#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 2.82 -0.22 0.00 0.04 -1.26 -4.96 135.00 131.43 2j1k s PRO 362 Ca 0.00 0.61 -0.17 0.00 0.04 0.00 0.00 61.00 61.48 2j1k s PRO 362 Cb 0.00 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.60 2j1k s PRO 362 CO 0.00 -1.09 0.56 -1.50 0.04 0.00 0.00 177.00 175.01 2j1k s ILE 363 N -3.24 -0.00 -0.10 0.56 2.07 -0.74 -5.02 121.20 114.73 2j1k s ILE 363 Ca 0.58 0.02 0.03 0.00 -1.41 0.00 0.00 60.65 59.87 2j1k s ILE 363 Cb -0.12 -0.80 -0.01 0.00 0.13 0.00 0.00 42.46 41.66 2j1k s ILE 363 CO 0.53 0.01 -0.19 -0.89 -1.91 0.00 0.00 174.94 172.49 2j1k s THR 364 N 0.74 2.53 -0.10 4.00 2.01 -1.26 -0.80 115.64 122.76 2j1k s THR 364 Ca -0.04 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.11 2j1k s THR 364 Cb -0.05 -2.00 -0.02 0.00 0.01 0.00 0.00 72.50 70.44 2j1k s THR 364 CO -0.05 0.55 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.55 2j1k s LEU 365 N 0.16 2.81 0.32 4.42 1.43 -0.35 -0.92 118.68 126.55 2j1k s LEU 365 Ca -0.10 -0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 52.61 2j1k s LEU 365 Cb -0.16 -1.61 0.03 0.00 0.03 0.00 0.00 46.19 44.48 2j1k s LEU 365 CO 0.06 0.24 0.66 -1.66 0.23 0.00 0.00 176.35 175.89 2j1k s TRP 366 N -0.12 0.22 -0.83 0.29 1.48 0.60 -0.09 118.94 120.48 2j1k s TRP 366 Ca -0.01 -0.71 0.26 0.00 -1.06 0.00 0.00 56.10 54.58 2j1k s TRP 366 Cb -0.14 0.54 0.61 0.00 -1.16 0.00 0.00 33.47 33.32 2j1k s TRP 366 CO 0.03 -1.30 1.51 0.25 -4.06 0.00 0.00 176.95 173.38 2j1k n THR 367 N -0.49 0.20 0.00 0.66 -2.24 -0.83 -1.76 114.28 109.82 2j1k n THR 367 Ca -0.04 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2j1k n THR 367 Cb 0.60 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 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 1.42 -0.89 3.85 3.38 0.00 -1.26 -4.63 105.19 107.05 2j1k n GLY 368 Ca 0.05 -1.66 -0.31 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.92 3.46 -1.02 1.61 0.04 -1.26 -4.09 135.00 131.82 2j1k s PRO 369 Ca 0.00 0.89 -0.10 0.00 0.04 0.00 0.00 61.00 61.82 2j1k s PRO 369 Cb 0.00 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2j1k s PRO 369 CO 0.00 -0.68 0.82 0.41 0.04 0.00 0.00 177.00 177.59 2j1k n GLY 370 N -2.17 -1.12 3.77 0.56 0.00 -1.26 -4.89 105.19 100.08 2j1k n GLY 370 Ca 0.07 0.52 -0.33 0.00 0.00 0.00 0.00 46.02 46.28 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 -4.80 2.87 0.92 1.61 0.04 -1.26 -5.03 135.00 129.36 2j1k s PRO 371 Ca 0.37 1.45 -0.14 0.00 0.04 0.00 0.00 61.00 62.72 2j1k s PRO 371 Cb -0.09 -1.96 0.15 0.00 0.04 0.00 0.00 34.50 32.65 2j1k s PRO 371 CO 0.80 -1.20 1.19 -1.54 0.04 0.00 0.00 177.00 176.29 2j1k s SER 372 N -2.41 3.46 -0.53 6.66 1.04 -1.26 -4.84 113.70 115.83 2j1k s SER 372 Ca 0.68 0.71 -0.28 0.00 0.48 0.00 0.00 55.95 57.54 2j1k s SER 372 Cb -0.22 -1.10 0.01 0.00 0.10 0.00 0.00 66.02 64.81 2j1k s SER 372 CO 0.39 -2.56 1.50 -0.63 0.98 0.00 0.00 173.24 172.92 2j1k s ILE 373 N -3.49 3.73 0.00 -1.02 1.01 -1.26 -3.79 121.20 116.38 2j1k s ILE 373 Ca 0.66 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.95 2j1k s ILE 373 Cb -0.11 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 38.08 2j1k s ILE 373 CO 0.52 -1.02 0.55 -0.46 0.00 0.00 0.00 174.94 174.53 2j1k n ASN 374 N 9.87 0.65 -4.24 3.58 0.23 -0.53 -4.81 115.26 120.02 2j1k n ASN 374 Ca 0.15 -1.27 -0.36 0.00 -0.53 0.00 0.00 54.58 52.56 2j1k n ASN 374 Cb 0.49 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.06 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 -0.27 1.76 -0.10 4.83 0.00 0.19 -4.19 107.32 109.54 2j1k s GLY 375 Ca 0.00 -1.65 -0.23 0.00 0.00 0.00 0.00 44.72 42.85 2j1k s GLY 375 CO 0.00 0.68 0.67 -1.36 0.00 0.00 0.00 173.10 173.09 2j1k s PHE 376 N 1.35 3.53 -0.15 1.90 0.08 -0.15 -0.59 117.98 123.95 2j1k s PHE 376 Ca -0.02 1.16 0.02 0.00 0.12 0.00 0.00 56.93 58.21 2j1k s PHE 376 Cb -0.19 -2.79 0.01 0.00 -0.57 0.00 0.00 43.02 39.48 2j1k s PHE 376 CO 0.00 0.04 -0.20 0.42 -0.10 0.00 0.00 175.22 175.38 2j1k s ILE 377 N 1.02 2.22 -1.36 0.64 1.01 -0.39 -4.79 121.20 119.54 2j1k s ILE 377 Ca 0.35 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 2j1k s ILE 377 Cb -0.17 -1.91 0.01 0.00 0.01 0.00 0.00 42.46 40.40 2j1k s ILE 377 CO 0.16 0.54 0.66 0.59 0.00 0.00 0.00 174.94 176.88 2j1k n ASN 378 N 4.19 -1.32 -0.03 3.58 3.02 -1.26 -2.46 115.26 120.99 2j1k n ASN 378 Ca -0.20 -0.86 -0.00 0.00 -0.03 0.00 0.00 54.58 53.48 2j1k n ASN 378 Cb 0.51 -3.78 -0.00 0.00 -0.61 0.00 0.00 39.78 35.90 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 -4.13 -4.09 6.41 8.00 -1.26 -5.00 116.55 113.47 2j1k n ASP 379 Ca -0.27 0.01 -0.28 0.00 0.71 0.00 0.00 54.79 54.96 2j1k n ASP 379 Cb 0.66 -1.66 -0.17 0.00 -0.02 0.00 0.00 41.12 39.94 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 -1.65 1.52 -0.21 -3.53 2.01 -1.03 -5.09 115.64 107.65 2j1k s THR 380 Ca 0.00 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 61.02 2j1k s THR 380 Cb 0.00 -1.36 -0.01 0.00 0.01 0.00 0.00 72.50 71.14 2j1k s THR 380 CO 0.00 0.44 1.33 -2.16 -0.69 0.00 0.00 174.62 173.54 2j1k s PRO 381 N 0.66 4.07 0.00 4.92 0.04 -1.26 -1.26 135.00 142.17 2j1k s PRO 381 Ca -0.14 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.44 2j1k s PRO 381 Cb -0.16 -3.84 0.00 0.00 0.04 0.00 0.00 34.50 30.54 2j1k s PRO 381 CO 0.04 -0.92 0.00 1.33 0.04 0.00 0.00 177.00 177.49 2j1k n VAL 382 N 5.78 0.00 -4.80 -0.36 0.24 0.25 -4.91 118.33 114.52 2j1k n VAL 382 Ca 0.15 -0.05 -0.33 0.00 -2.04 0.00 0.00 64.34 62.07 2j1k n VAL 382 Cb 0.45 0.43 -0.14 0.00 -1.47 0.00 0.00 33.84 33.11 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 -0.56 3.02 -0.44 1.34 -1.09 -0.74 -0.98 121.20 121.75 2j1k s ILE 383 Ca 0.00 -0.68 -0.20 0.00 -2.23 0.00 0.00 60.65 57.54 2j1k s ILE 383 Cb 0.00 -2.26 0.02 0.00 -1.58 0.00 0.00 42.46 38.65 2j1k s ILE 383 CO 0.00 0.53 0.59 -0.60 -1.23 0.00 0.00 174.94 174.23 2j1k s ARG 384 N 0.29 3.23 -0.30 2.79 3.52 0.07 -0.64 118.95 127.91 2j1k s ARG 384 Ca -0.10 -0.48 -0.06 0.00 -0.13 0.00 0.00 55.73 54.95 2j1k s ARG 384 Cb -0.16 -3.96 0.02 0.00 -1.56 0.00 0.00 34.95 29.29 2j1k s ARG 384 CO 0.06 -0.98 0.07 0.00 -0.81 0.00 0.00 175.30 173.64 2j1k s PHE 386 N 1.46 3.36 -0.05 0.00 5.36 0.56 -4.81 117.98 123.86 2j1k s PHE 386 Ca 0.01 1.26 -0.02 0.00 -0.96 0.00 0.00 56.93 57.23 2j1k s PHE 386 Cb -0.18 -3.09 0.03 0.00 -0.34 0.00 0.00 43.02 39.44 2j1k s PHE 386 CO 0.02 -0.37 0.04 0.42 -1.46 0.00 0.00 175.22 173.88 2j1k s ILE 387 N 2.69 0.02 -0.14 3.12 1.01 -1.26 -0.55 121.20 126.10 2j1k s ILE 387 Ca 0.38 0.34 0.02 0.00 0.00 0.00 0.00 60.65 61.40 2j1k s ILE 387 Cb -0.16 -0.25 0.01 0.00 0.01 0.00 0.00 42.46 42.07 2j1k s ILE 387 CO 0.09 0.20 -0.21 0.00 0.00 0.00 0.00 174.94 175.02 2j1k s LEU 389 N 0.86 4.76 -0.30 0.00 1.43 0.87 -0.64 118.68 125.66 2j1k s LEU 389 Ca -0.07 -1.48 -0.05 0.00 -1.03 0.00 0.00 54.13 51.50 2j1k s LEU 389 Cb -0.15 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.21 2j1k s LEU 389 CO -0.02 -0.44 0.06 -0.89 0.23 0.00 0.00 176.35 175.28 2j1k s THR 390 N 1.33 3.67 -0.29 5.49 2.01 -0.20 -1.21 115.64 126.45 2j1k s THR 390 Ca 0.02 -0.91 -0.19 0.00 0.31 0.00 0.00 61.69 60.92 2j1k s THR 390 Cb -0.22 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.32 2j1k s THR 390 CO 0.01 0.02 0.55 -0.60 -0.69 0.00 0.00 174.62 173.90 2j1k s ARG 391 N 1.43 3.95 0.00 4.92 6.06 0.02 -0.76 118.95 134.56 2j1k s ARG 391 Ca 0.00 0.24 0.00 0.00 -2.50 0.00 0.00 55.73 53.48 2j1k s ARG 391 Cb -0.18 -3.70 0.00 0.00 0.06 0.00 0.00 34.95 31.13 2j1k s ARG 391 CO 0.01 -0.46 0.00 -0.25 -2.50 0.00 0.00 175.30 172.10 2j1k n ASP 392 N 5.67 0.00 -0.12 -2.12 8.00 -0.89 -1.78 116.55 125.30 2j1k n ASP 392 Ca -0.03 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.36 2j1k n ASP 392 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 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 0.69 0.00 -2.24 4.64 -1.97 -3.42 113.55 111.26 2j1k h SER 393 Ca 0.00 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2j1k h SER 393 Cb 0.00 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 2j1k h SER 393 CO 0.00 0.88 -0.20 -3.20 -0.87 0.00 0.00 176.83 173.44 2j1k n ASN 394 N -4.41 0.80 -4.92 4.97 5.15 -1.26 -5.05 115.26 110.55 2j1k n ASN 394 Ca -0.02 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.66 2j1k n ASN 394 Cb 0.33 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.55 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 -3.31 4.34 -0.23 1.20 1.43 -1.26 -0.61 118.68 120.24 2j1k s LEU 395 Ca 0.00 0.25 -0.08 0.00 -1.03 0.00 0.00 54.13 53.28 2j1k s LEU 395 Cb 0.00 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 2j1k s LEU 395 CO 0.00 0.16 0.08 -0.69 0.23 0.00 0.00 176.35 176.13 2j1k s VAL 396 N -1.52 4.49 -0.15 -1.59 1.01 0.19 -2.10 120.40 120.74 2j1k s VAL 396 Ca 0.35 -0.12 -0.20 0.00 0.00 0.00 0.00 61.98 62.02 2j1k s VAL 396 Cb -0.13 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2j1k s VAL 396 CO 0.28 0.36 0.55 -0.89 0.00 0.00 0.00 175.10 175.40 2j1k s THR 397 N 1.30 5.11 -0.31 3.92 2.01 0.06 -1.85 115.64 125.88 2j1k s THR 397 Ca 0.05 1.07 -0.18 0.00 0.31 0.00 0.00 61.69 62.94 2j1k s THR 397 Cb -0.15 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 2j1k s THR 397 CO 0.04 0.23 0.50 -0.69 -0.69 0.00 0.00 174.62 174.01 2j1k s VAL 398 N 1.18 5.05 -0.17 3.82 1.01 0.12 -1.03 120.40 130.38 2j1k s VAL 398 Ca 0.28 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.82 2j1k s VAL 398 Cb -0.16 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.35 2j1k s VAL 398 CO 0.11 -0.07 -0.19 0.21 0.00 0.00 0.00 175.10 175.16 2j1k s ASN 399 N 1.68 3.27 -0.10 3.32 3.84 0.19 -1.41 114.94 125.73 2j1k s ASN 399 Ca 0.19 -0.60 -0.17 0.00 0.21 0.00 0.00 52.86 52.49 2j1k s ASN 399 Cb -0.15 -1.50 0.04 0.00 -0.55 0.00 0.00 41.25 39.09 2j1k s ASN 399 CO 0.12 0.03 0.42 0.00 -2.79 0.00 0.00 177.10 174.88 2j1k s ALA 400 N 1.12 -1.06 0.05 1.71 0.00 -0.52 0.35 121.76 123.41 2j1k s ALA 400 Ca 0.01 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 2j1k s ALA 400 Cb -0.14 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.61 2j1k s ALA 400 CO -0.08 -0.24 0.20 -1.54 0.00 0.00 0.00 175.76 174.10 2j1k s SER 401 N -0.45 0.05 -0.01 0.00 1.04 0.29 0.02 113.70 114.63 2j1k s SER 401 Ca -0.06 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 55.95 2j1k s SER 401 Cb -0.03 0.31 -0.00 0.00 0.10 0.00 0.00 66.02 66.39 2j1k s SER 401 CO 0.03 -0.61 -0.05 -0.36 0.98 0.00 0.00 173.24 173.23 2j1k s PHE 402 N -2.93 0.52 -0.16 5.02 0.08 -1.26 -0.33 117.98 118.93 2j1k s PHE 402 Ca -0.02 -0.10 -0.00 0.00 0.12 0.00 0.00 56.93 56.92 2j1k s PHE 402 Cb 0.01 -0.36 0.04 0.00 -0.57 0.00 0.00 43.02 42.14 2j1k s PHE 402 CO -0.06 -0.02 -0.07 0.08 -0.10 0.00 0.00 175.22 175.04 2j1k s VAL 403 N -0.03 1.22 0.33 -0.44 1.01 0.24 -1.03 120.40 121.70 2j1k s VAL 403 Ca 0.01 -0.62 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 2j1k s VAL 403 Cb -0.03 -1.33 -0.10 0.00 0.00 0.00 0.00 36.38 34.92 2j1k s VAL 403 CO -0.00 0.21 1.21 -0.83 0.00 0.00 0.00 175.10 175.69 2j1k s GLY 404 N 1.60 2.99 0.24 4.51 0.00 0.54 -0.75 107.32 116.45 2j1k s GLY 404 Ca 0.02 1.07 0.06 0.00 0.00 0.00 0.00 44.72 45.87 2j1k s GLY 404 CO -0.08 1.68 -0.06 -0.54 0.00 0.00 0.00 173.10 174.09 2j1k s GLU 405 N -1.81 1.41 5.27 2.90 0.41 -0.15 -3.81 118.70 122.92 2j1k s GLU 405 Ca 0.50 -1.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.36 2j1k s GLU 405 Cb -0.35 -0.95 0.00 0.00 -1.78 0.00 0.00 34.13 31.05 2j1k s GLU 405 CO 0.46 0.03 0.00 0.41 -0.49 0.00 0.00 175.26 175.66 2j1k n GLY 406 N -0.47 3.58 0.17 -1.39 0.00 -1.26 -0.53 105.19 105.28 2j1k n GLY 406 Ca -0.06 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2j1k n GLY 406 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2j1k h GLY 407 N 0.00 0.00 -2.18 -0.02 0.00 -1.96 -2.50 103.07 96.41 2j1k h GLY 407 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2j1k h GLY 407 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 2j1k n TYR 408 N -2.38 1.03 -0.23 5.60 4.01 0.31 -4.56 117.16 120.95 2j1k n TYR 408 Ca 0.00 -0.63 -0.06 0.00 -0.16 0.00 0.00 57.90 57.05 2j1k n TYR 408 Cb 0.15 -0.18 0.07 0.00 -0.31 0.00 0.00 39.34 39.08 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 2.97 1.08 -5.23 -0.72 2.43 -1.43 -3.34 114.38 110.15 2j1k h ARG 409 Ca 0.00 -0.26 -0.64 0.00 -0.81 0.00 0.00 59.98 58.27 2j1k h ARG 409 Cb 1.21 -0.14 -0.33 0.00 -0.42 0.00 0.00 29.97 30.29 2j1k h ARG 409 CO 0.15 0.96 -0.86 0.42 -1.51 0.00 0.00 179.97 179.13 2j1k s ILE 410 N -5.27 1.83 0.04 1.20 1.01 -1.26 -0.50 121.20 118.25 2j1k s ILE 410 Ca -0.12 -0.89 0.05 0.00 0.00 0.00 0.00 60.65 59.69 2j1k s ILE 410 Cb 0.15 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 2j1k s ILE 410 CO 0.84 0.51 -0.08 0.68 0.00 0.00 0.00 174.94 176.89 2j1k s VAL 411 N 0.35 3.53 0.34 2.92 -7.23 0.20 -4.89 120.40 115.63 2j1k s VAL 411 Ca -0.16 -0.97 0.09 0.00 -1.81 0.00 0.00 61.98 59.13 2j1k s VAL 411 Cb -0.17 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 2j1k s VAL 411 CO 0.07 0.28 0.06 -0.94 -0.31 0.00 0.00 175.10 174.27 2j1k s SER 412 N -1.73 4.37 0.56 4.85 1.04 -1.26 -0.56 113.70 120.97 2j1k s SER 412 Ca 0.19 -0.92 0.31 0.00 0.48 0.00 0.00 55.95 56.01 2j1k s SER 412 Cb -0.11 -0.60 1.46 0.00 0.10 0.00 0.00 66.02 66.87 2j1k s SER 412 CO 0.10 -0.27 1.85 -0.65 0.98 0.00 0.00 173.24 175.25 2j1k h PRO 413 N 1.70 0.00 -0.02 4.02 0.11 -1.78 -0.38 132.00 135.65 2j1k h PRO 413 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2j1k h PRO 413 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2j1k h PRO 413 CO 0.66 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.70 2j1k n THR 414 N -3.98 0.02 -1.71 -1.15 -2.24 -1.26 -2.51 114.28 101.45 2j1k n THR 414 Ca 0.16 -0.15 -0.43 0.00 -2.27 0.00 0.00 64.05 61.36 2j1k n THR 414 Cb 0.92 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.19 2j1k n THR 414 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2j1k n GLN 415 N -0.31 2.36 -2.89 -0.78 -0.06 -0.15 -4.96 117.38 110.58 2j1k n GLN 415 Ca 0.20 0.84 -0.33 0.00 -2.00 0.00 0.00 57.00 55.71 2j1k n GLN 415 Cb 0.24 -2.55 -0.06 0.00 -4.06 0.00 0.00 30.24 23.81 2j1k n GLN 415 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 2j1k s SER 416 N 0.31 6.86 0.51 1.69 1.04 -1.26 -4.65 113.70 118.20 2j1k s SER 416 Ca 0.65 1.55 -0.19 0.00 0.48 0.00 0.00 55.95 58.44 2j1k s SER 416 Cb -0.57 -2.48 -0.08 0.00 0.10 0.00 0.00 66.02 62.99 2j1k s SER 416 CO 0.51 -0.33 1.03 -1.10 0.98 0.00 0.00 173.24 174.33 2j1k s GLN 417 N -3.19 3.76 0.10 4.02 -0.21 -1.26 -5.02 119.66 117.85 2j1k s GLN 417 Ca 0.59 1.26 -0.14 0.00 0.02 0.00 0.00 55.36 57.09 2j1k s GLN 417 Cb -0.09 -2.09 0.02 0.00 1.00 0.00 0.00 33.01 31.85 2j1k s GLN 417 CO 0.16 -0.45 0.33 -0.59 -2.12 0.00 0.00 175.29 172.62 2j1k s PHE 418 N -2.17 -0.10 -0.08 0.91 -0.12 -0.98 -5.00 117.98 110.44 2j1k s PHE 418 Ca 0.65 -0.20 0.03 0.00 -0.05 0.00 0.00 56.93 57.36 2j1k s PHE 418 Cb -0.15 0.15 -0.02 0.00 -0.63 0.00 0.00 43.02 42.38 2j1k s PHE 418 CO 0.24 -0.62 -0.17 -1.12 -0.05 0.00 0.00 175.22 173.49 2j1k s SER 419 N -2.66 3.71 -0.41 1.98 0.01 -1.26 -0.47 113.70 114.60 2j1k s SER 419 Ca 0.02 -0.35 -0.10 0.00 1.31 0.00 0.00 55.95 56.83 2j1k s SER 419 Cb 0.02 -1.12 0.06 0.00 0.21 0.00 0.00 66.02 65.19 2j1k s SER 419 CO -0.10 0.25 0.25 -0.76 0.41 0.00 0.00 173.24 173.29 2j1k s LEU 420 N -0.16 5.03 -0.22 2.44 1.43 0.35 -4.94 118.68 122.60 2j1k s LEU 420 Ca -0.02 -1.30 -0.13 0.00 -1.03 0.00 0.00 54.13 51.65 2j1k s LEU 420 Cb -0.14 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 2j1k s LEU 420 CO 0.03 -0.49 0.28 -0.63 0.23 0.00 0.00 176.35 175.77 2j1k s ILE 421 N 1.49 5.28 -0.26 -0.59 1.01 -1.26 -1.16 121.20 125.71 2j1k s ILE 421 Ca 0.02 0.45 -0.13 0.00 0.00 0.00 0.00 60.65 60.99 2j1k s ILE 421 Cb -0.22 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2j1k s ILE 421 CO 0.04 0.30 0.30 -0.04 0.00 0.00 0.00 174.94 175.54 2j1k s MET 422 N 1.19 4.02 -0.14 2.79 -1.94 0.63 -0.58 119.30 125.28 2j1k s MET 422 Ca 0.13 -0.08 -0.04 0.00 -1.71 0.00 0.00 55.69 53.99 2j1k s MET 422 Cb -0.14 -3.63 -0.03 0.00 2.01 0.00 0.00 34.83 33.04 2j1k s MET 422 CO 0.06 -0.18 0.01 -1.21 -0.01 0.00 0.00 175.02 173.69 2j1k s GLU 423 N 1.76 3.53 0.05 2.03 2.02 -1.26 -1.60 118.70 125.23 2j1k s GLU 423 Ca 0.12 -0.43 0.07 0.00 0.02 0.00 0.00 54.97 54.75 2j1k s GLU 423 Cb -0.15 -2.96 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 2j1k s GLU 423 CO 0.09 0.41 -0.19 -0.06 0.02 0.00 0.00 175.26 175.53 2j1k s PHE 424 N -0.07 1.65 0.51 1.61 0.08 0.08 -0.16 117.98 121.68 2j1k s PHE 424 Ca 0.04 -0.38 -0.08 0.00 0.12 0.00 0.00 56.93 56.63 2j1k s PHE 424 Cb -0.13 -0.97 0.12 0.00 -0.57 0.00 0.00 43.02 41.47 2j1k s PHE 424 CO 0.02 0.09 0.69 -0.40 -0.10 0.00 0.00 175.22 175.53 2j1k n ASP 425 N 1.73 0.13 0.31 1.36 5.68 -0.37 -1.26 116.55 124.13 2j1k n ASP 425 Ca -0.18 -1.30 0.20 0.00 -0.50 0.00 0.00 54.79 53.01 2j1k n ASP 425 Cb 0.54 -0.52 0.94 0.00 -1.14 0.00 0.00 41.12 40.93 2j1k n ASP 425 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 2j1k h GLN 426 N 0.00 0.00 -0.66 0.11 7.50 -1.94 -2.10 115.11 118.02 2j1k h GLN 426 Ca -0.22 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.93 2j1k h GLN 426 Cb 0.64 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.17 2j1k h GLN 426 CO 0.17 0.00 0.00 1.19 -1.50 0.00 0.00 178.83 178.69 2j1k n PHE 427 N -3.07 0.94 -1.41 2.96 3.72 -1.26 -4.93 117.46 114.40 2j1k n PHE 427 Ca -0.01 -0.52 -0.04 0.00 -0.05 0.00 0.00 57.45 56.83 2j1k n PHE 427 Cb 0.19 -0.03 -0.01 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 1.38 0.56 3.73 1.37 0.00 -0.79 -3.17 105.19 108.26 2j1k n GLY 428 Ca 0.22 -0.82 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.92 4.26 0.16 1.61 -0.21 -1.26 -4.67 119.66 116.63 2j1k s GLN 429 Ca 0.00 0.20 -0.32 0.00 0.02 0.00 0.00 55.36 55.27 2j1k s GLN 429 Cb 0.00 -3.42 -0.10 0.00 1.00 0.00 0.00 33.01 30.49 2j1k s GLN 429 CO 0.00 0.24 1.63 -1.17 -2.12 0.00 0.00 175.29 173.87 2j1k s LEU 430 N 0.44 4.37 0.68 2.90 2.96 -1.26 -1.24 118.68 127.53 2j1k s LEU 430 Ca 0.19 2.67 -0.03 0.00 -0.22 0.00 0.00 54.13 56.74 2j1k s LEU 430 Cb -0.14 -3.59 0.08 0.00 0.50 0.00 0.00 46.19 43.05 2j1k s LEU 430 CO 0.06 -0.88 0.96 -0.04 -1.32 0.00 0.00 176.35 175.13 2j1k s MET 431 N 1.42 2.01 0.00 1.98 -1.94 0.77 -4.47 119.30 119.07 2j1k s MET 431 Ca 0.72 -0.72 0.27 0.00 -1.71 0.00 0.00 55.69 54.25 2j1k s MET 431 Cb -0.45 -2.30 0.83 0.00 2.01 0.00 0.00 34.83 34.92 2j1k s MET 431 CO 0.32 -1.23 1.62 -1.13 -0.01 0.00 0.00 175.02 174.59 2j1k n SER 432 N -2.77 1.87 0.01 3.03 3.41 -1.26 -1.50 113.62 116.40 2j1k n SER 432 Ca 0.11 -1.62 0.11 0.00 -0.26 0.00 0.00 58.87 57.20 2j1k n SER 432 Cb 0.60 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.50 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 0.46 0.06 -2.12 6.66 -2.24 -1.26 -4.72 114.28 111.13 2j1k n THR 433 Ca 0.18 -0.19 -0.28 0.00 -2.27 0.00 0.00 64.05 61.49 2j1k n THR 433 Cb 0.42 0.48 0.15 0.00 -2.10 0.00 0.00 70.33 69.28 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 -3.53 1.76 0.35 3.38 0.00 -1.26 -4.97 107.32 103.04 2j1k s GLY 434 Ca 0.03 -1.30 0.15 0.00 0.00 0.00 0.00 44.72 43.61 2j1k s GLY 434 CO 0.84 -0.62 1.72 3.43 0.00 0.00 0.00 173.10 178.48 2j1k h ASN 435 N -1.27 0.00 -3.22 1.64 4.21 -1.15 -3.38 115.58 112.40 2j1k h ASN 435 Ca -0.42 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.42 2j1k h ASN 435 Cb 1.25 0.00 -0.32 0.00 -1.12 0.00 0.00 38.32 38.14 2j1k h ASN 435 CO 0.41 0.45 -0.81 -0.63 -1.29 0.00 0.00 177.43 175.56 2j1k s ILE 436 N -3.74 2.55 0.34 2.81 1.01 -0.84 -0.98 121.20 122.36 2j1k s ILE 436 Ca -0.01 -0.79 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 2j1k s ILE 436 Cb 0.12 -2.09 0.01 0.00 0.01 0.00 0.00 42.46 40.51 2j1k s ILE 436 CO 0.71 0.51 0.47 -0.46 0.00 0.00 0.00 174.94 176.17 2j1k n ASN 437 N 4.38 -1.30 0.00 3.58 0.23 -1.26 -4.25 115.26 116.65 2j1k n ASN 437 Ca -0.20 -2.86 0.11 0.00 -0.53 0.00 0.00 54.58 51.10 2j1k n ASN 437 Cb 0.51 2.44 0.65 0.00 -2.08 0.00 0.00 39.78 41.30 2j1k n ASN 437 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2j1k n SER 438 N -1.64 0.00 0.01 0.53 3.41 -0.57 -2.46 113.62 112.91 2j1k n SER 438 Ca 0.01 -0.81 0.12 0.00 -0.26 0.00 0.00 58.87 57.94 2j1k n SER 438 Cb 0.57 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 65.05 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 -0.96 0.29 -3.92 6.66 -2.24 -1.26 -4.85 114.28 108.00 2j1k n THR 439 Ca 0.16 0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.76 2j1k n THR 439 Cb 0.08 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 67.64 2j1k n THR 439 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2j1k s THR 440 N -3.02 3.96 0.06 4.28 2.01 -1.03 -5.07 115.64 116.83 2j1k s THR 440 Ca 0.12 -1.35 -0.31 0.00 0.31 0.00 0.00 61.69 60.45 2j1k s THR 440 Cb 0.16 -3.30 -0.11 0.00 0.01 0.00 0.00 72.50 69.27 2j1k s THR 440 CO 0.48 -0.25 1.88 0.41 -0.69 0.00 0.00 174.62 176.45 2j1k n THR 441 N -1.31 0.52 -3.64 -0.82 -1.04 -1.26 -4.94 114.28 101.78 2j1k n THR 441 Ca -0.04 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.05 61.77 2j1k n THR 441 Cb 0.59 -2.12 -0.07 0.00 -1.82 0.00 0.00 70.33 66.91 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 3.43 -0.60 -5.00 -1.42 -0.11 -1.26 -4.52 118.94 109.46 2j1k s TRP 442 Ca 0.86 1.44 0.00 0.00 1.22 0.00 0.00 56.10 59.62 2j1k s TRP 442 Cb -0.51 0.34 0.00 0.00 -1.50 0.00 0.00 33.47 31.80 2j1k s TRP 442 CO 0.41 -0.29 0.00 0.41 -4.62 0.00 0.00 176.95 172.86 2j1k n GLY 443 N 2.52 -1.26 3.75 5.86 0.00 -0.72 -4.53 105.19 110.80 2j1k n GLY 443 Ca -0.14 -1.23 -0.40 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.00 4.75 -0.34 1.61 2.12 0.25 -0.29 118.70 124.80 2j1k s GLU 444 Ca 0.00 1.58 -0.18 0.00 0.36 0.00 0.00 54.97 56.73 2j1k s GLU 444 Cb 0.00 -3.28 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 2j1k s GLU 444 CO 0.00 0.34 0.53 0.21 -0.54 0.00 0.00 175.26 175.80 2j1k s LYS 445 N -0.92 3.68 0.37 4.30 2.20 -0.10 -0.39 119.74 128.89 2j1k s LYS 445 Ca 0.44 -0.07 -0.27 0.00 -0.36 0.00 0.00 55.97 55.71 2j1k s LYS 445 Cb -0.27 -3.79 -0.09 0.00 -1.51 0.00 0.00 37.83 32.17 2j1k s LYS 445 CO 0.34 -0.62 1.20 -2.14 -0.36 0.00 0.00 175.35 173.77 2j1k s PRO 446 N 2.43 4.18 0.17 4.03 0.02 -1.26 -4.45 135.00 140.12 2j1k s PRO 446 Ca 0.20 1.95 -0.32 0.00 0.02 0.00 0.00 61.00 62.85 2j1k s PRO 446 Cb -0.15 -2.83 -0.11 0.00 0.02 0.00 0.00 34.50 31.42 2j1k s PRO 446 CO 0.13 -0.24 1.70 -0.46 -0.33 0.00 0.00 177.00 177.80 2j1k s TRP 447 N -1.31 2.74 0.00 6.54 -0.00 -1.26 -2.65 118.94 123.01 2j1k s TRP 447 Ca 0.54 0.33 0.00 0.00 -0.00 0.00 0.00 56.10 56.97 2j1k s TRP 447 Cb -0.34 -4.08 0.00 0.00 -0.00 0.00 0.00 33.47 29.05 2j1k s TRP 447 CO 0.43 -4.17 0.00 0.41 -0.00 0.00 0.00 176.95 173.62 2j1k n GLY 448 N 3.98 0.09 3.56 5.86 0.00 -1.26 -5.06 105.19 112.35 2j1k n GLY 448 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.01 -0.01 -0.24 1.61 2.20 -1.08 -5.06 114.94 110.34 2j1k s ASN 449 Ca 0.00 -1.00 0.14 0.00 -0.94 0.00 0.00 52.86 51.06 2j1k s ASN 449 Cb 0.00 0.58 0.70 0.00 -2.00 0.00 0.00 41.25 40.53 2j1k s ASN 449 CO 0.00 -1.14 1.65 0.59 -2.94 0.00 0.00 177.10 175.26 2j1k n ASN 450 N -0.45 4.81 -4.80 3.54 3.02 -1.26 -4.38 115.26 115.74 2j1k n ASN 450 Ca -0.01 -3.07 -0.30 0.00 -0.03 0.00 0.00 54.58 51.16 2j1k n ASN 450 Cb 0.62 -0.66 0.08 0.00 -0.61 0.00 0.00 39.78 39.22 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 -2.87 3.42 -0.27 3.41 -4.23 -1.26 -4.53 115.64 109.30 2j1k s THR 451 Ca 0.51 0.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.48 2j1k s THR 451 Cb 0.40 -3.15 0.05 0.00 1.34 0.00 0.00 72.50 71.14 2j1k s THR 451 CO 0.12 -0.60 -0.07 -0.69 -0.54 0.00 0.00 174.62 172.85 2j1k s VAL 452 N -3.07 2.57 -0.42 2.29 1.01 -1.26 -4.38 120.40 117.14 2j1k s VAL 452 Ca 0.60 -1.42 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 2j1k s VAL 452 Cb -0.15 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.81 2j1k s VAL 452 CO 0.55 0.00 0.43 -1.10 0.00 0.00 0.00 175.10 174.98 2j1k s GLN 453 N 1.20 3.08 0.05 2.72 -1.52 0.48 -4.83 119.66 120.84 2j1k s GLN 453 Ca -0.06 -0.79 0.28 0.00 -1.95 0.00 0.00 55.36 52.84 2j1k s GLN 453 Cb -0.19 -3.97 1.07 0.00 -0.22 0.00 0.00 33.01 29.70 2j1k s GLN 453 CO -0.04 -0.85 1.84 -0.35 -0.25 0.00 0.00 175.29 175.64 2j1k n PRO 454 N 5.57 0.07 -2.14 2.91 -0.04 -1.26 -0.58 135.00 139.52 2j1k n PRO 454 Ca -0.08 0.05 -0.43 0.00 -0.04 0.00 0.00 63.50 63.01 2j1k n PRO 454 Cb 0.47 -1.57 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 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 -3.03 4.13 0.67 0.54 3.52 -1.26 -4.95 118.95 118.57 2j1k s ARG 455 Ca 0.13 1.95 -0.17 0.00 -0.13 0.00 0.00 55.73 57.51 2j1k s ARG 455 Cb 0.17 -3.93 0.01 0.00 -1.56 0.00 0.00 34.95 29.64 2j1k s ARG 455 CO 0.56 -0.88 1.21 -2.14 -0.81 0.00 0.00 175.30 173.24 2j1k s PRO 456 N 3.99 2.51 0.06 5.12 0.02 -1.26 -4.89 135.00 140.54 2j1k s PRO 456 Ca 0.68 1.79 0.01 0.00 0.02 0.00 0.00 61.00 63.51 2j1k s PRO 456 Cb -0.29 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.33 2j1k s PRO 456 CO 0.25 -1.56 -0.06 0.45 -0.33 0.00 0.00 177.00 175.75 2j1k s SER 457 N -1.85 0.84 0.58 2.53 0.15 -1.26 -5.03 113.70 109.66 2j1k s SER 457 Ca 0.76 -0.73 0.28 0.00 0.70 0.00 0.00 55.95 56.95 2j1k s SER 457 Cb -0.30 0.08 1.73 0.00 -1.71 0.00 0.00 66.02 65.82 2j1k s SER 457 CO 0.40 -0.34 2.23 1.12 1.20 0.00 0.00 173.24 177.86 2j1k h HIS 458 N 3.91 0.00 0.00 3.44 2.07 -1.96 -2.59 115.15 120.01 2j1k h HIS 458 Ca -0.35 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.17 2j1k h HIS 458 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 2j1k h HIS 458 CO 0.62 0.00 0.00 1.79 -3.07 0.00 0.00 177.93 177.27 2j1k h THR 459 N 0.00 0.00 -0.13 6.12 1.35 -1.96 -3.03 112.91 115.26 2j1k h THR 459 Ca 0.01 -0.22 -0.02 0.00 -0.55 0.00 0.00 66.41 65.63 2j1k h THR 459 Cb 0.04 0.98 -0.01 0.00 -1.73 0.00 0.00 68.15 67.43 2j1k h THR 459 CO -0.00 0.00 -0.02 -0.50 -0.25 0.00 0.00 175.52 174.75 2j1k h TRP 460 N 0.00 0.18 -0.63 4.73 4.06 -1.71 -1.43 115.95 121.15 2j1k h TRP 460 Ca 0.00 -0.01 0.12 0.00 2.06 0.00 0.00 58.89 61.06 2j1k h TRP 460 Cb 0.28 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.35 2j1k h TRP 460 CO 0.00 0.21 0.42 -0.22 -3.56 0.00 0.00 178.44 175.30 2j1k h LYS 461 N 0.18 0.34 0.00 0.49 3.64 -1.48 -2.37 116.57 117.37 2j1k h LYS 461 Ca 0.04 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2j1k h LYS 461 Cb 0.16 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2j1k h LYS 461 CO 0.00 0.23 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.33 2j1k h LEU 462 N 0.35 0.00 -0.21 5.20 3.38 -1.48 -0.51 115.31 122.05 2j1k h LEU 462 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2j1k h LEU 462 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2j1k h LEU 462 CO -0.08 0.01 -0.10 0.00 0.09 0.00 0.00 178.44 178.36 2j1k s MET 464 N -2.49 3.93 -0.31 0.00 -1.94 -0.20 -4.88 119.30 113.41 2j1k s MET 464 Ca 0.28 0.66 -0.29 0.00 -1.71 0.00 0.00 55.69 54.64 2j1k s MET 464 Cb 0.20 -2.36 -0.01 0.00 2.01 0.00 0.00 34.83 34.67 2j1k s MET 464 CO 0.48 0.02 1.52 -1.25 -0.01 0.00 0.00 175.02 175.78 2j1k s PRO 465 N -3.44 3.68 -0.35 2.03 0.04 -1.26 0.87 135.00 136.56 2j1k s PRO 465 Ca 0.54 1.31 -0.32 0.00 0.04 0.00 0.00 61.00 62.57 2j1k s PRO 465 Cb -0.10 -4.03 -0.14 0.00 0.04 0.00 0.00 34.50 30.28 2j1k s PRO 465 CO 0.24 -1.44 1.32 -1.71 0.04 0.00 0.00 177.00 175.45 2j1k n ASN 466 N 8.70 0.69 0.14 6.66 2.85 -0.59 -4.69 115.26 129.01 2j1k n ASN 466 Ca 0.18 0.66 0.13 0.00 -0.11 0.00 0.00 54.58 55.44 2j1k n ASN 466 Cb 0.47 -0.63 0.43 0.00 1.24 0.00 0.00 39.78 41.29 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 4.95 0.00 0.19 1.20 0.11 -1.91 -0.14 114.38 118.78 2j1k h ARG 467 Ca -0.19 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.55 2j1k h ARG 467 Cb 0.98 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.08 2j1k h ARG 467 CO 0.73 0.00 -1.66 1.49 0.10 0.00 0.00 179.97 180.63 2j1k h GLU 468 N 0.00 0.41 -0.73 0.08 4.81 -1.98 -2.27 114.58 114.90 2j1k h GLU 468 Ca 0.00 -0.70 -0.03 0.00 -0.13 0.00 0.00 59.36 58.49 2j1k h GLU 468 Cb 0.63 0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.24 2j1k h GLU 468 CO 0.00 1.34 0.32 0.28 -0.73 0.00 0.00 179.01 180.22 2j1k h VAL 469 N 0.07 1.24 -1.77 0.32 2.07 -1.91 -3.29 116.25 112.98 2j1k h VAL 469 Ca -0.32 -0.72 -0.65 0.00 0.82 0.00 0.00 66.70 65.83 2j1k h VAL 469 Cb 2.08 0.37 -0.37 0.00 -1.52 0.00 0.00 31.29 31.84 2j1k h VAL 469 CO 0.19 0.30 -0.15 -1.22 0.02 0.00 0.00 177.57 176.71 2j1k n TYR 470 N -4.38 3.34 0.43 1.57 4.01 -0.08 -4.71 117.16 117.34 2j1k n TYR 470 Ca 0.06 -2.97 0.13 0.00 -0.16 0.00 0.00 57.90 54.95 2j1k n TYR 470 Cb 0.15 -0.48 0.30 0.00 -0.31 0.00 0.00 39.34 39.01 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 2.82 0.00 -3.30 7.72 4.64 -1.48 -3.42 113.55 120.52 2j1k h SER 471 Ca 0.37 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 61.07 2j1k h SER 471 Cb 0.60 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.51 2j1k h SER 471 CO 1.02 0.00 -0.81 0.42 -0.87 0.00 0.00 176.83 176.59 2j1k s THR 472 N -3.17 2.20 0.30 2.95 -4.23 -1.26 -5.08 115.64 107.35 2j1k s THR 472 Ca 0.09 -1.99 -0.30 0.00 -1.18 0.00 0.00 61.69 58.31 2j1k s THR 472 Cb 0.09 -2.04 -0.12 0.00 1.34 0.00 0.00 72.50 71.77 2j1k s THR 472 CO 0.63 -0.17 1.46 -2.65 -0.54 0.00 0.00 174.62 173.34 2j1k n PRO 473 N 0.29 2.36 -4.37 3.99 -0.02 -1.26 -4.96 135.00 131.03 2j1k n PRO 473 Ca -0.13 0.84 -0.23 0.00 -2.02 0.00 0.00 63.50 61.95 2j1k n PRO 473 Cb 0.56 -2.53 -0.08 0.00 -0.02 0.00 0.00 33.50 31.43 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 -0.39 3.00 0.03 3.55 0.00 -0.86 -4.97 121.76 122.12 2j1k s ALA 474 Ca 0.62 -1.75 -0.12 0.00 0.00 0.00 0.00 51.96 50.71 2j1k s ALA 474 Cb -0.56 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.02 2j1k s ALA 474 CO 0.54 0.27 0.26 0.00 0.00 0.00 0.00 175.76 176.82 2j1k s ALA 475 N -2.40 -0.58 -0.15 0.00 0.00 -1.26 0.27 121.76 117.63 2j1k s ALA 475 Ca 0.31 -0.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.23 2j1k s ALA 475 Cb -0.06 0.24 0.05 0.00 0.00 0.00 0.00 23.12 23.35 2j1k s ALA 475 CO 0.18 -0.35 0.01 0.99 0.00 0.00 0.00 175.76 176.59 2j1k s THR 476 N -2.18 0.56 -0.22 0.00 2.01 -0.41 -5.01 115.64 110.39 2j1k s THR 476 Ca -0.08 -0.33 -0.16 0.00 0.31 0.00 0.00 61.69 61.43 2j1k s THR 476 Cb -0.02 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 2j1k s THR 476 CO -0.01 0.01 0.42 -0.51 -0.69 0.00 0.00 174.62 173.84 2j1k s ILE 477 N 1.86 5.17 0.12 1.82 2.07 -1.26 -1.25 121.20 129.73 2j1k s ILE 477 Ca 0.01 0.73 0.06 0.00 -1.41 0.00 0.00 60.65 60.04 2j1k s ILE 477 Cb -0.15 -3.75 -0.04 0.00 0.13 0.00 0.00 42.46 38.65 2j1k s ILE 477 CO -0.07 0.20 -0.14 -0.44 -1.91 0.00 0.00 174.94 172.59 2j1k s SER 478 N 1.23 2.00 0.35 4.50 0.01 -0.25 -4.99 113.70 116.55 2j1k s SER 478 Ca 0.19 -0.82 -0.26 0.00 1.31 0.00 0.00 55.95 56.37 2j1k s SER 478 Cb -0.15 -0.07 -0.12 0.00 0.21 0.00 0.00 66.02 65.89 2j1k s SER 478 CO 0.09 -0.15 1.01 -1.14 0.41 0.00 0.00 173.24 173.46 2j1k n ARG 479 N 0.50 1.40 -3.59 12.44 0.63 -1.26 -0.76 116.66 126.01 2j1k n ARG 479 Ca -0.15 0.49 -0.29 0.00 -0.92 0.00 0.00 57.85 56.98 2j1k n ARG 479 Cb 0.57 -1.95 -0.12 0.00 0.45 0.00 0.00 32.46 31.41 2j1k n ARG 479 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j1k s GLY 481 N 0.67 2.80 -0.08 0.00 0.00 -1.26 -1.19 107.32 108.25 2j1k s GLY 481 Ca 0.18 1.54 0.01 0.00 0.00 0.00 0.00 44.72 46.45 2j1k s GLY 481 CO 0.00 2.27 -0.10 1.08 0.00 0.00 0.00 173.10 176.35 2j1k s LEU 482 N -1.77 2.95 -1.67 0.66 1.43 0.17 -0.84 118.68 119.61 2j1k s LEU 482 Ca 0.54 -0.15 -0.18 0.00 -1.03 0.00 0.00 54.13 53.32 2j1k s LEU 482 Cb -0.46 -1.64 0.14 0.00 0.03 0.00 0.00 46.19 44.26 2j1k s LEU 482 CO 0.59 0.30 0.84 -0.67 0.23 0.00 0.00 176.35 177.64 2j1k n ASP 483 N 2.66 -3.69 -0.04 2.29 2.03 0.51 -4.79 116.55 115.52 2j1k n ASP 483 Ca -0.18 -0.96 -0.00 0.00 0.52 0.00 0.00 54.79 54.18 2j1k n ASP 483 Cb 0.53 -3.03 0.29 0.00 -0.72 0.00 0.00 41.12 38.18 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 -1.64 0.57 0.38 1.67 0.02 -1.84 -0.72 113.55 111.99 2j1k h SER 484 Ca -0.59 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.25 2j1k h SER 484 Cb 1.38 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2j1k h SER 484 CO 0.76 0.58 -0.18 0.40 -1.14 0.00 0.00 176.83 177.25 2j1k h ILE 485 N 0.60 0.58 -0.68 3.27 2.04 -1.95 0.34 117.51 121.71 2j1k h ILE 485 Ca 0.14 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 2j1k h ILE 485 Cb 0.25 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2j1k h ILE 485 CO -0.00 0.09 0.35 0.00 0.00 0.00 0.00 178.15 178.58 2j1k h ALA 486 N -0.35 0.88 -0.15 1.87 0.00 -1.84 -1.55 119.26 118.13 2j1k h ALA 486 Ca -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2j1k h ALA 486 Cb 0.53 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2j1k h ALA 486 CO 0.08 0.43 0.00 1.33 0.00 0.00 0.00 179.25 181.09 2j1k n VAL 487 N -4.47 0.20 -4.02 0.00 0.24 -0.32 -4.94 118.33 105.02 2j1k n VAL 487 Ca 0.05 -0.27 -0.30 0.00 -2.04 0.00 0.00 64.34 61.79 2j1k n VAL 487 Cb 0.12 0.17 -0.01 0.00 -1.47 0.00 0.00 33.84 32.64 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 0.05 -2.12 -1.96 -1.34 2.03 -0.42 -2.20 116.55 110.58 2j1k n ASP 488 Ca 0.13 -0.96 -0.19 0.00 0.52 0.00 0.00 54.79 54.30 2j1k n ASP 488 Cb 0.24 -3.17 -0.03 0.00 -0.72 0.00 0.00 41.12 37.44 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 -1.71 0.22 3.62 0.27 0.00 0.11 -4.93 105.19 102.77 2j1k n GLY 489 Ca -0.12 -0.10 -0.50 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.99 -0.05 0.18 4.61 0.00 -0.94 -4.83 120.51 118.49 2j1k n ALA 490 Ca -0.21 0.48 0.15 0.00 0.00 0.00 0.00 53.44 53.86 2j1k n ALA 490 Cb 0.66 -2.19 0.74 0.00 0.00 0.00 0.00 19.45 18.66 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 5.21 0.00 -0.71 0.00 0.11 -1.92 -1.13 132.00 133.56 2j1k h PRO 491 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2j1k h PRO 491 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2j1k h PRO 491 CO 0.83 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.49 2j1k n SER 492 N -4.19 2.26 -0.23 -2.05 3.41 -1.26 -3.74 113.62 107.82 2j1k n SER 492 Ca 0.02 -2.23 0.08 0.00 -0.26 0.00 0.00 58.87 56.48 2j1k n SER 492 Cb 0.30 -0.46 0.15 0.00 -0.26 0.00 0.00 64.21 63.93 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 0.21 1.83 -4.44 4.33 5.12 -0.43 -1.85 116.66 121.43 2j1k n ARG 493 Ca 0.09 -2.48 -0.34 0.00 -1.93 0.00 0.00 57.85 53.19 2j1k n ARG 493 Cb 0.48 -1.50 -0.10 0.00 -1.16 0.00 0.00 32.46 30.18 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 -2.43 4.94 0.00 0.55 0.01 -1.25 -0.66 113.70 114.86 2j1k s SER 494 Ca 0.30 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2j1k s SER 494 Cb 0.25 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 65.20 2j1k s SER 494 CO 0.04 0.33 0.00 2.30 0.41 0.00 0.00 173.24 176.33 2j1k n ILE 495 N 1.89 0.00 -4.28 1.44 -5.35 -0.34 -4.41 119.36 108.32 2j1k n ILE 495 Ca -0.17 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.01 2j1k n ILE 495 Cb 0.53 -0.39 -0.10 0.00 -1.74 0.00 0.00 39.64 37.94 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 -0.71 4.43 -0.10 7.28 1.01 -0.49 -0.42 116.67 127.68 2j1k s ASP 496 Ca 0.00 -0.35 0.02 0.00 0.71 0.00 0.00 52.55 52.93 2j1k s ASP 496 Cb 0.00 -0.88 0.01 0.00 1.01 0.00 0.00 42.92 43.07 2j1k s ASP 496 CO 0.00 0.19 -0.15 0.00 0.21 0.00 0.00 175.17 175.42 2j1k s MET 498 N 0.92 3.56 -0.16 0.00 1.75 0.15 -1.09 119.30 124.43 2j1k s MET 498 Ca -0.08 -0.55 -0.27 0.00 -1.25 0.00 0.00 55.69 53.54 2j1k s MET 498 Cb -0.15 -3.05 -0.01 0.00 2.84 0.00 0.00 34.83 34.45 2j1k s MET 498 CO -0.00 -0.03 0.89 -1.17 -0.65 0.00 0.00 175.02 174.06 2j1k s LEU 499 N 1.09 4.19 -0.19 4.11 2.96 -0.38 -0.81 118.68 129.65 2j1k s LEU 499 Ca 0.02 1.28 -0.07 0.00 -0.22 0.00 0.00 54.13 55.14 2j1k s LEU 499 Cb -0.14 -3.34 -0.04 0.00 0.50 0.00 0.00 46.19 43.17 2j1k s LEU 499 CO 0.01 -0.43 0.05 -0.63 -1.32 0.00 0.00 176.35 174.02 2j1k s ILE 500 N 2.19 4.53 -0.27 6.68 1.01 -0.25 -1.29 121.20 133.81 2j1k s ILE 500 Ca 0.41 -0.12 -0.10 0.00 0.00 0.00 0.00 60.65 60.84 2j1k s ILE 500 Cb -0.17 -3.05 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 2j1k s ILE 500 CO 0.13 0.44 0.16 -0.63 0.00 0.00 0.00 174.94 175.04 2j1k s ILE 501 N 0.64 5.10 -1.46 2.92 1.01 0.14 -1.40 121.20 128.14 2j1k s ILE 501 Ca 0.02 0.10 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 2j1k s ILE 501 Cb -0.13 -3.41 0.03 0.00 0.01 0.00 0.00 42.46 38.95 2j1k s ILE 501 CO 0.02 0.28 0.83 0.59 0.00 0.00 0.00 174.94 176.66 2j1k n ASN 502 N 4.94 -5.67 -4.68 3.58 3.02 0.66 -2.02 115.26 115.10 2j1k n ASN 502 Ca -0.15 -0.46 -0.42 0.00 -0.03 0.00 0.00 54.58 53.52 2j1k n ASN 502 Cb 0.52 -4.54 -0.03 0.00 -0.61 0.00 0.00 39.78 35.12 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 -6.09 4.23 0.43 3.52 2.20 -1.26 -4.25 119.74 118.52 2j1k s LYS 503 Ca 0.47 2.12 -0.26 0.00 -0.36 0.00 0.00 55.97 57.93 2j1k s LYS 503 Cb -0.22 -3.69 -0.09 0.00 -1.51 0.00 0.00 37.83 32.32 2j1k s LYS 503 CO 0.57 -0.69 1.40 -2.30 -0.36 0.00 0.00 175.35 173.97 2j1k n PRO 504 N 5.92 2.24 -3.36 4.03 -0.02 -1.26 -4.70 135.00 137.85 2j1k n PRO 504 Ca 0.15 0.80 -0.12 0.00 -2.02 0.00 0.00 63.50 62.30 2j1k n PRO 504 Cb 0.43 -2.57 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 2j1k n PRO 504 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2j1k s LYS 505 N -2.32 0.35 5.20 -0.52 2.47 -1.26 -5.11 119.74 118.55 2j1k s LYS 505 Ca 0.60 0.13 0.00 0.00 -1.56 0.00 0.00 55.97 55.14 2j1k s LYS 505 Cb -0.47 -0.53 0.00 0.00 -1.46 0.00 0.00 37.83 35.37 2j1k s LYS 505 CO 0.59 -0.92 0.00 0.41 0.16 0.00 0.00 175.35 175.58 2j1k n GLY 506 N 5.34 3.48 0.80 5.54 0.00 -1.26 -1.88 105.19 117.20 2j1k n GLY 506 Ca -0.02 0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 0.12 -1.82 1.61 0.24 -1.26 -4.97 118.33 112.25 2j1k n VAL 507 Ca 0.00 -0.45 -0.40 0.00 -2.04 0.00 0.00 64.34 61.45 2j1k n VAL 507 Cb 0.00 0.95 0.01 0.00 -1.47 0.00 0.00 33.84 33.33 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 -1.88 3.38 -0.02 2.33 0.00 -0.79 -4.94 121.76 119.85 2j1k s ALA 508 Ca 0.33 1.49 -0.02 0.00 0.00 0.00 0.00 51.96 53.76 2j1k s ALA 508 Cb 0.20 -3.59 -0.27 0.00 0.00 0.00 0.00 23.12 19.46 2j1k s ALA 508 CO 0.31 -1.11 0.76 1.15 0.00 0.00 0.00 175.76 176.87 2j1k h THR 509 N 2.59 1.04 -4.03 0.00 2.02 -1.44 -3.43 112.91 109.66 2j1k h THR 509 Ca -0.51 -2.71 -0.44 0.00 0.77 0.00 0.00 66.41 63.52 2j1k h THR 509 Cb 1.25 2.69 -0.24 0.00 -1.74 0.00 0.00 68.15 70.11 2j1k h THR 509 CO 0.62 0.80 -0.79 -0.31 0.37 0.00 0.00 175.52 176.21 2j1k s TYR 510 N -2.60 1.23 0.02 3.16 2.02 -0.64 -5.00 117.35 115.53 2j1k s TYR 510 Ca -0.11 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 2j1k s TYR 510 Cb 0.07 -0.73 -0.01 0.00 -0.40 0.00 0.00 41.96 40.89 2j1k s TYR 510 CO 0.84 0.04 -0.05 0.95 -1.57 0.00 0.00 175.55 175.75 2j1k s THR 511 N -0.90 0.36 -0.11 -0.71 -4.23 -1.26 -0.74 115.64 108.05 2j1k s THR 511 Ca 0.01 -0.69 -0.00 0.00 -1.18 0.00 0.00 61.69 59.83 2j1k s THR 511 Cb -0.08 -0.40 0.02 0.00 1.34 0.00 0.00 72.50 73.38 2j1k s THR 511 CO 0.01 -0.22 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.04 2j1k s LEU 512 N -0.97 1.19 -0.14 4.79 1.43 -0.63 -0.24 118.68 124.11 2j1k s LEU 512 Ca -0.07 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 52.73 2j1k s LEU 512 Cb -0.07 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 2j1k s LEU 512 CO -0.00 -0.11 -0.14 -0.89 0.23 0.00 0.00 176.35 175.44 2j1k s THR 513 N 1.67 2.92 -0.46 5.49 2.01 -0.49 -0.27 115.64 126.51 2j1k s THR 513 Ca 0.04 -0.70 -0.16 0.00 0.31 0.00 0.00 61.69 61.18 2j1k s THR 513 Cb -0.13 -2.23 0.05 0.00 0.01 0.00 0.00 72.50 70.20 2j1k s THR 513 CO -0.08 0.52 0.44 -0.36 -0.69 0.00 0.00 174.62 174.45 2j1k s PHE 514 N 0.55 3.19 -0.28 4.92 0.08 -0.30 -1.09 117.98 125.05 2j1k s PHE 514 Ca -0.09 -0.71 -0.08 0.00 0.12 0.00 0.00 56.93 56.17 2j1k s PHE 514 Cb -0.16 -3.12 -0.02 0.00 -0.57 0.00 0.00 43.02 39.15 2j1k s PHE 514 CO 0.04 -0.80 0.10 0.50 -0.10 0.00 0.00 175.22 174.96 2j1k s ARG 515 N 1.94 3.49 -0.24 0.44 3.52 0.01 -0.50 118.95 127.61 2j1k s ARG 515 Ca 0.08 -0.60 -0.13 0.00 -0.13 0.00 0.00 55.73 54.94 2j1k s ARG 515 Cb -0.21 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.71 2j1k s ARG 515 CO 0.09 -0.30 0.29 -0.06 -0.81 0.00 0.00 175.30 174.51 2j1k s PHE 516 N 1.61 3.30 0.09 5.12 0.08 0.38 -0.67 117.98 127.89 2j1k s PHE 516 Ca 0.05 0.38 0.02 0.00 0.12 0.00 0.00 56.93 57.50 2j1k s PHE 516 Cb -0.16 -2.44 -0.04 0.00 -0.57 0.00 0.00 43.02 39.82 2j1k s PHE 516 CO 0.05 -0.06 -0.08 -0.51 -0.10 0.00 0.00 175.22 174.52 2j1k s LEU 517 N 1.47 2.44 -1.28 -0.37 1.43 -0.49 -2.32 118.68 119.57 2j1k s LEU 517 Ca 0.13 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.31 2j1k s LEU 517 Cb -0.15 -0.15 0.01 0.00 0.03 0.00 0.00 46.19 45.93 2j1k s LEU 517 CO 0.08 -0.37 1.03 0.59 0.23 0.00 0.00 176.35 177.91 2j1k n ASN 518 N 0.35 -3.49 0.27 2.29 3.02 -1.26 -1.39 115.26 115.05 2j1k n ASN 518 Ca -0.15 -0.62 0.13 0.00 -0.03 0.00 0.00 54.58 53.91 2j1k n ASN 518 Cb 0.59 -4.94 0.78 0.00 -0.61 0.00 0.00 39.78 35.60 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 -2.17 0.00 0.00 3.10 0.04 -1.83 -2.41 116.94 113.67 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 1.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.50 2j1k h PHE 519 CO 0.47 0.08 0.00 0.27 -0.60 0.00 0.00 178.31 178.53 2j1k n ASN 520 N -3.73 0.00 0.22 2.17 0.23 -1.04 -1.26 115.26 111.86 2j1k n ASN 520 Ca -0.02 -0.17 0.09 0.00 -0.53 0.00 0.00 54.58 53.94 2j1k n ASN 520 Cb 0.19 -0.15 0.52 0.00 -2.08 0.00 0.00 39.78 38.26 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 -6.81 -3.83 2.47 -1.71 -3.46 114.38 101.03 2j1k h ARG 521 Ca 0.00 0.00 -0.52 0.00 -1.26 0.00 0.00 59.98 58.20 2j1k h ARG 521 Cb 0.07 0.00 0.05 0.00 -1.65 0.00 0.00 29.97 28.45 2j1k h ARG 521 CO 0.00 0.24 0.64 -0.51 0.56 0.00 0.00 179.97 180.89 2j1k s LEU 522 N -7.28 4.44 0.33 3.04 1.43 -0.39 -4.71 118.68 115.54 2j1k s LEU 522 Ca -0.01 2.58 0.14 0.00 -1.03 0.00 0.00 54.13 55.80 2j1k s LEU 522 Cb 0.12 -3.64 0.56 0.00 0.03 0.00 0.00 46.19 43.27 2j1k s LEU 522 CO 0.64 -0.51 1.70 0.77 0.23 0.00 0.00 176.35 179.19 2j1k h SER 523 N 4.04 0.00 -0.83 2.29 4.64 -1.70 -3.42 113.55 118.58 2j1k h SER 523 Ca -0.47 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 60.93 2j1k h SER 523 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 2j1k h SER 523 CO 0.69 0.48 0.24 0.61 -0.87 0.00 0.00 176.83 177.99 2j1k n GLY 524 N 0.09 0.65 3.68 -0.77 0.00 -1.26 -4.96 105.19 102.62 2j1k n GLY 524 Ca -0.01 -0.92 -0.47 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.25 1.42 3.04 -0.02 0.00 -1.26 -4.46 105.19 103.66 2j1k n GLY 525 Ca 0.01 0.79 -0.21 0.00 0.00 0.00 0.00 46.02 46.60 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 3.07 0.93 0.13 2.61 2.01 0.28 -4.95 115.64 119.72 2j1k s THR 526 Ca 0.87 -0.46 -0.32 0.00 0.31 0.00 0.00 61.69 62.09 2j1k s THR 526 Cb -0.65 -0.81 -0.12 0.00 0.01 0.00 0.00 72.50 70.94 2j1k s THR 526 CO 0.45 0.28 1.77 -0.11 -0.69 0.00 0.00 174.62 176.33 2j1k n LEU 527 N 3.13 3.84 -3.52 4.42 7.94 -1.26 -0.63 117.00 130.92 2j1k n LEU 527 Ca -0.17 1.02 -0.40 0.00 -1.11 0.00 0.00 56.01 55.34 2j1k n LEU 527 Cb 0.54 -1.52 -0.01 0.00 0.53 0.00 0.00 43.42 42.96 2j1k n LEU 527 CO 0.25 0.09 2.95 0.33 -1.11 0.00 0.00 177.39 179.89 2j1k n PHE 528 N 4.98 2.87 -3.92 1.96 7.35 0.34 -3.81 117.46 127.23 2j1k n PHE 528 Ca 0.18 -3.01 -0.31 0.00 -0.76 0.00 0.00 57.45 53.55 2j1k n PHE 528 Cb 0.35 -2.41 -0.13 0.00 0.35 0.00 0.00 39.48 37.63 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 2.05 1.99 0.63 -4.13 2.20 -1.26 -0.34 119.74 120.88 2j1k s LYS 529 Ca 0.58 -2.44 -0.14 0.00 -0.36 0.00 0.00 55.97 53.60 2j1k s LYS 529 Cb 0.16 -3.38 -0.02 0.00 -1.51 0.00 0.00 37.83 33.08 2j1k s LYS 529 CO -0.07 -1.09 1.06 0.95 -0.36 0.00 0.00 175.35 175.85 2j1k s THR 530 N 0.02 3.78 1.07 3.43 -4.23 -0.20 -0.36 115.64 119.14 2j1k s THR 530 Ca 0.16 0.77 -0.12 0.00 -1.18 0.00 0.00 61.69 61.31 2j1k s THR 530 Cb -0.24 -3.34 0.20 0.00 1.34 0.00 0.00 72.50 70.47 2j1k s THR 530 CO -0.02 -0.57 0.89 0.47 -0.54 0.00 0.00 174.62 174.86 2j1k n ASP 531 N -2.36 -1.15 -4.64 3.99 9.92 -0.02 -4.55 116.55 117.75 2j1k n ASP 531 Ca 0.09 0.08 -0.43 0.00 -0.53 0.00 0.00 54.79 54.00 2j1k n ASP 531 Cb 0.53 -1.30 -0.02 0.00 -0.64 0.00 0.00 41.12 39.69 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 -2.46 4.17 -0.12 2.53 1.01 -1.26 -4.50 120.40 119.77 2j1k s VAL 532 Ca 0.66 1.35 -0.06 0.00 0.00 0.00 0.00 61.98 63.93 2j1k s VAL 532 Cb -0.23 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2j1k s VAL 532 CO 0.63 -0.35 0.11 -0.76 0.00 0.00 0.00 175.10 174.73 2j1k s LEU 533 N 4.11 4.18 -0.05 3.92 1.43 0.10 -4.94 118.68 127.44 2j1k s LEU 533 Ca 0.56 0.37 0.04 0.00 -1.03 0.00 0.00 54.13 54.08 2j1k s LEU 533 Cb -0.19 -2.01 -0.00 0.00 0.03 0.00 0.00 46.19 44.02 2j1k s LEU 533 CO 0.20 0.38 -0.18 -0.89 0.23 0.00 0.00 176.35 176.09 2j1k s THR 534 N -0.87 1.52 0.15 5.49 2.01 -1.26 -1.43 115.64 121.25 2j1k s THR 534 Ca 0.14 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.38 2j1k s THR 534 Cb -0.12 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 2j1k s THR 534 CO 0.03 0.43 0.02 -0.36 -0.69 0.00 0.00 174.62 174.06 2j1k s PHE 535 N 0.04 1.01 -0.02 4.92 0.08 -0.50 -4.99 117.98 118.52 2j1k s PHE 535 Ca -0.05 -1.12 -0.02 0.00 0.12 0.00 0.00 56.93 55.87 2j1k s PHE 535 Cb -0.12 -0.58 0.01 0.00 -0.57 0.00 0.00 43.02 41.76 2j1k s PHE 535 CO 0.03 -0.36 0.06 0.99 -0.10 0.00 0.00 175.22 175.84 2j1k s THR 536 N -3.85 -0.01 0.12 0.64 2.01 -1.26 0.14 115.64 113.44 2j1k s THR 536 Ca 0.23 0.03 -0.07 0.00 0.31 0.00 0.00 61.69 62.19 2j1k s THR 536 Cb 0.07 -0.10 -0.01 0.00 0.01 0.00 0.00 72.50 72.47 2j1k s THR 536 CO 0.02 0.01 0.19 -0.72 -0.69 0.00 0.00 174.62 173.43 2j1k s TYR 537 N 0.19 0.40 0.10 4.92 -0.85 -0.77 -5.00 117.35 116.33 2j1k s TYR 537 Ca -0.01 -0.80 -0.31 0.00 -0.52 0.00 0.00 57.07 55.43 2j1k s TYR 537 Cb -0.02 -0.15 -0.07 0.00 0.38 0.00 0.00 41.96 42.10 2j1k s TYR 537 CO -0.01 -0.60 1.28 0.08 -1.52 0.00 0.00 175.55 174.78 2j1k s VAL 538 N -3.94 3.68 0.49 -3.49 1.01 -1.26 -0.63 120.40 116.25 2j1k s VAL 538 Ca 0.13 1.22 -0.20 0.00 0.00 0.00 0.00 61.98 63.13 2j1k s VAL 538 Cb 0.05 -3.78 -0.08 0.00 0.00 0.00 0.00 36.38 32.56 2j1k s VAL 538 CO -0.04 0.11 1.04 -0.83 0.00 0.00 0.00 175.10 175.38 2j1k s GLY 539 N 0.98 2.50 0.78 4.51 0.00 0.22 -1.55 107.32 114.77 2j1k s GLY 539 Ca 0.61 0.61 -0.13 0.00 0.00 0.00 0.00 44.72 45.81 2j1k s GLY 539 CO 0.30 0.93 1.17 1.85 0.00 0.00 0.00 173.10 177.35 2j1k s GLU 540 N -3.26 1.92 0.16 2.90 2.56 0.25 -4.18 118.70 119.06 2j1k s GLU 540 Ca 0.67 1.59 -0.11 0.00 0.00 0.00 0.00 54.97 57.13 2j1k s GLU 540 Cb -0.17 -1.83 -0.07 0.00 2.00 0.00 0.00 34.13 34.07 2j1k s GLU 540 CO 0.21 -1.97 0.50 -0.80 -0.56 0.00 0.00 175.26 172.64 2j1k s ASN 541 N -2.43 6.68 0.00 -1.70 0.01 -1.26 -4.51 114.94 111.73 2j1k s ASN 541 Ca 0.70 0.91 0.05 0.00 -0.71 0.00 0.00 52.86 53.81 2j1k s ASN 541 Cb -0.25 -2.22 0.31 0.00 0.41 0.00 0.00 41.25 39.50 2j1k s ASN 541 CO 0.50 0.04 0.78 1.67 -1.51 0.00 0.00 177.10 178.58