s SER 416 Ca 0.59 1.97 -0.17 0.00 1.31 0.00 0.00 55.95 59.64 2j1k s SER 416 Cb -0.45 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.14 2j1k s SER 416 CO 0.50 0.08 1.13 -1.10 0.41 0.00 0.00 173.24 174.26 2j1k s GLN 417 N -1.01 3.08 0.09 12.44 -0.21 -1.26 -5.04 119.66 127.74 2j1k s GLN 417 Ca 0.43 1.54 -0.15 0.00 0.02 0.00 0.00 55.36 57.20 2j1k s GLN 417 Cb -0.26 -1.97 0.03 0.00 1.00 0.00 0.00 33.01 31.80 2j1k s GLN 417 CO 0.33 -1.06 0.35 -0.59 -2.12 0.00 0.00 175.29 172.20 2j1k s PHE 418 N -2.00 -0.14 -0.06 0.91 -0.12 -1.11 -5.01 117.98 110.45 2j1k s PHE 418 Ca 0.71 -0.11 0.02 0.00 -0.05 0.00 0.00 56.93 57.50 2j1k s PHE 418 Cb -0.23 0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.30 2j1k s PHE 418 CO 0.34 -0.61 -0.11 -1.12 -0.05 0.00 0.00 175.22 173.66 2j1k s SER 419 N -2.52 4.27 -0.40 1.98 0.01 -1.26 -0.50 113.70 115.29 2j1k s SER 419 Ca 0.00 -0.14 -0.06 0.00 1.31 0.00 0.00 55.95 57.06 2j1k s SER 419 Cb 0.01 -1.03 0.08 0.00 0.21 0.00 0.00 66.02 65.30 2j1k s SER 419 CO -0.08 0.34 0.20 -0.76 0.41 0.00 0.00 173.24 173.35 2j1k s LEU 420 N -0.68 4.97 -0.16 2.44 1.43 0.29 -4.96 118.68 122.01 2j1k s LEU 420 Ca 0.10 -1.59 -0.15 0.00 -1.03 0.00 0.00 54.13 51.45 2j1k s LEU 420 Cb -0.11 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2j1k s LEU 420 CO 0.01 -0.49 0.37 -0.63 0.23 0.00 0.00 176.35 175.84 2j1k s ILE 421 N 1.33 5.25 -0.27 -0.59 1.01 -1.26 -1.57 121.20 125.09 2j1k s ILE 421 Ca 0.03 0.69 -0.11 0.00 0.00 0.00 0.00 60.65 61.27 2j1k s ILE 421 Cb -0.22 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 2j1k s ILE 421 CO 0.00 0.33 0.18 -0.04 0.00 0.00 0.00 174.94 175.41 2j1k s MET 422 N 0.77 3.93 -0.16 2.79 -1.94 0.11 -0.52 119.30 124.27 2j1k s MET 422 Ca 0.20 -0.33 -0.07 0.00 -1.71 0.00 0.00 55.69 53.77 2j1k s MET 422 Cb -0.14 -3.62 -0.04 0.00 2.01 0.00 0.00 34.83 33.04 2j1k s MET 422 CO 0.07 -0.17 0.07 -1.21 -0.01 0.00 0.00 175.02 173.77 2j1k s GLU 423 N 1.70 3.78 0.07 2.03 2.02 -1.26 -1.49 118.70 125.56 2j1k s GLU 423 Ca 0.07 -0.30 0.08 0.00 0.02 0.00 0.00 54.97 54.84 2j1k s GLU 423 Cb -0.16 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 30.87 2j1k s GLU 423 CO 0.10 0.42 -0.23 -0.06 0.02 0.00 0.00 175.26 175.51 2j1k s PHE 424 N -0.03 1.96 0.68 1.61 0.08 0.60 -0.56 117.98 122.31 2j1k s PHE 424 Ca 0.07 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.62 2j1k s PHE 424 Cb -0.12 -1.13 0.16 0.00 -0.57 0.00 0.00 43.02 41.36 2j1k s PHE 424 CO 0.01 0.16 0.93 -0.40 -0.10 0.00 0.00 175.22 175.82 2j1k n ASP 425 N 1.50 0.14 0.07 1.36 5.68 0.04 -2.01 116.55 123.34 2j1k n ASP 425 Ca -0.18 -1.38 0.09 0.00 -0.50 0.00 0.00 54.79 52.82 2j1k n ASP 425 Cb 0.53 -0.70 0.38 0.00 -1.14 0.00 0.00 41.12 40.19 2j1k n ASP 425 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2j1k n GLN 426 N -2.95 0.10 -0.22 0.11 10.64 -1.26 -1.45 117.38 122.35 2j1k n GLN 426 Ca 0.12 0.40 0.12 0.00 -1.83 0.00 0.00 57.00 55.80 2j1k n GLN 426 Cb 0.41 -1.71 0.23 0.00 -0.86 0.00 0.00 30.24 28.32 2j1k n GLN 426 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2j1k n PHE 427 N -1.89 0.57 -1.03 2.61 3.72 -1.26 -4.95 117.46 115.23 2j1k n PHE 427 Ca 0.02 -0.29 -0.01 0.00 -0.05 0.00 0.00 57.45 57.12 2j1k n PHE 427 Cb 0.16 -0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.69 2j1k n PHE 427 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2j1k n GLY 428 N 1.52 0.46 3.71 1.37 0.00 -0.53 -3.59 105.19 108.13 2j1k n GLY 428 Ca 0.20 -1.04 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 2j1k n GLY 428 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j1k s GLN 429 N -2.07 4.27 0.23 1.61 -0.21 -1.26 -4.71 119.66 117.52 2j1k s GLN 429 Ca 0.00 0.27 -0.32 0.00 0.02 0.00 0.00 55.36 55.33 2j1k s GLN 429 Cb 0.00 -3.46 -0.13 0.00 1.00 0.00 0.00 33.01 30.42 2j1k s GLN 429 CO 0.00 0.12 1.58 -0.11 -2.12 0.00 0.00 175.29 174.76 2j1k n LEU 430 N 3.89 3.70 -4.98 2.90 7.94 -1.26 -0.78 117.00 128.40 2j1k n LEU 430 Ca -0.09 1.11 -0.20 0.00 -1.11 0.00 0.00 56.01 55.73 2j1k n LEU 430 Cb 0.51 -1.51 0.02 0.00 0.53 0.00 0.00 43.42 42.97 2j1k n LEU 430 CO 0.41 -0.09 0.27 -0.04 -1.11 0.00 0.00 177.39 176.84 2j1k s MET 431 N 0.21 2.71 0.00 1.96 -1.94 0.27 -4.51 119.30 118.00 2j1k s MET 431 Ca 0.71 -0.92 0.30 0.00 -1.71 0.00 0.00 55.69 54.06 2j1k s MET 431 Cb -0.57 -2.60 1.38 0.00 2.01 0.00 0.00 34.83 35.05 2j1k s MET 431 CO 0.43 -0.49 1.98 -1.13 -0.01 0.00 0.00 175.02 175.79 2j1k n SER 432 N -2.12 0.06 0.07 3.03 3.41 -1.26 -1.53 113.62 115.28 2j1k n SER 432 Ca 0.07 -0.01 0.11 0.00 -0.26 0.00 0.00 58.87 58.78 2j1k n SER 432 Cb 0.59 -0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 2j1k n SER 432 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2j1k n THR 433 N -1.32 0.44 -1.72 6.66 -2.24 -1.26 -4.68 114.28 110.16 2j1k n THR 433 Ca 0.12 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 61.10 2j1k n THR 433 Cb 0.28 -0.21 0.18 0.00 -2.10 0.00 0.00 70.33 68.47 2j1k n THR 433 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2j1k s GLY 434 N -4.30 1.70 0.40 3.38 0.00 -1.26 -4.97 107.32 102.26 2j1k s GLY 434 Ca -0.01 -1.01 0.21 0.00 0.00 0.00 0.00 44.72 43.90 2j1k s GLY 434 CO 0.81 -0.28 1.77 3.43 0.00 0.00 0.00 173.10 178.83 2j1k h ASN 435 N -1.74 0.00 -3.20 1.64 4.21 -1.12 -3.38 115.58 111.99 2j1k h ASN 435 Ca -0.45 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.39 2j1k h ASN 435 Cb 1.27 0.00 -0.34 0.00 -1.12 0.00 0.00 38.32 38.13 2j1k h ASN 435 CO 0.43 0.32 -0.83 -0.63 -1.29 0.00 0.00 177.43 175.44 2j1k s ILE 436 N -3.63 2.34 0.35 2.81 1.01 -0.94 -0.13 121.20 123.01 2j1k s ILE 436 Ca 0.00 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.74 2j1k s ILE 436 Cb 0.11 -2.04 -0.00 0.00 0.01 0.00 0.00 42.46 40.53 2j1k s ILE 436 CO 0.67 0.46 0.43 0.54 0.00 0.00 0.00 174.94 177.04 2j1k s ASN 437 N 1.31 1.20 0.00 3.58 2.20 -1.26 -4.33 114.94 117.64 2j1k s ASN 437 Ca 0.04 -1.59 0.19 0.00 -0.94 0.00 0.00 52.86 50.56 2j1k s ASN 437 Cb -0.14 0.65 1.10 0.00 -2.00 0.00 0.00 41.25 40.85 2j1k s ASN 437 CO -0.10 -1.26 1.54 -1.54 -2.94 0.00 0.00 177.10 172.80 2j1k n SER 438 N -1.53 0.00 0.00 3.54 3.41 -0.58 -1.74 113.62 116.71 2j1k n SER 438 Ca 0.03 -0.48 0.14 0.00 -0.26 0.00 0.00 58.87 58.30 2j1k n SER 438 Cb 0.62 -0.05 0.65 0.00 -0.26 0.00 0.00 64.21 65.16 2j1k n SER 438 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2j1k n THR 439 N -1.05 0.10 -4.11 6.66 -2.24 -1.26 -4.83 114.28 107.54 2j1k n THR 439 Ca 0.13 0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.68 2j1k n THR 439 Cb 0.08 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 67.70 2j1k n THR 439 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2j1k s THR 440 N -2.78 4.32 -0.11 4.28 -1.32 -0.71 -5.07 115.64 114.25 2j1k s THR 440 Ca 0.20 -1.18 -0.34 0.00 -1.21 0.00 0.00 61.69 59.15 2j1k s THR 440 Cb 0.18 -3.21 -0.12 0.00 -1.51 0.00 0.00 72.50 67.84 2j1k s THR 440 CO 0.46 -0.13 1.89 0.41 -2.21 0.00 0.00 174.62 175.04 2j1k n THR 441 N -0.38 0.57 -3.64 5.08 -1.04 -1.26 -4.94 114.28 108.67 2j1k n THR 441 Ca -0.08 -0.11 -0.10 0.00 -2.04 0.00 0.00 64.05 61.72 2j1k n THR 441 Cb 0.55 -1.85 -0.07 0.00 -1.82 0.00 0.00 70.33 67.14 2j1k n THR 441 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 2j1k s TRP 442 N 4.18 -0.73 -3.14 -1.42 -0.11 -1.26 -4.46 118.94 112.00 2j1k s TRP 442 Ca 0.94 1.66 0.00 0.00 1.22 0.00 0.00 56.10 59.91 2j1k s TRP 442 Cb -0.71 0.38 0.00 0.00 -1.50 0.00 0.00 33.47 31.64 2j1k s TRP 442 CO 0.52 -0.36 0.00 0.41 -4.62 0.00 0.00 176.95 172.91 2j1k n GLY 443 N 3.03 -0.90 3.76 5.86 0.00 -0.84 -4.47 105.19 111.63 2j1k n GLY 443 Ca -0.15 -0.99 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 2j1k n GLY 443 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j1k s GLU 444 N -1.25 4.71 -0.35 1.61 2.12 0.23 -0.49 118.70 125.28 2j1k s GLU 444 Ca 0.00 1.32 -0.18 0.00 0.36 0.00 0.00 54.97 56.48 2j1k s GLU 444 Cb 0.00 -3.27 -0.00 0.00 0.26 0.00 0.00 34.13 31.11 2j1k s GLU 444 CO 0.00 0.54 0.50 0.21 -0.54 0.00 0.00 175.26 175.97 2j1k s LYS 445 N -1.14 3.61 0.47 4.30 2.20 -0.14 -0.28 119.74 128.76 2j1k s LYS 445 Ca 0.38 -0.19 -0.23 0.00 -0.36 0.00 0.00 55.97 55.58 2j1k s LYS 445 Cb -0.25 -3.81 -0.07 0.00 -1.51 0.00 0.00 37.83 32.20 2j1k s LYS 445 CO 0.29 -0.63 1.23 -2.14 -0.36 0.00 0.00 175.35 173.74 2j1k s PRO 446 N 2.35 3.62 0.03 4.03 0.02 -1.26 -4.54 135.00 139.26 2j1k s PRO 446 Ca 0.18 1.94 -0.32 0.00 0.02 0.00 0.00 61.00 62.82 2j1k s PRO 446 Cb -0.16 -2.41 -0.10 0.00 0.02 0.00 0.00 34.50 31.85 2j1k s PRO 446 CO 0.13 -0.71 1.90 1.87 -0.33 0.00 0.00 177.00 179.86 2j1k n TRP 447 N -0.55 2.49 0.00 6.54 -0.00 -1.26 -3.13 117.44 121.53 2j1k n TRP 447 Ca 0.08 -0.20 0.00 0.00 -0.00 0.00 0.00 57.50 57.38 2j1k n TRP 447 Cb 0.47 -2.74 0.00 0.00 -0.00 0.00 0.00 31.31 29.04 2j1k n TRP 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2j1k n GLY 448 N 4.38 0.52 3.58 5.87 0.00 -1.26 -5.06 105.19 113.22 2j1k n GLY 448 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 2j1k n GLY 448 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j1k s ASN 449 N -2.76 -0.06 -0.30 1.61 2.20 -1.18 -5.06 114.94 109.38 2j1k s ASN 449 Ca 0.00 -0.95 0.11 0.00 -0.94 0.00 0.00 52.86 51.08 2j1k s ASN 449 Cb 0.00 0.59 0.76 0.00 -2.00 0.00 0.00 41.25 40.60 2j1k s ASN 449 CO 0.00 -1.15 1.78 0.59 -2.94 0.00 0.00 177.10 175.39 2j1k n ASN 450 N -0.42 5.02 -4.80 3.54 3.02 -1.26 -4.37 115.26 115.98 2j1k n ASN 450 Ca -0.02 -3.16 -0.31 0.00 -0.03 0.00 0.00 54.58 51.07 2j1k n ASN 450 Cb 0.62 -0.73 0.07 0.00 -0.61 0.00 0.00 39.78 39.13 2j1k n ASN 450 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2j1k s THR 451 N -2.95 3.70 -0.34 3.41 -4.23 -1.26 -4.60 115.64 109.37 2j1k s THR 451 Ca 0.55 0.55 -0.03 0.00 -1.18 0.00 0.00 61.69 61.57 2j1k s THR 451 Cb 0.43 -3.22 0.06 0.00 1.34 0.00 0.00 72.50 71.12 2j1k s THR 451 CO 0.14 -0.72 0.08 -0.69 -0.54 0.00 0.00 174.62 172.89 2j1k s VAL 452 N -3.02 3.30 -0.48 2.29 1.01 -1.26 -4.34 120.40 117.89 2j1k s VAL 452 Ca 0.59 -1.46 -0.21 0.00 0.00 0.00 0.00 61.98 60.90 2j1k s VAL 452 Cb -0.15 -2.97 0.04 0.00 0.00 0.00 0.00 36.38 33.30 2j1k s VAL 452 CO 0.55 -0.26 0.71 -1.10 0.00 0.00 0.00 175.10 175.00 2j1k s GLN 453 N 1.27 3.25 0.07 2.72 -1.52 0.61 -4.82 119.66 121.24 2j1k s GLN 453 Ca -0.01 -0.48 0.27 0.00 -1.95 0.00 0.00 55.36 53.19 2j1k s GLN 453 Cb -0.20 -4.02 0.89 0.00 -0.22 0.00 0.00 33.01 29.46 2j1k s GLN 453 CO -0.01 -1.18 1.73 -0.35 -0.25 0.00 0.00 175.29 175.23 2j1k n PRO 454 N 6.53 0.10 -1.76 2.91 -0.04 -1.26 -0.60 135.00 140.88 2j1k n PRO 454 Ca -0.02 0.07 -0.42 0.00 -0.04 0.00 0.00 63.50 63.08 2j1k n PRO 454 Cb 0.47 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 2j1k n PRO 454 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2j1k s ARG 455 N -3.05 3.94 0.71 0.54 3.52 -1.26 -4.94 118.95 118.42 2j1k s ARG 455 Ca 0.12 2.35 -0.15 0.00 -0.13 0.00 0.00 55.73 57.92 2j1k s ARG 455 Cb 0.16 -4.16 0.03 0.00 -1.56 0.00 0.00 34.95 29.42 2j1k s ARG 455 CO 0.60 -1.17 1.18 -2.14 -0.81 0.00 0.00 175.30 172.96 2j1k s PRO 456 N 4.74 2.33 -0.00 5.12 0.02 -1.26 -4.89 135.00 141.06 2j1k s PRO 456 Ca 0.86 1.67 -0.08 0.00 0.02 0.00 0.00 61.00 63.48 2j1k s PRO 456 Cb -0.38 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.28 2j1k s PRO 456 CO 0.37 -1.67 0.15 0.45 -0.33 0.00 0.00 177.00 175.97 2j1k s SER 457 N -2.15 0.01 0.51 2.53 0.15 -1.26 -5.04 113.70 108.45 2j1k s SER 457 Ca 0.73 -0.17 0.22 0.00 0.70 0.00 0.00 55.95 57.42 2j1k s SER 457 Cb -0.27 0.22 1.32 0.00 -1.71 0.00 0.00 66.02 65.57 2j1k s SER 457 CO 0.44 -0.36 2.02 1.12 1.20 0.00 0.00 173.24 177.66 2j1k h HIS 458 N 4.33 0.07 0.00 3.44 2.07 -1.96 -2.13 115.15 120.96 2j1k h HIS 458 Ca -0.30 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.20 2j1k h HIS 458 Cb 1.19 -0.02 -0.00 0.00 2.57 0.00 0.00 27.41 31.15 2j1k h HIS 458 CO 0.58 0.03 -0.08 1.79 -3.07 0.00 0.00 177.93 177.19 2j1k h THR 459 N 0.07 0.35 -0.28 6.12 1.35 -1.96 -2.97 112.91 115.58 2j1k h THR 459 Ca 0.21 -0.45 0.08 0.00 -0.55 0.00 0.00 66.41 65.71 2j1k h THR 459 Cb 0.76 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 2j1k h THR 459 CO -0.02 0.08 0.27 -0.50 -0.25 0.00 0.00 175.52 175.10 2j1k h TRP 460 N 0.00 0.00 0.00 4.73 4.06 -1.65 0.22 115.95 123.31 2j1k h TRP 460 Ca -0.00 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 2j1k h TRP 460 Cb 0.32 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.48 2j1k h TRP 460 CO 0.00 0.00 -0.11 -0.22 -3.56 0.00 0.00 178.44 174.55 2j1k h LYS 461 N 0.00 0.00 0.00 0.49 3.64 -1.58 -2.53 116.57 116.59 2j1k h LYS 461 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2j1k h LYS 461 Cb 0.67 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2j1k h LYS 461 CO -0.00 0.11 0.00 -0.07 -2.27 0.00 0.00 179.45 177.22 2j1k h LEU 462 N 0.00 0.00 -0.43 5.20 3.38 -1.16 -1.80 115.31 120.50 2j1k h LEU 462 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2j1k h LEU 462 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2j1k h LEU 462 CO 0.01 0.00 -0.21 0.00 0.09 0.00 0.00 178.44 178.33 2j1k s MET 464 N -2.49 3.99 -0.15 0.00 -1.94 -0.68 -4.89 119.30 113.15 2j1k s MET 464 Ca 0.26 0.65 -0.29 0.00 -1.71 0.00 0.00 55.69 54.60 2j1k s MET 464 Cb 0.19 -2.43 -0.03 0.00 2.01 0.00 0.00 34.83 34.57 2j1k s MET 464 CO 0.51 0.15 1.53 -1.25 -0.01 0.00 0.00 175.02 175.95 2j1k s PRO 465 N -3.02 4.05 -0.49 2.03 0.04 -1.26 0.21 135.00 136.55 2j1k s PRO 465 Ca 0.54 1.84 -0.44 0.00 0.04 0.00 0.00 61.00 62.98 2j1k s PRO 465 Cb -0.10 -3.95 -0.19 0.00 0.04 0.00 0.00 34.50 30.30 2j1k s PRO 465 CO 0.18 -0.98 2.00 -1.71 0.04 0.00 0.00 177.00 176.53 2j1k n ASN 466 N 7.49 0.92 0.22 6.66 2.85 -0.55 -4.70 115.26 128.15 2j1k n ASN 466 Ca 0.17 0.80 0.07 0.00 -0.11 0.00 0.00 54.58 55.51 2j1k n ASN 466 Cb 0.44 -0.91 0.50 0.00 1.24 0.00 0.00 39.78 41.05 2j1k n ASN 466 CO 0.00 0.00 0.00 0.08 -2.11 0.00 0.00 177.26 175.23 2j1k h ARG 467 N 8.10 0.00 -0.02 1.20 0.11 -1.90 0.16 114.38 122.03 2j1k h ARG 467 Ca -0.19 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.78 2j1k h ARG 467 Cb 1.40 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.49 2j1k h ARG 467 CO 1.06 0.26 -0.39 1.49 0.10 0.00 0.00 179.97 182.49 2j1k h GLU 468 N 0.00 0.30 -0.74 0.08 4.81 -1.98 -2.02 114.58 115.03 2j1k h GLU 468 Ca -0.00 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 58.92 2j1k h GLU 468 Cb 0.57 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.99 2j1k h GLU 468 CO 0.03 0.99 0.41 0.28 -0.73 0.00 0.00 179.01 179.99 2j1k h VAL 469 N -0.27 1.22 -1.89 0.32 2.07 -1.89 -3.21 116.25 112.60 2j1k h VAL 469 Ca -0.04 -0.54 -0.69 0.00 0.82 0.00 0.00 66.70 66.25 2j1k h VAL 469 Cb 1.11 0.23 -0.35 0.00 -1.52 0.00 0.00 31.29 30.77 2j1k h VAL 469 CO 0.08 0.24 0.18 -1.22 0.02 0.00 0.00 177.57 176.87 2j1k n TYR 470 N -4.47 3.26 0.18 1.57 4.01 0.55 -4.71 117.16 117.54 2j1k n TYR 470 Ca 0.07 -2.86 0.05 0.00 -0.16 0.00 0.00 57.90 54.99 2j1k n TYR 470 Cb 0.09 -0.69 0.26 0.00 -0.31 0.00 0.00 39.34 38.68 2j1k n TYR 470 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2j1k h SER 471 N 3.00 0.00 -3.48 7.72 4.64 -1.36 -3.42 113.55 120.64 2j1k h SER 471 Ca 0.41 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 61.07 2j1k h SER 471 Cb 0.45 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.37 2j1k h SER 471 CO 1.11 0.40 -0.78 0.42 -0.87 0.00 0.00 176.83 177.11 2j1k s THR 472 N -3.41 2.92 0.37 2.95 -4.23 -1.26 -5.08 115.64 107.90 2j1k s THR 472 Ca 0.01 -1.58 -0.26 0.00 -1.18 0.00 0.00 61.69 58.68 2j1k s THR 472 Cb 0.10 -2.37 -0.12 0.00 1.34 0.00 0.00 72.50 71.45 2j1k s THR 472 CO 0.70 0.03 1.09 -2.65 -0.54 0.00 0.00 174.62 173.24 2j1k n PRO 473 N 0.55 1.56 -4.46 3.99 -0.02 -1.26 -4.98 135.00 130.39 2j1k n PRO 473 Ca -0.14 0.55 -0.24 0.00 -2.02 0.00 0.00 63.50 61.65 2j1k n PRO 473 Cb 0.54 -2.08 -0.10 0.00 -0.02 0.00 0.00 33.50 31.84 2j1k n PRO 473 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j1k s ALA 474 N -1.17 2.89 -0.01 3.55 0.00 -0.77 -4.96 121.76 121.28 2j1k s ALA 474 Ca 0.60 -1.92 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 2j1k s ALA 474 Cb -0.59 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.28 2j1k s ALA 474 CO 0.59 0.21 0.32 0.00 0.00 0.00 0.00 175.76 176.87 2j1k s ALA 475 N -2.52 -0.79 -0.16 0.00 0.00 -1.26 0.01 121.76 117.04 2j1k s ALA 475 Ca 0.31 0.32 -0.02 0.00 0.00 0.00 0.00 51.96 52.57 2j1k s ALA 475 Cb -0.03 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.24 2j1k s ALA 475 CO 0.16 -0.27 0.02 0.99 0.00 0.00 0.00 175.76 176.66 2j1k s THR 476 N -1.42 0.50 -0.17 0.00 2.01 -0.10 -5.00 115.64 111.46 2j1k s THR 476 Ca -0.13 -0.38 -0.17 0.00 0.31 0.00 0.00 61.69 61.32 2j1k s THR 476 Cb -0.05 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 2j1k s THR 476 CO 0.04 -0.07 0.44 -0.51 -0.69 0.00 0.00 174.62 173.83 2j1k s ILE 477 N 1.88 5.18 0.10 1.82 2.07 -1.26 -0.95 121.20 130.05 2j1k s ILE 477 Ca 0.01 0.83 0.04 0.00 -1.41 0.00 0.00 60.65 60.12 2j1k s ILE 477 Cb -0.16 -3.77 -0.04 0.00 0.13 0.00 0.00 42.46 38.62 2j1k s ILE 477 CO -0.07 0.27 -0.10 -0.44 -1.91 0.00 0.00 174.94 172.69 2j1k s SER 478 N 0.87 1.52 0.43 4.50 0.01 -0.01 -4.97 113.70 116.05 2j1k s SER 478 Ca 0.22 -0.84 -0.25 0.00 1.31 0.00 0.00 55.95 56.39 2j1k s SER 478 Cb -0.15 0.00 -0.09 0.00 0.21 0.00 0.00 66.02 65.99 2j1k s SER 478 CO 0.09 -0.27 1.33 -1.14 0.41 0.00 0.00 173.24 173.65 2j1k n ARG 479 N 0.45 2.04 -3.58 12.44 0.63 -1.26 -1.12 116.66 126.25 2j1k n ARG 479 Ca -0.15 0.72 -0.29 0.00 -0.92 0.00 0.00 57.85 57.21 2j1k n ARG 479 Cb 0.58 -2.47 -0.12 0.00 0.45 0.00 0.00 32.46 30.90 2j1k n ARG 479 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j1k n GLY 481 N 3.58 0.76 3.37 0.00 0.00 -1.26 -1.56 105.19 110.09 2j1k n GLY 481 Ca 0.13 0.39 -0.33 0.00 0.00 0.00 0.00 46.02 46.21 2j1k n GLY 481 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j1k s LEU 482 N -0.66 2.66 -1.51 0.99 1.43 -0.44 -0.44 118.68 120.70 2j1k s LEU 482 Ca 0.60 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 53.26 2j1k s LEU 482 Cb -0.58 -1.58 0.07 0.00 0.03 0.00 0.00 46.19 44.13 2j1k s LEU 482 CO 0.57 0.19 0.88 -0.67 0.23 0.00 0.00 176.35 177.55 2j1k n ASP 483 N 3.34 -3.76 -0.09 2.29 2.03 0.11 -4.81 116.55 115.67 2j1k n ASP 483 Ca -0.18 -0.82 -0.05 0.00 0.52 0.00 0.00 54.79 54.26 2j1k n ASP 483 Cb 0.53 -3.74 0.15 0.00 -0.72 0.00 0.00 41.12 37.34 2j1k n ASP 483 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2j1k h SER 484 N -1.98 0.73 0.23 1.67 0.02 -1.85 -0.15 113.55 112.22 2j1k h SER 484 Ca -0.59 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.15 2j1k h SER 484 Cb 1.37 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2j1k h SER 484 CO 0.66 0.84 -0.11 0.40 -1.14 0.00 0.00 176.83 177.48 2j1k h ILE 485 N 0.69 0.84 -0.62 3.27 2.04 -1.95 0.14 117.51 121.91 2j1k h ILE 485 Ca 0.12 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2j1k h ILE 485 Cb 0.53 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2j1k h ILE 485 CO 0.03 0.12 0.40 0.00 0.00 0.00 0.00 178.15 178.69 2j1k h ALA 486 N 0.10 0.79 -0.14 1.87 0.00 -1.89 -1.40 119.26 118.58 2j1k h ALA 486 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2j1k h ALA 486 Cb 0.43 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2j1k h ALA 486 CO 0.05 0.25 0.00 1.33 0.00 0.00 0.00 179.25 180.88 2j1k n VAL 487 N -4.63 0.19 -4.08 0.00 0.24 -0.09 -4.94 118.33 105.01 2j1k n VAL 487 Ca 0.05 -0.26 -0.28 0.00 -2.04 0.00 0.00 64.34 61.81 2j1k n VAL 487 Cb 0.03 0.16 -0.04 0.00 -1.47 0.00 0.00 33.84 32.53 2j1k n VAL 487 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2j1k n ASP 488 N 0.03 -0.38 -2.19 -1.34 2.03 -0.10 -2.37 116.55 112.23 2j1k n ASP 488 Ca 0.14 -1.08 -0.21 0.00 0.52 0.00 0.00 54.79 54.17 2j1k n ASP 488 Cb 0.24 -2.65 -0.03 0.00 -0.72 0.00 0.00 41.12 37.96 2j1k n ASP 488 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2j1k n GLY 489 N -2.04 0.02 3.65 0.27 0.00 0.30 -4.93 105.19 102.45 2j1k n GLY 489 Ca -0.26 -0.02 -0.52 0.00 0.00 0.00 0.00 46.02 45.21 2j1k n GLY 489 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j1k n ALA 490 N -1.31 -0.11 -0.32 4.61 0.00 -1.00 -4.87 120.51 117.52 2j1k n ALA 490 Ca -0.24 0.44 0.16 0.00 0.00 0.00 0.00 53.44 53.80 2j1k n ALA 490 Cb 0.68 -2.22 0.35 0.00 0.00 0.00 0.00 19.45 18.27 2j1k n ALA 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2j1k h PRO 491 N 6.15 0.35 -0.89 0.00 0.11 -1.93 -0.34 132.00 135.46 2j1k h PRO 491 Ca -0.47 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 2j1k h PRO 491 Cb 1.31 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2j1k h PRO 491 CO 0.87 0.23 0.06 -1.13 -0.21 0.00 0.00 178.00 177.82 2j1k n SER 492 N -5.07 2.86 -0.62 -2.05 3.41 -1.26 -3.56 113.62 107.32 2j1k n SER 492 Ca 0.25 -2.40 0.08 0.00 -0.26 0.00 0.00 58.87 56.54 2j1k n SER 492 Cb 0.75 -0.58 0.20 0.00 -0.26 0.00 0.00 64.21 64.32 2j1k n SER 492 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2j1k n ARG 493 N 0.14 2.57 -4.70 4.33 5.12 -0.14 -1.90 116.66 122.10 2j1k n ARG 493 Ca 0.13 -2.59 -0.33 0.00 -1.93 0.00 0.00 57.85 53.13 2j1k n ARG 493 Cb 0.68 -1.63 -0.12 0.00 -1.16 0.00 0.00 32.46 30.23 2j1k n ARG 493 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2j1k s SER 494 N -1.94 4.45 0.00 0.55 0.01 -1.23 -1.33 113.70 114.21 2j1k s SER 494 Ca 0.35 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2j1k s SER 494 Cb 0.27 -1.06 0.00 0.00 0.21 0.00 0.00 66.02 65.44 2j1k s SER 494 CO 0.08 0.35 0.00 2.30 0.41 0.00 0.00 173.24 176.38 2j1k n ILE 495 N 2.20 0.00 -4.48 1.44 -5.35 -0.60 -4.37 119.36 108.20 2j1k n ILE 495 Ca -0.18 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.00 2j1k n ILE 495 Cb 0.53 -0.53 -0.11 0.00 -1.74 0.00 0.00 39.64 37.78 2j1k n ILE 495 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2j1k s ASP 496 N -0.67 4.18 -0.14 7.28 1.01 -0.47 -0.18 116.67 127.69 2j1k s ASP 496 Ca 0.00 -0.34 0.02 0.00 0.71 0.00 0.00 52.55 52.94 2j1k s ASP 496 Cb 0.00 -0.80 0.01 0.00 1.01 0.00 0.00 42.92 43.14 2j1k s ASP 496 CO 0.00 0.24 -0.21 0.00 0.21 0.00 0.00 175.17 175.41 2j1k s MET 498 N 0.84 3.42 -0.15 0.00 1.75 0.54 -0.83 119.30 124.87 2j1k s MET 498 Ca -0.07 -0.63 -0.29 0.00 -1.25 0.00 0.00 55.69 53.46 2j1k s MET 498 Cb -0.15 -3.27 -0.01 0.00 2.84 0.00 0.00 34.83 34.24 2j1k s MET 498 CO -0.02 -0.27 0.99 -1.17 -0.65 0.00 0.00 175.02 173.90 2j1k s LEU 499 N 1.55 4.19 -0.16 4.11 2.96 -0.13 -0.57 118.68 130.64 2j1k s LEU 499 Ca 0.05 1.43 -0.04 0.00 -0.22 0.00 0.00 54.13 55.35 2j1k s LEU 499 Cb -0.16 -3.50 -0.03 0.00 0.50 0.00 0.00 46.19 43.00 2j1k s LEU 499 CO 0.02 -0.50 -0.01 -0.63 -1.32 0.00 0.00 176.35 173.90 2j1k s ILE 500 N 2.37 4.11 -0.25 6.68 1.01 -0.14 -0.93 121.20 134.05 2j1k s ILE 500 Ca 0.45 -0.28 -0.06 0.00 0.00 0.00 0.00 60.65 60.76 2j1k s ILE 500 Cb -0.17 -2.81 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 2j1k s ILE 500 CO 0.14 0.49 0.04 -0.63 0.00 0.00 0.00 174.94 174.97 2j1k s ILE 501 N 0.33 3.94 -1.45 2.92 1.01 0.10 -1.04 121.20 127.01 2j1k s ILE 501 Ca -0.02 -0.39 -0.00 0.00 0.00 0.00 0.00 60.65 60.23 2j1k s ILE 501 Cb -0.14 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.46 2j1k s ILE 501 CO 0.02 0.30 0.01 0.59 0.00 0.00 0.00 174.94 175.87 2j1k n ASN 502 N 4.87 -5.02 -4.68 3.58 3.02 0.20 -1.85 115.26 115.39 2j1k n ASN 502 Ca -0.16 -0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 53.94 2j1k n ASN 502 Cb 0.50 -4.11 -0.03 0.00 -0.61 0.00 0.00 39.78 35.54 2j1k n ASN 502 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2j1k s LYS 503 N -4.86 4.18 0.47 3.52 2.20 -1.26 -4.30 119.74 119.69 2j1k s LYS 503 Ca 0.00 2.34 -0.24 0.00 -0.36 0.00 0.00 55.97 57.72 2j1k s LYS 503 Cb -0.00 -3.77 -0.07 0.00 -1.51 0.00 0.00 37.83 32.47 2j1k s LYS 503 CO 0.01 -0.79 1.29 -2.14 -0.36 0.00 0.00 175.35 173.35 2j1k s PRO 504 N 3.24 3.62 -0.21 4.03 0.02 -1.26 -4.69 135.00 139.76 2j1k s PRO 504 Ca 0.76 2.09 -0.08 0.00 0.02 0.00 0.00 61.00 63.78 2j1k s PRO 504 Cb -0.39 -2.49 0.09 0.00 0.02 0.00 0.00 34.50 31.73 2j1k s PRO 504 CO 0.33 -0.75 0.45 0.21 -0.33 0.00 0.00 177.00 176.91 2j1k s LYS 505 N -2.60 0.38 2.56 5.54 2.47 -1.26 -5.12 119.74 121.71 2j1k s LYS 505 Ca 0.64 1.04 0.00 0.00 -1.56 0.00 0.00 55.97 56.09 2j1k s LYS 505 Cb -0.36 0.32 0.00 0.00 -1.46 0.00 0.00 37.83 36.32 2j1k s LYS 505 CO 0.45 -0.22 0.00 0.41 0.16 0.00 0.00 175.35 176.14 2j1k n GLY 506 N 5.13 2.86 1.26 5.54 0.00 -1.26 -1.78 105.19 116.94 2j1k n GLY 506 Ca -0.12 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.13 2j1k n GLY 506 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j1k n VAL 507 N 0.00 1.85 -2.42 1.61 0.24 -1.26 -4.99 118.33 113.36 2j1k n VAL 507 Ca 0.00 -1.34 -0.41 0.00 -2.04 0.00 0.00 64.34 60.55 2j1k n VAL 507 Cb 0.00 0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 32.42 2j1k n VAL 507 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j1k s ALA 508 N -1.98 3.42 0.06 2.33 0.00 -0.73 -4.95 121.76 119.91 2j1k s ALA 508 Ca 0.44 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 53.20 2j1k s ALA 508 Cb 0.30 -3.39 -0.28 0.00 0.00 0.00 0.00 23.12 19.75 2j1k s ALA 508 CO 0.19 -0.30 1.11 1.15 0.00 0.00 0.00 175.76 177.91 2j1k h THR 509 N 3.63 1.35 -4.11 0.00 2.02 -1.67 -3.43 112.91 110.70 2j1k h THR 509 Ca -0.45 -2.66 -0.46 0.00 0.77 0.00 0.00 66.41 63.61 2j1k h THR 509 Cb 1.21 2.80 -0.29 0.00 -1.74 0.00 0.00 68.15 70.13 2j1k h THR 509 CO 0.73 0.79 -0.80 -0.31 0.37 0.00 0.00 175.52 176.30 2j1k s TYR 510 N -2.85 1.15 0.02 3.16 2.02 -0.91 -5.00 117.35 114.93 2j1k s TYR 510 Ca -0.08 -0.23 0.04 0.00 -0.37 0.00 0.00 57.07 56.43 2j1k s TYR 510 Cb 0.06 -0.75 -0.02 0.00 -0.40 0.00 0.00 41.96 40.85 2j1k s TYR 510 CO 0.92 -0.04 -0.12 0.95 -1.57 0.00 0.00 175.55 175.69 2j1k s THR 511 N -0.22 0.96 -0.13 -0.71 -4.23 -1.26 -0.29 115.64 109.75 2j1k s THR 511 Ca 0.04 -0.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 2j1k s THR 511 Cb -0.06 -0.85 0.02 0.00 1.34 0.00 0.00 72.50 72.95 2j1k s THR 511 CO -0.00 0.09 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.24 2j1k s LEU 512 N -0.77 1.81 -0.15 4.79 1.43 -0.55 -0.63 118.68 124.61 2j1k s LEU 512 Ca 0.02 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 2j1k s LEU 512 Cb -0.06 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.94 2j1k s LEU 512 CO 0.00 0.01 -0.14 -0.89 0.23 0.00 0.00 176.35 175.56 2j1k s THR 513 N 1.11 2.80 -0.40 5.49 2.01 -0.20 0.06 115.64 126.50 2j1k s THR 513 Ca -0.03 -0.73 -0.15 0.00 0.31 0.00 0.00 61.69 61.09 2j1k s THR 513 Cb -0.14 -2.18 0.01 0.00 0.01 0.00 0.00 72.50 70.20 2j1k s THR 513 CO -0.05 0.51 0.31 -0.36 -0.69 0.00 0.00 174.62 174.34 2j1k s PHE 514 N 0.69 3.23 -0.21 4.92 0.08 -0.61 -0.97 117.98 125.12 2j1k s PHE 514 Ca -0.07 -0.52 -0.03 0.00 0.12 0.00 0.00 56.93 56.44 2j1k s PHE 514 Cb -0.16 -2.60 -0.00 0.00 -0.57 0.00 0.00 43.02 39.69 2j1k s PHE 514 CO 0.02 -0.57 -0.07 0.50 -0.10 0.00 0.00 175.22 175.00 2j1k s ARG 515 N 1.73 3.32 -0.24 0.44 3.52 0.27 -0.54 118.95 127.44 2j1k s ARG 515 Ca 0.06 -0.66 -0.14 0.00 -0.13 0.00 0.00 55.73 54.86 2j1k s ARG 515 Cb -0.19 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.22 2j1k s ARG 515 CO 0.10 -0.20 0.32 -0.06 -0.81 0.00 0.00 175.30 174.65 2j1k s PHE 516 N 1.45 3.30 0.11 5.12 0.08 0.34 -0.34 117.98 128.03 2j1k s PHE 516 Ca 0.06 0.40 0.04 0.00 0.12 0.00 0.00 56.93 57.55 2j1k s PHE 516 Cb -0.14 -2.47 -0.04 0.00 -0.57 0.00 0.00 43.02 39.80 2j1k s PHE 516 CO -0.05 -0.09 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.37 2j1k s LEU 517 N 1.59 2.42 -1.15 -0.37 1.43 -0.09 -2.75 118.68 119.77 2j1k s LEU 517 Ca 0.14 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2j1k s LEU 517 Cb -0.15 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.71 2j1k s LEU 517 CO 0.08 -0.26 0.97 0.59 0.23 0.00 0.00 176.35 177.96 2j1k n ASN 518 N 0.44 -3.37 0.26 2.29 3.02 -1.26 -1.37 115.26 115.28 2j1k n ASN 518 Ca -0.15 -0.64 0.17 0.00 -0.03 0.00 0.00 54.58 53.93 2j1k n ASN 518 Cb 0.58 -5.11 0.69 0.00 -0.61 0.00 0.00 39.78 35.33 2j1k n ASN 518 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2j1k h PHE 519 N -1.65 0.00 0.00 3.10 0.04 -1.85 -2.85 116.94 113.73 2j1k h PHE 519 Ca -0.59 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.18 2j1k h PHE 519 Cb 1.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.48 2j1k h PHE 519 CO 0.40 0.00 0.00 0.27 -0.60 0.00 0.00 178.31 178.38 2j1k n ASN 520 N -2.98 0.00 0.22 2.17 0.23 -1.13 -1.42 115.26 112.35 2j1k n ASN 520 Ca 0.01 0.10 0.08 0.00 -0.53 0.00 0.00 54.58 54.24 2j1k n ASN 520 Cb 0.28 -0.31 0.50 0.00 -2.08 0.00 0.00 39.78 38.18 2j1k n ASN 520 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2j1k h ARG 521 N 0.00 0.00 -6.90 -3.83 3.08 -1.79 -3.46 114.38 101.48 2j1k h ARG 521 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 2j1k h ARG 521 Cb 0.16 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.29 2j1k h ARG 521 CO 0.00 0.26 0.66 -0.51 -1.07 0.00 0.00 179.97 179.31 2j1k s LEU 522 N -7.41 4.38 0.22 3.04 1.43 -0.51 -4.72 118.68 115.11 2j1k s LEU 522 Ca -0.02 2.74 0.26 0.00 -1.03 0.00 0.00 54.13 56.08 2j1k s LEU 522 Cb 0.13 -3.69 0.73 0.00 0.03 0.00 0.00 46.19 43.38 2j1k s LEU 522 CO 0.65 -0.64 1.72 0.77 0.23 0.00 0.00 176.35 179.09 2j1k h SER 523 N 3.20 0.00 0.00 2.29 4.64 -1.70 -3.43 113.55 118.56 2j1k h SER 523 Ca -0.49 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2j1k h SER 523 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2j1k h SER 523 CO 0.65 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 2j1k n GLY 524 N 1.29 -1.16 3.68 -0.77 0.00 -1.26 -5.01 105.19 101.96 2j1k n GLY 524 Ca 0.05 -0.97 -0.53 0.00 0.00 0.00 0.00 46.02 44.58 2j1k n GLY 524 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j1k n GLY 525 N -0.02 0.98 3.16 -0.02 0.00 -1.26 -4.50 105.19 103.53 2j1k n GLY 525 Ca 0.00 0.85 -0.24 0.00 0.00 0.00 0.00 46.02 46.63 2j1k n GLY 525 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j1k s THR 526 N 2.97 1.33 0.14 2.61 2.01 0.13 -4.92 115.64 119.90 2j1k s THR 526 Ca 0.93 -0.80 -0.31 0.00 0.31 0.00 0.00 61.69 61.81 2j1k s THR 526 Cb -0.91 -1.13 -0.10 0.00 0.01 0.00 0.00 72.50 70.37 2j1k s THR 526 CO 0.56 0.31 1.77 -0.22 -0.69 0.00 0.00 174.62 176.35 2j1k s LEU 527 N -0.57 4.39 -1.47 4.42 2.96 -1.26 -0.05 118.68 127.09 2j1k s LEU 527 Ca 0.06 2.74 -0.12 0.00 -0.22 0.00 0.00 54.13 56.59 2j1k s LEU 527 Cb -0.07 -3.58 0.03 0.00 0.50 0.00 0.00 46.19 43.08 2j1k s LEU 527 CO -0.00 -0.97 2.36 0.33 -1.32 0.00 0.00 176.35 176.74 2j1k n PHE 528 N 5.16 3.19 -3.94 5.38 7.35 -0.13 -3.83 117.46 130.65 2j1k n PHE 528 Ca 0.17 -2.98 -0.30 0.00 -0.76 0.00 0.00 57.45 53.58 2j1k n PHE 528 Cb 0.38 -2.45 -0.14 0.00 0.35 0.00 0.00 39.48 37.62 2j1k n PHE 528 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2j1k s LYS 529 N 2.50 1.96 0.73 -4.13 2.20 -1.26 -1.01 119.74 120.73 2j1k s LYS 529 Ca 0.51 -2.62 -0.13 0.00 -0.36 0.00 0.00 55.97 53.38 2j1k s LYS 529 Cb 0.15 -3.27 0.03 0.00 -1.51 0.00 0.00 37.83 33.23 2j1k s LYS 529 CO -0.07 -1.12 1.11 0.95 -0.36 0.00 0.00 175.35 175.85 2j1k s THR 530 N -0.30 3.20 1.12 3.43 -4.23 -0.15 -0.71 115.64 118.01 2j1k s THR 530 Ca 0.17 0.47 -0.12 0.00 -1.18 0.00 0.00 61.69 61.03 2j1k s THR 530 Cb -0.25 -2.96 0.25 0.00 1.34 0.00 0.00 72.50 70.88 2j1k s THR 530 CO -0.00 -0.43 0.99 0.47 -0.54 0.00 0.00 174.62 175.10 2j1k n ASP 531 N -3.04 -1.31 -4.68 3.99 9.92 0.41 -4.57 116.55 117.28 2j1k n ASP 531 Ca 0.10 -0.02 -0.42 0.00 -0.53 0.00 0.00 54.79 53.91 2j1k n ASP 531 Cb 0.52 -1.30 -0.03 0.00 -0.64 0.00 0.00 41.12 39.68 2j1k n ASP 531 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2j1k s VAL 532 N -2.45 4.32 -0.02 2.53 1.01 -1.26 -4.50 120.40 120.03 2j1k s VAL 532 Ca 0.68 1.63 0.02 0.00 0.00 0.00 0.00 61.98 64.30 2j1k s VAL 532 Cb -0.24 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 2j1k s VAL 532 CO 0.64 -0.04 -0.03 -0.76 0.00 0.00 0.00 175.10 174.90 2j1k s LEU 533 N 2.56 3.35 -0.07 3.92 1.43 0.11 -4.96 118.68 125.03 2j1k s LEU 533 Ca 0.54 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 2j1k s LEU 533 Cb -0.23 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.13 2j1k s LEU 533 CO 0.19 0.31 -0.13 -0.89 0.23 0.00 0.00 176.35 176.06 2j1k s THR 534 N -0.99 1.19 0.26 5.49 2.01 -1.26 -0.97 115.64 121.37 2j1k s THR 534 Ca 0.17 -0.51 0.03 0.00 0.31 0.00 0.00 61.69 61.69 2j1k s THR 534 Cb -0.11 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.27 2j1k s THR 534 CO 0.07 0.37 0.02 -0.36 -0.69 0.00 0.00 174.62 174.03 2j1k s PHE 535 N 0.61 1.67 -0.02 4.92 0.08 -0.28 -4.98 117.98 119.98 2j1k s PHE 535 Ca -0.14 -0.96 -0.05 0.00 0.12 0.00 0.00 56.93 55.90 2j1k s PHE 535 Cb -0.16 -1.00 0.01 0.00 -0.57 0.00 0.00 43.02 41.30 2j1k s PHE 535 CO 0.04 -0.06 0.12 0.99 -0.10 0.00 0.00 175.22 176.21 2j1k s THR 536 N -3.42 0.04 0.13 0.64 2.01 -1.26 -0.13 115.64 113.65 2j1k s THR 536 Ca 0.32 -0.32 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 2j1k s THR 536 Cb 0.07 -0.28 0.02 0.00 0.01 0.00 0.00 72.50 72.32 2j1k s THR 536 CO 0.11 -0.18 0.33 -0.72 -0.69 0.00 0.00 174.62 173.47 2j1k s TYR 537 N -0.57 0.02 0.02 4.92 -0.85 -0.80 -5.01 117.35 115.09 2j1k s TYR 537 Ca -0.07 -0.38 -0.30 0.00 -0.52 0.00 0.00 57.07 55.80 2j1k s TYR 537 Cb -0.04 0.12 -0.05 0.00 0.38 0.00 0.00 41.96 42.37 2j1k s TYR 537 CO 0.01 -0.68 1.29 0.08 -1.52 0.00 0.00 175.55 174.72 2j1k s VAL 538 N -3.86 3.88 0.56 -3.49 1.01 -1.26 -0.88 120.40 116.35 2j1k s VAL 538 Ca 0.07 1.30 -0.18 0.00 0.00 0.00 0.00 61.98 63.16 2j1k s VAL 538 Cb 0.03 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2j1k s VAL 538 CO -0.09 0.05 1.08 -0.83 0.00 0.00 0.00 175.10 175.31 2j1k s GLY 539 N 1.41 2.41 0.63 4.51 0.00 -0.05 -1.48 107.32 114.75 2j1k s GLY 539 Ca 0.60 0.62 -0.16 0.00 0.00 0.00 0.00 44.72 45.79 2j1k s GLY 539 CO 0.27 0.96 1.10 1.85 0.00 0.00 0.00 173.10 177.28 2j1k s GLU 540 N -3.58 2.97 0.28 2.90 2.56 0.13 -4.26 118.70 119.70 2j1k s GLU 540 Ca 0.68 1.38 -0.15 0.00 0.00 0.00 0.00 54.97 56.89 2j1k s GLU 540 Cb -0.19 -1.97 -0.08 0.00 2.00 0.00 0.00 34.13 33.88 2j1k s GLU 540 CO 0.30 -1.12 0.70 -0.80 -0.56 0.00 0.00 175.26 173.77 2j1k s ASN 541 N -2.52 6.81 0.00 -1.70 0.01 -1.26 -4.46 114.94 111.83 2j1k s ASN 541 Ca 0.67 1.24 0.03 0.00 -0.71 0.00 0.00 52.86 54.10 2j1k s ASN 541 Cb -0.20 -2.36 0.20 0.00 0.41 0.00 0.00 41.25 39.31 2j1k s ASN 541 CO 0.39 -0.12 0.68 1.67 -1.51 0.00 0.00 177.10 178.21