#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 2.64 -0.22 0.00 0.04 -1.26 -4.93 135.00 131.27 2j1k s PRO 362 Ca 0.00 1.10 -0.15 0.00 0.04 0.00 0.00 61.00 61.98 2j1k s PRO 362 Cb 0.00 -1.95 0.07 0.00 0.04 0.00 0.00 34.50 32.66 2j1k s PRO 362 CO 0.00 -1.34 0.57 -1.50 0.04 0.00 0.00 177.00 174.77 2j1k s ILE 363 N -2.90 -0.01 -0.12 0.56 -1.16 -0.71 -5.02 121.20 111.84 2j1k s ILE 363 Ca 0.60 0.03 0.01 0.00 -0.51 0.00 0.00 60.65 60.78 2j1k s ILE 363 Cb -0.16 -0.81 -0.01 0.00 0.61 0.00 0.00 42.46 42.09 2j1k s ILE 363 CO 0.53 0.01 -0.15 -0.89 -2.81 0.00 0.00 174.94 171.63 2j1k s THR 364 N 1.11 2.83 -0.11 4.00 2.01 -1.26 -0.44 115.64 123.78 2j1k s THR 364 Ca -0.06 -0.74 -0.01 0.00 0.31 0.00 0.00 61.69 61.19 2j1k s THR 364 Cb -0.06 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 2j1k s THR 364 CO -0.11 0.53 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.51 2j1k s LEU 365 N 0.37 3.05 0.34 4.42 1.43 -0.07 -0.67 118.68 127.55 2j1k s LEU 365 Ca -0.12 -0.14 -0.14 0.00 -1.03 0.00 0.00 54.13 52.69 2j1k s LEU 365 Cb -0.16 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.40 2j1k s LEU 365 CO 0.06 0.25 0.69 -1.66 0.23 0.00 0.00 176.35 175.92 2j1k s TRP 366 N -0.15 0.27 -0.96 0.29 1.48 0.12 -0.34 118.94 119.65 2j1k s TRP 366 Ca 0.01 -0.79 0.26 0.00 -1.06 0.00 0.00 56.10 54.53 2j1k s TRP 366 Cb -0.13 0.58 0.76 0.00 -1.16 0.00 0.00 33.47 33.51 2j1k s TRP 366 CO 0.03 -1.37 1.60 0.25 -4.06 0.00 0.00 176.95 173.39 2j1k n THR 367 N -0.51 0.05 0.00 0.66 -2.24 -0.89 -1.93 114.28 109.42 2j1k n THR 367 Ca -0.05 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2j1k n THR 367 Cb 0.60 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 1.48 -1.09 3.86 3.38 0.00 -1.26 -4.69 105.19 106.87 2j1k n GLY 368 Ca 0.06 -1.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.11 3.08 -1.16 1.61 0.04 -1.26 -4.04 135.00 131.16 2j1k s PRO 369 Ca 0.00 0.68 -0.05 0.00 0.04 0.00 0.00 61.00 61.66 2j1k s PRO 369 Cb 0.00 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2j1k s PRO 369 CO 0.00 -0.93 0.88 0.41 0.04 0.00 0.00 177.00 177.40 2j1k n GLY 370 N -2.63 -0.74 3.74 0.56 0.00 -1.26 -4.90 105.19 99.95 2j1k n GLY 370 Ca 0.07 0.34 -0.36 0.00 0.00 0.00 0.00 46.02 46.07 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 -5.20 2.77 0.99 1.61 0.04 -1.26 -5.01 135.00 128.95 2j1k s PRO 371 Ca 0.24 1.89 -0.12 0.00 0.04 0.00 0.00 61.00 63.05 2j1k s PRO 371 Cb -0.05 -1.89 0.18 0.00 0.04 0.00 0.00 34.50 32.78 2j1k s PRO 371 CO 0.77 -1.38 1.10 -1.12 0.04 0.00 0.00 177.00 176.41 2j1k s SER 372 N -1.57 2.73 -0.47 6.66 0.01 -1.26 -4.82 113.70 114.98 2j1k s SER 372 Ca 0.79 1.15 -0.28 0.00 1.31 0.00 0.00 55.95 58.92 2j1k s SER 372 Cb -0.33 -1.80 -0.00 0.00 0.21 0.00 0.00 66.02 64.10 2j1k s SER 372 CO 0.36 -3.06 1.61 -0.63 0.41 0.00 0.00 173.24 171.93 2j1k s ILE 373 N -3.02 3.64 0.00 1.44 1.01 -1.26 -3.83 121.20 119.18 2j1k s ILE 373 Ca 0.65 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.89 2j1k s ILE 373 Cb -0.18 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.22 2j1k s ILE 373 CO 0.57 -0.82 0.43 -0.46 0.00 0.00 0.00 174.94 174.66 2j1k n ASN 374 N 10.22 0.57 -4.26 3.58 0.23 -0.61 -4.85 115.26 120.12 2j1k n ASN 374 Ca 0.18 -1.18 -0.37 0.00 -0.53 0.00 0.00 54.58 52.68 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 -0.18 1.82 -0.07 4.83 0.00 -0.16 -4.16 107.32 109.41 2j1k s GLY 375 Ca 0.00 -1.73 -0.24 0.00 0.00 0.00 0.00 44.72 42.75 2j1k s GLY 375 CO 0.00 0.75 0.74 -1.36 0.00 0.00 0.00 173.10 173.23 2j1k s PHE 376 N 1.38 3.57 -0.13 1.90 0.08 0.24 -0.66 117.98 124.37 2j1k s PHE 376 Ca -0.02 1.29 0.02 0.00 0.12 0.00 0.00 56.93 58.34 2j1k s PHE 376 Cb -0.19 -2.85 0.01 0.00 -0.57 0.00 0.00 43.02 39.42 2j1k s PHE 376 CO 0.02 0.06 -0.19 0.42 -0.10 0.00 0.00 175.22 175.43 2j1k s ILE 377 N 0.91 1.80 -1.44 0.64 1.01 -0.78 -4.77 121.20 118.57 2j1k s ILE 377 Ca 0.39 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 2j1k s ILE 377 Cb -0.18 -1.61 0.03 0.00 0.01 0.00 0.00 42.46 40.71 2j1k s ILE 377 CO 0.19 0.50 0.62 0.59 0.00 0.00 0.00 174.94 176.84 2j1k n ASN 378 N 4.17 -1.58 -0.15 3.58 3.02 -1.26 -2.51 115.26 120.52 2j1k n ASN 378 Ca -0.19 -0.92 -0.02 0.00 -0.03 0.00 0.00 54.58 53.41 2j1k n ASN 378 Cb 0.51 -3.40 -0.01 0.00 -0.61 0.00 0.00 39.78 36.27 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 -2.94 -4.24 -4.11 6.41 8.00 -1.26 -5.00 116.55 113.40 2j1k n ASP 379 Ca -0.21 0.05 -0.28 0.00 0.71 0.00 0.00 54.79 55.06 2j1k n ASP 379 Cb 0.64 -1.91 -0.17 0.00 -0.02 0.00 0.00 41.12 39.66 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 -1.74 1.56 -0.26 -3.53 2.01 -1.05 -5.09 115.64 107.54 2j1k s THR 380 Ca 0.00 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 60.98 2j1k s THR 380 Cb 0.00 -1.38 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 2j1k s THR 380 CO 0.00 0.45 1.39 -2.16 -0.69 0.00 0.00 174.62 173.61 2j1k s PRO 381 N 0.50 3.91 0.00 4.92 0.04 -1.26 -1.86 135.00 141.25 2j1k s PRO 381 Ca -0.16 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.29 2j1k s PRO 381 Cb -0.17 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.46 2j1k s PRO 381 CO 0.06 -1.13 0.00 1.33 0.04 0.00 0.00 177.00 177.30 2j1k n VAL 382 N 6.19 0.00 -5.07 -0.36 0.24 0.17 -4.91 118.33 114.58 2j1k n VAL 382 Ca 0.16 -0.25 -0.32 0.00 -2.04 0.00 0.00 64.34 61.89 2j1k n VAL 382 Cb 0.46 0.80 -0.16 0.00 -1.47 0.00 0.00 33.84 33.47 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 -0.93 2.34 -0.50 1.34 -1.09 -0.83 -0.53 121.20 120.99 2j1k s ILE 383 Ca 0.00 -0.92 -0.21 0.00 -2.23 0.00 0.00 60.65 57.29 2j1k s ILE 383 Cb 0.00 -1.92 0.04 0.00 -1.58 0.00 0.00 42.46 39.00 2j1k s ILE 383 CO 0.00 0.55 0.73 -0.60 -1.23 0.00 0.00 174.94 174.39 2j1k s ARG 384 N 0.37 3.23 -0.30 2.79 3.52 0.43 -0.99 118.95 127.99 2j1k s ARG 384 Ca -0.16 -0.56 -0.07 0.00 -0.13 0.00 0.00 55.73 54.81 2j1k s ARG 384 Cb -0.17 -4.05 0.01 0.00 -1.56 0.00 0.00 34.95 29.18 2j1k s ARG 384 CO 0.08 -1.26 0.09 0.00 -0.81 0.00 0.00 175.30 173.40 2j1k s PHE 386 N 1.49 3.33 -0.04 0.00 5.36 0.46 -4.79 117.98 123.80 2j1k s PHE 386 Ca 0.02 0.94 0.01 0.00 -0.96 0.00 0.00 56.93 56.95 2j1k s PHE 386 Cb -0.18 -2.87 0.02 0.00 -0.34 0.00 0.00 43.02 39.65 2j1k s PHE 386 CO 0.03 -0.28 -0.05 0.42 -1.46 0.00 0.00 175.22 173.88 2j1k s ILE 387 N 2.32 0.53 -0.12 3.12 1.01 -1.26 -0.95 121.20 125.84 2j1k s ILE 387 Ca 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 60.65 60.77 2j1k s ILE 387 Cb -0.16 -0.53 0.04 0.00 0.01 0.00 0.00 42.46 41.82 2j1k s ILE 387 CO 0.09 0.21 -0.00 0.00 0.00 0.00 0.00 174.94 175.24 2j1k s LEU 389 N 1.88 5.37 -0.25 0.00 1.43 0.54 -0.62 118.68 127.03 2j1k s LEU 389 Ca 0.03 -1.53 -0.05 0.00 -1.03 0.00 0.00 54.13 51.55 2j1k s LEU 389 Cb -0.14 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 2j1k s LEU 389 CO -0.07 -0.59 0.02 -0.89 0.23 0.00 0.00 176.35 175.05 2j1k s THR 390 N 1.47 3.75 -0.28 5.49 2.01 -0.44 -0.90 115.64 126.74 2j1k s THR 390 Ca 0.04 -0.51 -0.12 0.00 0.31 0.00 0.00 61.69 61.40 2j1k s THR 390 Cb -0.24 -2.80 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2j1k s THR 390 CO 0.03 0.28 0.24 -0.60 -0.69 0.00 0.00 174.62 173.88 2j1k s ARG 391 N 1.51 3.92 0.00 4.92 6.06 0.42 -0.57 118.95 135.20 2j1k s ARG 391 Ca 0.05 -0.27 0.00 0.00 -2.50 0.00 0.00 55.73 53.01 2j1k s ARG 391 Cb -0.16 -3.67 0.00 0.00 0.06 0.00 0.00 34.95 31.18 2j1k s ARG 391 CO 0.00 -0.23 0.00 -0.25 -2.50 0.00 0.00 175.30 172.32 2j1k n ASP 392 N 5.13 0.00 -0.13 -2.12 8.00 -1.01 -1.73 116.55 124.70 2j1k n ASP 392 Ca -0.13 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.28 2j1k n ASP 392 Cb 0.51 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.60 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 0.53 0.00 -2.24 4.64 -1.97 -3.43 113.55 111.08 2j1k h SER 393 Ca 0.00 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2j1k h SER 393 Cb 0.00 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 2j1k h SER 393 CO 0.00 0.57 -0.21 -3.20 -0.87 0.00 0.00 176.83 173.12 2j1k n ASN 394 N -4.65 0.55 -4.90 4.97 5.15 -1.26 -5.04 115.26 110.08 2j1k n ASN 394 Ca -0.01 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.68 2j1k n ASN 394 Cb 0.16 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.37 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 -4.07 4.14 -0.16 1.20 1.43 -1.26 -0.35 118.68 119.61 2j1k s LEU 395 Ca 0.00 0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 53.72 2j1k s LEU 395 Cb 0.00 -3.44 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 2j1k s LEU 395 CO 0.00 -0.11 -0.02 -0.69 0.23 0.00 0.00 176.35 175.77 2j1k s VAL 396 N -1.93 4.08 -0.22 -1.59 1.01 0.75 -2.40 120.40 120.10 2j1k s VAL 396 Ca 0.43 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.03 2j1k s VAL 396 Cb -0.11 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 2j1k s VAL 396 CO 0.28 0.49 0.12 -0.89 0.00 0.00 0.00 175.10 175.09 2j1k s THR 397 N 0.36 5.07 -0.26 3.92 2.01 0.26 -1.53 115.64 125.47 2j1k s THR 397 Ca -0.03 0.07 -0.16 0.00 0.31 0.00 0.00 61.69 61.88 2j1k s THR 397 Cb -0.14 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 2j1k s THR 397 CO 0.02 0.38 0.44 -0.69 -0.69 0.00 0.00 174.62 174.09 2j1k s VAL 398 N 0.92 5.13 -0.19 3.82 1.01 0.14 -1.33 120.40 129.90 2j1k s VAL 398 Ca 0.06 0.73 0.01 0.00 0.00 0.00 0.00 61.98 62.79 2j1k s VAL 398 Cb -0.13 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.52 2j1k s VAL 398 CO 0.03 0.14 -0.15 0.21 0.00 0.00 0.00 175.10 175.32 2j1k s ASN 399 N 1.52 3.35 0.01 3.32 3.84 0.21 -1.09 114.94 126.10 2j1k s ASN 399 Ca 0.18 -0.81 -0.08 0.00 0.21 0.00 0.00 52.86 52.37 2j1k s ASN 399 Cb -0.16 -1.39 0.00 0.00 -0.55 0.00 0.00 41.25 39.15 2j1k s ASN 399 CO 0.09 -0.07 0.15 0.00 -2.79 0.00 0.00 177.10 174.48 2j1k s ALA 400 N 1.31 -0.33 0.03 1.71 0.00 -0.11 -0.81 121.76 123.57 2j1k s ALA 400 Ca 0.01 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 51.68 2j1k s ALA 400 Cb -0.15 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.13 2j1k s ALA 400 CO -0.10 -0.25 0.23 -1.54 0.00 0.00 0.00 175.76 174.10 2j1k s SER 401 N -1.59 -0.03 -0.01 0.00 1.04 -0.13 -0.02 113.70 112.96 2j1k s SER 401 Ca -0.12 -0.25 0.02 0.00 0.48 0.00 0.00 55.95 56.08 2j1k s SER 401 Cb -0.06 0.30 -0.00 0.00 0.10 0.00 0.00 66.02 66.36 2j1k s SER 401 CO 0.00 -0.54 -0.07 -0.36 0.98 0.00 0.00 173.24 173.25 2j1k s PHE 402 N -2.28 0.69 -0.12 5.02 0.08 -1.26 -0.40 117.98 119.71 2j1k s PHE 402 Ca -0.07 -0.14 -0.01 0.00 0.12 0.00 0.00 56.93 56.83 2j1k s PHE 402 Cb -0.02 -0.46 0.03 0.00 -0.57 0.00 0.00 43.02 41.99 2j1k s PHE 402 CO -0.02 -0.03 -0.06 0.08 -0.10 0.00 0.00 175.22 175.08 2j1k s VAL 403 N -0.06 0.98 0.32 -0.44 1.01 -0.45 -0.43 120.40 121.33 2j1k s VAL 403 Ca 0.01 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.40 2j1k s VAL 403 Cb -0.04 -1.04 -0.09 0.00 0.00 0.00 0.00 36.38 35.20 2j1k s VAL 403 CO -0.00 0.31 1.14 -0.83 0.00 0.00 0.00 175.10 175.72 2j1k s GLY 404 N 1.72 2.99 0.20 4.51 0.00 0.06 -0.43 107.32 116.37 2j1k s GLY 404 Ca 0.04 0.95 0.10 0.00 0.00 0.00 0.00 44.72 45.81 2j1k s GLY 404 CO -0.08 1.53 -0.19 -0.54 0.00 0.00 0.00 173.10 173.82 2j1k s GLU 405 N -1.75 1.41 7.74 2.90 0.41 0.31 -3.78 118.70 125.93 2j1k s GLU 405 Ca 0.49 -1.53 0.00 0.00 -0.41 0.00 0.00 54.97 53.52 2j1k s GLU 405 Cb -0.32 -1.48 0.00 0.00 -1.78 0.00 0.00 34.13 30.55 2j1k s GLU 405 CO 0.41 0.29 0.00 0.41 -0.49 0.00 0.00 175.26 175.88 2j1k n GLY 406 N 0.01 3.23 0.31 -1.39 0.00 -1.26 -1.88 105.19 104.21 2j1k n GLY 406 Ca -0.11 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.50 -0.02 0.00 -1.95 -1.65 103.07 97.95 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 -3.92 0.42 -0.30 5.60 4.01 -0.79 -4.36 117.16 117.83 2j1k n TYR 408 Ca -0.01 -0.21 -0.04 0.00 -0.16 0.00 0.00 57.90 57.47 2j1k n TYR 408 Cb 0.16 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.27 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 2.96 1.09 -5.32 -0.72 2.43 -1.32 -3.37 114.38 110.13 2j1k h ARG 409 Ca 0.00 -0.08 -0.68 0.00 -0.81 0.00 0.00 59.98 58.41 2j1k h ARG 409 Cb 0.66 -0.24 -0.33 0.00 -0.42 0.00 0.00 29.97 29.65 2j1k h ARG 409 CO 0.00 0.75 -0.87 0.42 -1.51 0.00 0.00 179.97 178.76 2j1k s ILE 410 N -6.04 2.14 0.21 1.20 1.01 -1.26 -1.02 121.20 117.43 2j1k s ILE 410 Ca -0.13 -0.99 0.07 0.00 0.00 0.00 0.00 60.65 59.61 2j1k s ILE 410 Cb 0.16 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 2j1k s ILE 410 CO 0.80 0.56 0.06 0.68 0.00 0.00 0.00 174.94 177.03 2j1k s VAL 411 N 0.41 3.94 0.32 2.92 -7.23 -0.11 -4.88 120.40 115.78 2j1k s VAL 411 Ca -0.17 -1.46 0.07 0.00 -1.81 0.00 0.00 61.98 58.61 2j1k s VAL 411 Cb -0.17 -3.05 -0.06 0.00 0.56 0.00 0.00 36.38 33.66 2j1k s VAL 411 CO 0.07 -0.21 -0.04 -0.94 -0.31 0.00 0.00 175.10 173.67 2j1k s SER 412 N -3.31 3.09 0.61 4.85 1.04 -1.26 -0.65 113.70 118.07 2j1k s SER 412 Ca 0.30 -1.25 0.35 0.00 0.48 0.00 0.00 55.95 55.83 2j1k s SER 412 Cb -0.09 -0.23 1.99 0.00 0.10 0.00 0.00 66.02 67.79 2j1k s SER 412 CO 0.21 -0.37 2.27 -0.65 0.98 0.00 0.00 173.24 175.67 2j1k h PRO 413 N 2.12 0.00 -0.00 4.02 0.11 -1.79 -1.32 132.00 135.14 2j1k h PRO 413 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2j1k h PRO 413 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2j1k h PRO 413 CO 0.70 0.02 -0.12 0.25 -0.21 0.00 0.00 178.00 178.64 2j1k n THR 414 N -3.50 0.00 -1.66 -1.15 -2.24 -1.26 -2.43 114.28 102.04 2j1k n THR 414 Ca -0.03 -0.06 -0.46 0.00 -2.27 0.00 0.00 64.05 61.23 2j1k n THR 414 Cb 0.11 -0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.95 1.97 -2.72 -0.78 -0.06 -0.50 -4.95 117.38 109.38 2j1k n GLN 415 Ca 0.14 0.71 -0.33 0.00 -2.00 0.00 0.00 57.00 55.52 2j1k n GLN 415 Cb 0.28 -2.43 -0.06 0.00 -4.06 0.00 0.00 30.24 23.98 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 0.67 6.75 0.60 1.69 1.04 -1.26 -4.65 113.70 118.53 2j1k s SER 416 Ca 0.77 1.76 -0.17 0.00 0.48 0.00 0.00 55.95 58.79 2j1k s SER 416 Cb -0.71 -2.55 -0.03 0.00 0.10 0.00 0.00 66.02 62.83 2j1k s SER 416 CO 0.42 -0.50 1.09 -1.10 0.98 0.00 0.00 173.24 174.14 2j1k s GLN 417 N -3.22 3.16 -0.01 4.02 -0.21 -1.26 -5.03 119.66 117.11 2j1k s GLN 417 Ca 0.64 1.39 -0.22 0.00 0.02 0.00 0.00 55.36 57.19 2j1k s GLN 417 Cb -0.11 -2.00 0.05 0.00 1.00 0.00 0.00 33.01 31.94 2j1k s GLN 417 CO 0.16 -0.96 0.49 -0.59 -2.12 0.00 0.00 175.29 172.26 2j1k s PHE 418 N -2.20 -0.40 -0.09 0.91 -0.12 -1.09 -5.02 117.98 109.98 2j1k s PHE 418 Ca 0.68 0.61 0.01 0.00 -0.05 0.00 0.00 56.93 58.17 2j1k s PHE 418 Cb -0.20 0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.42 2j1k s PHE 418 CO 0.35 -0.53 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.79 2j1k s SER 419 N -1.44 4.48 -0.34 1.98 0.01 -1.26 -0.95 113.70 116.18 2j1k s SER 419 Ca -0.11 -0.10 -0.07 0.00 1.31 0.00 0.00 55.95 56.98 2j1k s SER 419 Cb -0.02 -1.26 0.03 0.00 0.21 0.00 0.00 66.02 64.98 2j1k s SER 419 CO 0.05 0.31 0.12 -0.76 0.41 0.00 0.00 173.24 173.36 2j1k s LEU 420 N -0.48 4.29 -0.17 2.44 1.43 -0.09 -4.95 118.68 121.14 2j1k s LEU 420 Ca 0.07 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 52.06 2j1k s LEU 420 Cb -0.12 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2j1k s LEU 420 CO 0.02 -0.31 0.10 -0.63 0.23 0.00 0.00 176.35 175.76 2j1k s ILE 421 N 1.45 5.12 -0.21 -0.59 1.01 -1.26 -0.83 121.20 125.90 2j1k s ILE 421 Ca -0.00 0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.64 2j1k s ILE 421 Cb -0.19 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 2j1k s ILE 421 CO 0.03 0.49 0.11 -0.04 0.00 0.00 0.00 174.94 175.53 2j1k s MET 422 N 0.06 4.07 -0.15 2.79 -1.94 0.18 -1.14 119.30 123.18 2j1k s MET 422 Ca 0.07 -0.28 -0.04 0.00 -1.71 0.00 0.00 55.69 53.73 2j1k s MET 422 Cb -0.12 -3.37 -0.03 0.00 2.01 0.00 0.00 34.83 33.32 2j1k s MET 422 CO -0.00 0.21 -0.02 -1.21 -0.01 0.00 0.00 175.02 173.99 2j1k s GLU 423 N 0.58 3.66 0.04 2.03 2.02 -1.26 -1.70 118.70 124.07 2j1k s GLU 423 Ca 0.06 -0.49 0.08 0.00 0.02 0.00 0.00 54.97 54.64 2j1k s GLU 423 Cb -0.12 -2.94 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 2j1k s GLU 423 CO 0.01 0.28 -0.23 -0.06 0.02 0.00 0.00 175.26 175.28 2j1k s PHE 424 N 0.26 2.01 0.96 1.61 0.08 0.60 -0.21 117.98 123.29 2j1k s PHE 424 Ca -0.02 -0.39 -0.16 0.00 0.12 0.00 0.00 56.93 56.49 2j1k s PHE 424 Cb -0.14 -1.21 0.22 0.00 -0.57 0.00 0.00 43.02 41.32 2j1k s PHE 424 CO 0.02 0.10 1.30 -0.40 -0.10 0.00 0.00 175.22 176.14 2j1k n ASP 425 N 1.87 0.15 0.01 1.36 5.68 -0.36 -1.24 116.55 124.02 2j1k n ASP 425 Ca -0.17 -1.50 0.03 0.00 -0.50 0.00 0.00 54.79 52.65 2j1k n ASP 425 Cb 0.53 -0.99 0.13 0.00 -1.14 0.00 0.00 41.12 39.64 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 -3.75 0.01 -0.08 0.11 0.00 -1.26 -1.54 117.38 110.87 2j1k n GLN 426 Ca 0.16 0.44 0.07 0.00 0.00 0.00 0.00 57.00 57.68 2j1k n GLN 426 Cb 0.57 -1.54 0.11 0.00 0.00 0.00 0.00 30.24 29.39 2j1k n GLN 426 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2j1k n PHE 427 N -1.56 0.21 -0.74 2.61 3.72 -1.26 -4.97 117.46 115.46 2j1k n PHE 427 Ca 0.01 -0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 2j1k n PHE 427 Cb 0.05 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 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 0.85 0.54 3.74 1.37 0.00 -0.59 -2.98 105.19 108.11 2j1k n GLY 428 Ca 0.11 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.46 4.19 0.14 1.61 -0.21 -1.26 -4.71 119.66 117.96 2j1k s GLN 429 Ca 0.00 0.01 -0.33 0.00 0.02 0.00 0.00 55.36 55.06 2j1k s GLN 429 Cb 0.00 -3.41 -0.12 0.00 1.00 0.00 0.00 33.01 30.48 2j1k s GLN 429 CO 0.00 0.29 1.71 -0.11 -2.12 0.00 0.00 175.29 175.06 2j1k n LEU 430 N 3.44 3.58 -4.93 2.90 7.94 -1.26 -1.23 117.00 127.44 2j1k n LEU 430 Ca -0.13 1.04 -0.26 0.00 -1.11 0.00 0.00 56.01 55.55 2j1k n LEU 430 Cb 0.52 -1.48 0.05 0.00 0.53 0.00 0.00 43.42 43.04 2j1k n LEU 430 CO 0.39 -0.04 0.56 -0.04 -1.11 0.00 0.00 177.39 177.15 2j1k s MET 431 N 1.75 2.52 0.00 1.96 -1.94 0.70 -4.52 119.30 119.78 2j1k s MET 431 Ca 0.80 -0.19 0.26 0.00 -1.71 0.00 0.00 55.69 54.85 2j1k s MET 431 Cb -0.59 -2.23 1.22 0.00 2.01 0.00 0.00 34.83 35.23 2j1k s MET 431 CO 0.38 -0.98 1.82 -1.13 -0.01 0.00 0.00 175.02 175.10 2j1k n SER 432 N -2.74 0.88 -0.07 3.03 3.41 -1.26 -2.01 113.62 114.86 2j1k n SER 432 Ca 0.07 -1.40 0.07 0.00 -0.26 0.00 0.00 58.87 57.34 2j1k n SER 432 Cb 0.59 -0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.45 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 -0.27 0.00 -2.13 6.66 -2.24 -1.26 -4.70 114.28 110.34 2j1k n THR 433 Ca 0.19 -0.20 -0.28 0.00 -2.27 0.00 0.00 64.05 61.49 2j1k n THR 433 Cb 0.23 1.04 0.16 0.00 -2.10 0.00 0.00 70.33 69.66 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 -2.23 1.77 0.40 3.38 0.00 -1.26 -4.97 107.32 104.41 2j1k s GLY 434 Ca 0.07 -1.34 0.17 0.00 0.00 0.00 0.00 44.72 43.63 2j1k s GLY 434 CO 0.54 -0.64 1.84 3.43 0.00 0.00 0.00 173.10 178.26 2j1k h ASN 435 N -1.27 0.00 -3.20 1.64 4.21 -1.43 -3.37 115.58 112.16 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 38.12 2j1k h ASN 435 CO 0.40 0.33 -0.82 -0.63 -1.29 0.00 0.00 177.43 175.42 2j1k s ILE 436 N -3.98 2.46 0.33 2.81 1.01 -0.93 -0.59 121.20 122.30 2j1k s ILE 436 Ca -0.02 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 2j1k s ILE 436 Cb 0.13 -2.05 0.00 0.00 0.01 0.00 0.00 42.46 40.56 2j1k s ILE 436 CO 0.69 0.51 0.48 0.54 0.00 0.00 0.00 174.94 177.16 2j1k s ASN 437 N 1.15 0.74 0.00 3.58 2.20 -1.26 -4.31 114.94 117.04 2j1k s ASN 437 Ca 0.01 -1.41 0.17 0.00 -0.94 0.00 0.00 52.86 50.69 2j1k s ASN 437 Cb -0.14 0.66 1.00 0.00 -2.00 0.00 0.00 41.25 40.76 2j1k s ASN 437 CO -0.07 -1.29 1.43 -1.54 -2.94 0.00 0.00 177.10 172.70 2j1k n SER 438 N -1.27 0.00 0.07 3.54 3.41 -0.85 -1.81 113.62 116.72 2j1k n SER 438 Ca 0.00 -0.79 0.13 0.00 -0.26 0.00 0.00 58.87 57.95 2j1k n SER 438 Cb 0.62 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 65.04 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 -0.90 0.46 -4.06 6.66 -2.24 -1.26 -4.86 114.28 108.08 2j1k n THR 439 Ca 0.13 -0.12 -0.23 0.00 -2.27 0.00 0.00 64.05 61.56 2j1k n THR 439 Cb 0.06 -0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 67.61 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 -3.09 4.73 0.00 4.28 -1.32 -0.75 -5.06 115.64 114.43 2j1k s THR 440 Ca 0.11 -1.16 -0.31 0.00 -1.21 0.00 0.00 61.69 59.12 2j1k s THR 440 Cb 0.14 -3.51 -0.10 0.00 -1.51 0.00 0.00 72.50 67.52 2j1k s THR 440 CO 0.54 -0.26 1.96 0.41 -2.21 0.00 0.00 174.62 175.05 2j1k n THR 441 N -0.96 0.73 -3.63 5.08 -1.04 -1.26 -4.94 114.28 108.25 2j1k n THR 441 Ca -0.08 -0.13 -0.13 0.00 -2.04 0.00 0.00 64.05 61.66 2j1k n THR 441 Cb 0.57 -2.21 -0.07 0.00 -1.82 0.00 0.00 70.33 66.79 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 4.39 -0.75 -4.72 -1.42 -0.11 -1.26 -4.46 118.94 110.62 2j1k s TRP 442 Ca 0.90 1.82 0.00 0.00 1.22 0.00 0.00 56.10 60.04 2j1k s TRP 442 Cb -0.50 0.28 0.00 0.00 -1.50 0.00 0.00 33.47 31.75 2j1k s TRP 442 CO 0.45 -0.36 0.00 0.41 -4.62 0.00 0.00 176.95 172.82 2j1k n GLY 443 N 2.62 -0.64 3.77 5.86 0.00 -0.81 -4.55 105.19 111.45 2j1k n GLY 443 Ca -0.14 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.89 4.49 -0.39 1.61 2.12 0.08 0.15 118.70 124.87 2j1k s GLU 444 Ca 0.00 1.06 -0.21 0.00 0.36 0.00 0.00 54.97 56.18 2j1k s GLU 444 Cb 0.00 -3.29 0.01 0.00 0.26 0.00 0.00 34.13 31.11 2j1k s GLU 444 CO 0.00 0.48 0.65 0.21 -0.54 0.00 0.00 175.26 176.06 2j1k s LYS 445 N -0.76 3.54 0.37 4.30 2.20 0.15 -0.45 119.74 129.10 2j1k s LYS 445 Ca 0.35 -0.09 -0.27 0.00 -0.36 0.00 0.00 55.97 55.61 2j1k s LYS 445 Cb -0.22 -3.86 -0.10 0.00 -1.51 0.00 0.00 37.83 32.15 2j1k s LYS 445 CO 0.24 -0.85 1.31 -2.14 -0.36 0.00 0.00 175.35 173.55 2j1k s PRO 446 N 2.78 4.16 0.14 4.03 0.02 -1.26 -4.53 135.00 140.34 2j1k s PRO 446 Ca 0.24 2.19 -0.31 0.00 0.02 0.00 0.00 61.00 63.13 2j1k s PRO 446 Cb -0.14 -2.91 -0.11 0.00 0.02 0.00 0.00 34.50 31.36 2j1k s PRO 446 CO 0.17 -0.34 1.79 -0.46 -0.33 0.00 0.00 177.00 177.82 2j1k s TRP 447 N -1.21 2.37 0.00 6.54 -0.00 -1.26 -2.90 118.94 122.49 2j1k s TRP 447 Ca 0.53 0.10 0.00 0.00 -0.00 0.00 0.00 56.10 56.73 2j1k s TRP 447 Cb -0.39 -4.15 0.00 0.00 -0.00 0.00 0.00 33.47 28.93 2j1k s TRP 447 CO 0.51 -4.65 0.00 0.41 -0.00 0.00 0.00 176.95 173.22 2j1k n GLY 448 N 4.15 0.28 3.46 5.86 0.00 -1.26 -5.06 105.19 112.62 2j1k n GLY 448 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 0.70 -0.32 1.61 2.20 -1.14 -5.06 114.94 110.92 2j1k s ASN 449 Ca 0.00 -1.39 0.09 0.00 -0.94 0.00 0.00 52.86 50.62 2j1k s ASN 449 Cb 0.00 0.61 0.60 0.00 -2.00 0.00 0.00 41.25 40.46 2j1k s ASN 449 CO 0.00 -1.21 1.64 0.59 -2.94 0.00 0.00 177.10 175.18 2j1k n ASN 450 N -1.12 3.46 -4.83 3.54 3.02 -1.26 -4.49 115.26 113.59 2j1k n ASN 450 Ca 0.01 -3.52 -0.31 0.00 -0.03 0.00 0.00 54.58 50.74 2j1k n ASN 450 Cb 0.62 -0.70 0.05 0.00 -0.61 0.00 0.00 39.78 39.15 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 -3.15 3.88 -0.24 3.41 -4.23 -1.26 -4.55 115.64 109.50 2j1k s THR 451 Ca 0.49 0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 61.61 2j1k s THR 451 Cb 0.42 -3.40 0.03 0.00 1.34 0.00 0.00 72.50 70.89 2j1k s THR 451 CO 0.07 -0.80 -0.08 -0.69 -0.54 0.00 0.00 174.62 172.58 2j1k s VAL 452 N -3.10 2.72 -0.36 2.29 1.01 -1.26 -4.30 120.40 117.39 2j1k s VAL 452 Ca 0.58 -1.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 2j1k s VAL 452 Cb -0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 2j1k s VAL 452 CO 0.55 0.22 0.26 -1.10 0.00 0.00 0.00 175.10 175.03 2j1k s GLN 453 N 1.30 3.36 0.10 2.72 -1.52 0.41 -4.83 119.66 121.20 2j1k s GLN 453 Ca 0.00 -0.73 0.25 0.00 -1.95 0.00 0.00 55.36 52.93 2j1k s GLN 453 Cb -0.16 -3.85 0.60 0.00 -0.22 0.00 0.00 33.01 29.37 2j1k s GLN 453 CO -0.06 -0.53 1.52 -0.35 -0.25 0.00 0.00 175.29 175.62 2j1k n PRO 454 N 5.13 0.18 -2.18 2.91 -0.04 -1.26 -0.74 135.00 139.01 2j1k n PRO 454 Ca -0.12 0.08 -0.43 0.00 -0.04 0.00 0.00 63.50 62.99 2j1k n PRO 454 Cb 0.49 -1.64 -0.02 0.00 -0.04 0.00 0.00 33.50 32.28 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 -3.10 3.68 0.74 0.54 3.00 -1.26 -4.95 118.95 117.60 2j1k s ARG 455 Ca 0.09 1.42 -0.15 0.00 -1.00 0.00 0.00 55.73 56.09 2j1k s ARG 455 Cb 0.15 -4.04 0.04 0.00 0.00 0.00 0.00 34.95 31.10 2j1k s ARG 455 CO 0.67 -1.43 1.22 -2.14 0.00 0.00 0.00 175.30 173.61 2j1k s PRO 456 N 4.85 2.08 0.02 5.12 0.02 -1.26 -4.94 135.00 140.88 2j1k s PRO 456 Ca 0.69 1.81 -0.04 0.00 0.02 0.00 0.00 61.00 63.48 2j1k s PRO 456 Cb -0.21 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 2j1k s PRO 456 CO 0.30 -1.90 0.06 0.45 -0.33 0.00 0.00 177.00 175.58 2j1k s SER 457 N -1.96 0.18 0.52 2.53 0.15 -1.26 -5.04 113.70 108.84 2j1k s SER 457 Ca 0.75 -0.47 0.21 0.00 0.70 0.00 0.00 55.95 57.14 2j1k s SER 457 Cb -0.30 0.18 1.40 0.00 -1.71 0.00 0.00 66.02 65.58 2j1k s SER 457 CO 0.46 -0.41 2.13 1.12 1.20 0.00 0.00 173.24 177.74 2j1k h HIS 458 N 4.11 0.00 0.00 3.44 2.07 -1.96 -2.23 115.15 120.58 2j1k h HIS 458 Ca -0.32 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.20 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 0.59 0.06 -0.00 1.79 -3.07 0.00 0.00 177.93 177.30 2j1k h THR 459 N 0.00 0.46 -0.15 6.12 1.35 -1.96 -2.87 112.91 115.86 2j1k h THR 459 Ca -0.00 -0.02 0.04 0.00 -0.55 0.00 0.00 66.41 65.89 2j1k h THR 459 Cb 0.12 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.55 2j1k h THR 459 CO 0.01 0.00 0.13 -0.50 -0.25 0.00 0.00 175.52 174.91 2j1k h TRP 460 N 0.00 0.00 -0.50 4.73 4.06 -1.65 -0.82 115.95 121.76 2j1k h TRP 460 Ca -0.00 0.00 0.08 0.00 2.06 0.00 0.00 58.89 61.03 2j1k h TRP 460 Cb 0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.14 2j1k h TRP 460 CO 0.00 0.00 0.34 -0.22 -3.56 0.00 0.00 178.44 175.00 2j1k h LYS 461 N 0.00 0.31 -0.01 0.49 3.64 -1.40 -2.62 116.57 116.99 2j1k h LYS 461 Ca 0.07 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2j1k h LYS 461 Cb 0.32 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2j1k h LYS 461 CO -0.00 0.21 0.02 -0.07 -2.27 0.00 0.00 179.45 177.33 2j1k h LEU 462 N 0.32 0.00 -0.65 5.20 3.38 -1.36 0.01 115.31 122.21 2j1k h LEU 462 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2j1k h LEU 462 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2j1k h LEU 462 CO -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.46 2j1k s MET 464 N -2.05 4.05 -0.29 0.00 -1.94 -0.01 -4.88 119.30 114.18 2j1k s MET 464 Ca 0.39 0.71 -0.29 0.00 -1.71 0.00 0.00 55.69 54.80 2j1k s MET 464 Cb 0.21 -2.52 -0.02 0.00 2.01 0.00 0.00 34.83 34.51 2j1k s MET 464 CO 0.36 0.20 1.78 -1.25 -0.01 0.00 0.00 175.02 176.11 2j1k s PRO 465 N -2.79 3.46 -0.35 2.03 0.04 -1.26 -0.26 135.00 135.87 2j1k s PRO 465 Ca 0.52 1.55 -0.32 0.00 0.04 0.00 0.00 61.00 62.79 2j1k s PRO 465 Cb -0.11 -4.17 -0.14 0.00 0.04 0.00 0.00 34.50 30.12 2j1k s PRO 465 CO 0.18 -1.71 1.29 -1.71 0.04 0.00 0.00 177.00 175.09 2j1k n ASN 466 N 9.83 0.71 0.19 6.66 2.85 -0.56 -4.75 115.26 130.19 2j1k n ASN 466 Ca 0.22 0.68 0.05 0.00 -0.11 0.00 0.00 54.58 55.43 2j1k n ASN 466 Cb 0.46 -0.63 0.33 0.00 1.24 0.00 0.00 39.78 41.18 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 4.74 0.00 -0.08 1.20 0.11 -1.90 0.10 114.38 118.54 2j1k h ARG 467 Ca -0.21 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.71 2j1k h ARG 467 Cb 0.98 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.07 2j1k h ARG 467 CO 0.72 0.38 -0.58 1.49 0.10 0.00 0.00 179.97 182.09 2j1k h GLU 468 N 0.00 0.54 -0.59 0.08 4.81 -1.98 -2.15 114.58 115.30 2j1k h GLU 468 Ca -0.00 -0.47 -0.08 0.00 -0.13 0.00 0.00 59.36 58.68 2j1k h GLU 468 Cb 0.91 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2j1k h GLU 468 CO 0.05 1.10 0.06 0.28 -0.73 0.00 0.00 179.01 179.77 2j1k h VAL 469 N 0.14 1.26 -2.17 0.32 2.07 -1.88 -3.27 116.25 112.72 2j1k h VAL 469 Ca -0.05 -1.05 -0.68 0.00 0.82 0.00 0.00 66.70 65.75 2j1k h VAL 469 Cb 1.23 0.79 -0.36 0.00 -1.52 0.00 0.00 31.29 31.43 2j1k h VAL 469 CO 0.12 0.38 0.02 -1.22 0.02 0.00 0.00 177.57 176.89 2j1k n TYR 470 N -4.28 3.50 0.18 1.57 4.01 0.33 -4.71 117.16 117.75 2j1k n TYR 470 Ca 0.03 -3.31 0.09 0.00 -0.16 0.00 0.00 57.90 54.54 2j1k n TYR 470 Cb 0.30 -0.73 0.11 0.00 -0.31 0.00 0.00 39.34 38.71 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 3.34 0.00 -2.75 7.72 4.64 -1.44 -3.43 113.55 121.63 2j1k h SER 471 Ca 0.31 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 61.00 2j1k h SER 471 Cb 0.45 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.38 2j1k h SER 471 CO 0.99 0.16 -0.78 0.42 -0.87 0.00 0.00 176.83 176.75 2j1k s THR 472 N -3.14 2.54 0.40 2.95 -4.23 -1.26 -5.08 115.64 107.82 2j1k s THR 472 Ca 0.05 -2.14 -0.27 0.00 -1.18 0.00 0.00 61.69 58.16 2j1k s THR 472 Cb 0.06 -2.27 -0.10 0.00 1.34 0.00 0.00 72.50 71.53 2j1k s THR 472 CO 0.71 -0.24 1.47 -2.84 -0.54 0.00 0.00 174.62 173.18 2j1k s PRO 473 N -3.06 3.96 0.28 3.99 0.02 -1.26 -4.96 135.00 133.98 2j1k s PRO 473 Ca 0.25 2.53 0.12 0.00 0.02 0.00 0.00 61.00 63.92 2j1k s PRO 473 Cb -0.07 -2.86 -0.05 0.00 0.02 0.00 0.00 34.50 31.54 2j1k s PRO 473 CO 0.13 -0.64 -0.17 0.00 -0.33 0.00 0.00 177.00 175.99 2j1k s ALA 474 N -1.15 2.81 0.07 -1.55 0.00 -0.68 -4.97 121.76 116.30 2j1k s ALA 474 Ca 0.56 -1.88 -0.22 0.00 0.00 0.00 0.00 51.96 50.42 2j1k s ALA 474 Cb -0.46 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.42 2j1k s ALA 474 CO 0.61 0.26 0.52 0.00 0.00 0.00 0.00 175.76 177.15 2j1k s ALA 475 N -2.50 -1.33 -0.11 0.00 0.00 -1.26 0.08 121.76 116.64 2j1k s ALA 475 Ca 0.30 0.52 -0.03 0.00 0.00 0.00 0.00 51.96 52.76 2j1k s ALA 475 Cb -0.04 0.49 0.04 0.00 0.00 0.00 0.00 23.12 23.61 2j1k s ALA 475 CO 0.16 -0.56 0.05 0.99 0.00 0.00 0.00 175.76 176.39 2j1k s THR 476 N -2.79 0.14 -0.22 0.00 2.01 -0.64 -5.00 115.64 109.14 2j1k s THR 476 Ca -0.03 0.03 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 2j1k s THR 476 Cb -0.00 -0.51 -0.05 0.00 0.01 0.00 0.00 72.50 71.95 2j1k s THR 476 CO -0.04 0.03 0.22 -0.51 -0.69 0.00 0.00 174.62 173.63 2j1k s ILE 477 N 2.05 5.32 0.15 1.82 2.07 -1.26 -1.01 121.20 130.34 2j1k s ILE 477 Ca 0.03 0.33 0.06 0.00 -1.41 0.00 0.00 60.65 59.66 2j1k s ILE 477 Cb -0.14 -3.56 -0.04 0.00 0.13 0.00 0.00 42.46 38.85 2j1k s ILE 477 CO -0.06 0.33 -0.12 -0.44 -1.91 0.00 0.00 174.94 172.74 2j1k s SER 478 N 0.96 2.01 0.54 4.50 0.01 -0.63 -4.97 113.70 116.13 2j1k s SER 478 Ca 0.11 -0.94 -0.21 0.00 1.31 0.00 0.00 55.95 56.22 2j1k s SER 478 Cb -0.14 -0.06 -0.06 0.00 0.21 0.00 0.00 66.02 65.98 2j1k s SER 478 CO 0.05 -0.23 1.09 -1.14 0.41 0.00 0.00 173.24 173.41 2j1k n ARG 479 N 0.04 1.24 -3.46 12.44 0.63 -1.26 -1.09 116.66 125.20 2j1k n ARG 479 Ca -0.12 0.46 -0.29 0.00 -0.92 0.00 0.00 57.85 56.99 2j1k n ARG 479 Cb 0.59 -2.26 -0.12 0.00 0.45 0.00 0.00 32.46 31.13 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 1.15 2.84 -0.08 0.00 0.00 -1.26 -0.48 107.32 109.49 2j1k s GLY 481 Ca 0.17 1.12 0.05 0.00 0.00 0.00 0.00 44.72 46.07 2j1k s GLY 481 CO -0.01 1.62 -0.24 1.08 0.00 0.00 0.00 173.10 175.55 2j1k s LEU 482 N -3.07 2.11 -1.48 0.66 1.43 -0.37 -1.06 118.68 116.90 2j1k s LEU 482 Ca 0.65 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 53.16 2j1k s LEU 482 Cb -0.34 -1.40 0.05 0.00 0.03 0.00 0.00 46.19 44.53 2j1k s LEU 482 CO 0.42 0.21 0.67 -0.67 0.23 0.00 0.00 176.35 177.20 2j1k n ASP 483 N 3.18 -2.03 -0.02 2.29 2.03 0.21 -4.82 116.55 117.40 2j1k n ASP 483 Ca -0.18 -0.93 -0.08 0.00 0.52 0.00 0.00 54.79 54.12 2j1k n ASP 483 Cb 0.52 -3.35 0.09 0.00 -0.72 0.00 0.00 41.12 37.66 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 -1.83 0.63 -0.10 1.67 0.02 -1.85 -1.22 113.55 110.88 2j1k h SER 484 Ca -0.61 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.04 2j1k h SER 484 Cb 1.37 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 2j1k h SER 484 CO 0.66 0.97 -0.01 0.40 -1.14 0.00 0.00 176.83 177.71 2j1k h ILE 485 N 0.49 1.26 -0.19 3.27 2.04 -1.96 0.39 117.51 122.81 2j1k h ILE 485 Ca 0.04 -0.84 -0.12 0.00 1.00 0.00 0.00 64.86 64.95 2j1k h ILE 485 Cb 0.93 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 2j1k h ILE 485 CO 0.08 0.24 -0.39 0.00 0.00 0.00 0.00 178.15 178.08 2j1k h ALA 486 N 0.72 0.98 -0.22 1.87 0.00 -1.88 -2.47 119.26 118.27 2j1k h ALA 486 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2j1k h ALA 486 Cb 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2j1k h ALA 486 CO 0.01 0.61 0.00 1.33 0.00 0.00 0.00 179.25 181.20 2j1k n VAL 487 N -4.04 0.28 -4.12 0.00 0.24 -0.48 -4.95 118.33 105.26 2j1k n VAL 487 Ca -0.01 -0.40 -0.30 0.00 -2.04 0.00 0.00 64.34 61.58 2j1k n VAL 487 Cb 0.49 0.40 -0.04 0.00 -1.47 0.00 0.00 33.84 33.22 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 0.46 -1.05 -2.36 -1.34 2.03 -0.83 -2.36 116.55 111.10 2j1k n ASP 488 Ca 0.16 -1.06 -0.19 0.00 0.52 0.00 0.00 54.79 54.21 2j1k n ASP 488 Cb 0.35 -2.66 -0.01 0.00 -0.72 0.00 0.00 41.12 38.07 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 -1.88 -0.36 3.68 0.27 0.00 0.07 -4.92 105.19 102.04 2j1k n GLY 489 Ca -0.18 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.86 0.20 -0.20 4.61 0.00 -1.00 -4.86 120.51 117.40 2j1k n ALA 490 Ca -0.23 0.39 0.24 0.00 0.00 0.00 0.00 53.44 53.84 2j1k n ALA 490 Cb 0.67 -2.30 0.63 0.00 0.00 0.00 0.00 19.45 18.45 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 7.20 0.18 -0.95 0.00 0.11 -1.93 -0.66 132.00 135.95 2j1k h PRO 491 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2j1k h PRO 491 Cb 1.30 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2j1k h PRO 491 CO 0.92 0.12 0.01 -1.13 -0.21 0.00 0.00 178.00 177.71 2j1k n SER 492 N -4.39 1.84 -0.14 -2.05 3.41 -1.26 -3.55 113.62 107.48 2j1k n SER 492 Ca 0.19 -2.14 0.06 0.00 -0.26 0.00 0.00 58.87 56.72 2j1k n SER 492 Cb 0.84 -0.53 0.08 0.00 -0.26 0.00 0.00 64.21 64.35 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 0.11 1.26 -4.29 4.33 5.12 -0.25 -1.68 116.66 121.25 2j1k n ARG 493 Ca 0.04 -2.01 -0.33 0.00 -1.93 0.00 0.00 57.85 53.63 2j1k n ARG 493 Cb 0.42 -1.18 -0.09 0.00 -1.16 0.00 0.00 32.46 30.44 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 -2.09 5.10 0.00 0.55 0.01 -1.23 -1.24 113.70 114.81 2j1k s SER 494 Ca 0.19 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.45 2j1k s SER 494 Cb 0.17 -1.33 0.00 0.00 0.21 0.00 0.00 66.02 65.07 2j1k s SER 494 CO 0.02 0.28 0.00 2.30 0.41 0.00 0.00 173.24 176.25 2j1k n ILE 495 N 1.43 0.00 -4.18 1.44 -5.35 0.36 -4.51 119.36 108.56 2j1k n ILE 495 Ca -0.15 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.04 2j1k n ILE 495 Cb 0.53 -0.50 -0.09 0.00 -1.74 0.00 0.00 39.64 37.84 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 -0.95 4.76 -0.14 7.28 1.01 0.05 -0.32 116.67 128.35 2j1k s ASP 496 Ca 0.00 -0.30 -0.00 0.00 0.71 0.00 0.00 52.55 52.96 2j1k s ASP 496 Cb 0.00 -1.03 0.03 0.00 1.01 0.00 0.00 42.92 42.93 2j1k s ASP 496 CO 0.00 0.16 -0.07 0.00 0.21 0.00 0.00 175.17 175.47 2j1k s MET 498 N 1.64 3.83 -0.06 0.00 1.75 0.17 -1.61 119.30 125.03 2j1k s MET 498 Ca 0.03 -0.39 -0.30 0.00 -1.25 0.00 0.00 55.69 53.78 2j1k s MET 498 Cb -0.14 -3.48 -0.02 0.00 2.84 0.00 0.00 34.83 34.03 2j1k s MET 498 CO -0.08 -0.14 1.06 -1.17 -0.65 0.00 0.00 175.02 174.04 2j1k s LEU 499 N 1.57 4.29 -0.18 4.11 2.96 -0.18 -0.69 118.68 130.57 2j1k s LEU 499 Ca 0.06 1.67 -0.05 0.00 -0.22 0.00 0.00 54.13 55.59 2j1k s LEU 499 Cb -0.15 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 2j1k s LEU 499 CO 0.07 -0.44 0.00 -0.63 -1.32 0.00 0.00 176.35 174.03 2j1k s ILE 500 N 1.74 4.15 -0.27 6.68 1.01 -0.04 -1.62 121.20 132.85 2j1k s ILE 500 Ca 0.52 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.82 2j1k s ILE 500 Cb -0.21 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 2j1k s ILE 500 CO 0.22 0.46 0.11 -0.63 0.00 0.00 0.00 174.94 175.10 2j1k s ILE 501 N 0.57 4.52 -1.52 2.92 1.01 0.11 -1.46 121.20 127.36 2j1k s ILE 501 Ca -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2j1k s ILE 501 Cb -0.14 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2j1k s ILE 501 CO 0.02 0.24 0.18 0.59 0.00 0.00 0.00 174.94 175.98 2j1k n ASN 502 N 4.96 -5.45 -4.69 3.58 3.02 0.02 -1.69 115.26 115.00 2j1k n ASN 502 Ca -0.15 -0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 53.88 2j1k n ASN 502 Cb 0.51 -4.44 -0.03 0.00 -0.61 0.00 0.00 39.78 35.21 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 -5.14 4.27 0.38 3.52 2.20 -1.26 -4.39 119.74 119.32 2j1k s LYS 503 Ca 0.09 2.08 -0.28 0.00 -0.36 0.00 0.00 55.97 57.50 2j1k s LYS 503 Cb -0.04 -3.50 -0.10 0.00 -1.51 0.00 0.00 37.83 32.68 2j1k s LYS 503 CO 0.11 -0.58 1.40 -1.25 -0.36 0.00 0.00 175.35 174.67 2j1k s PRO 504 N 2.16 4.10 -0.13 4.03 0.04 -1.26 -4.65 135.00 139.28 2j1k s PRO 504 Ca 0.66 2.39 -0.04 0.00 0.04 0.00 0.00 61.00 64.05 2j1k s PRO 504 Cb -0.35 -2.92 0.06 0.00 0.04 0.00 0.00 34.50 31.34 2j1k s PRO 504 CO 0.29 -0.47 0.20 0.21 0.04 0.00 0.00 177.00 177.27 2j1k s LYS 505 N -2.08 0.10 7.84 4.56 2.47 -1.26 -5.10 119.74 126.28 2j1k s LYS 505 Ca 0.53 0.51 0.00 0.00 -1.56 0.00 0.00 55.97 55.45 2j1k s LYS 505 Cb -0.43 -0.49 0.00 0.00 -1.46 0.00 0.00 37.83 35.46 2j1k s LYS 505 CO 0.57 -0.40 0.00 0.41 0.16 0.00 0.00 175.35 176.09 2j1k n GLY 506 N 5.33 3.59 0.85 5.54 0.00 -1.26 -1.90 105.19 117.34 2j1k n GLY 506 Ca -0.05 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 45.93 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 2.33 -2.44 1.61 0.24 -1.26 -5.03 118.33 113.79 2j1k n VAL 507 Ca 0.00 -2.41 -0.40 0.00 -2.04 0.00 0.00 64.34 59.49 2j1k n VAL 507 Cb 0.00 -0.28 -0.04 0.00 -1.47 0.00 0.00 33.84 32.05 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 -3.05 3.35 -0.06 2.33 0.00 -0.80 -4.94 121.76 118.60 2j1k s ALA 508 Ca 0.41 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 53.12 2j1k s ALA 508 Cb 0.36 -3.34 -0.30 0.00 0.00 0.00 0.00 23.12 19.84 2j1k s ALA 508 CO 0.03 -0.24 0.74 1.15 0.00 0.00 0.00 175.76 177.44 2j1k h THR 509 N 2.91 1.19 -4.17 0.00 2.02 -1.43 -3.44 112.91 110.00 2j1k h THR 509 Ca -0.47 -2.50 -0.54 0.00 0.77 0.00 0.00 66.41 63.66 2j1k h THR 509 Cb 1.22 2.91 -0.26 0.00 -1.74 0.00 0.00 68.15 70.27 2j1k h THR 509 CO 0.66 0.75 -0.83 -0.31 0.37 0.00 0.00 175.52 176.16 2j1k s TYR 510 N -2.50 1.61 0.01 3.16 2.02 -0.74 -4.99 117.35 115.92 2j1k s TYR 510 Ca -0.16 -0.35 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 2j1k s TYR 510 Cb 0.04 -0.97 -0.01 0.00 -0.40 0.00 0.00 41.96 40.61 2j1k s TYR 510 CO 0.83 0.05 -0.10 0.95 -1.57 0.00 0.00 175.55 175.71 2j1k s THR 511 N -0.73 0.79 -0.13 -0.71 -4.23 -1.26 -0.29 115.64 109.08 2j1k s THR 511 Ca 0.06 -0.64 0.03 0.00 -1.18 0.00 0.00 61.69 59.96 2j1k s THR 511 Cb -0.08 -0.70 0.01 0.00 1.34 0.00 0.00 72.50 73.06 2j1k s THR 511 CO 0.01 0.07 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.19 2j1k s LEU 512 N -0.63 2.05 -0.13 4.79 1.43 -0.69 -0.80 118.68 124.70 2j1k s LEU 512 Ca 0.01 -0.57 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2j1k s LEU 512 Cb -0.05 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.77 2j1k s LEU 512 CO 0.00 0.08 -0.15 -0.89 0.23 0.00 0.00 176.35 175.62 2j1k s THR 513 N 0.76 2.80 -0.43 5.49 2.01 -0.54 0.51 115.64 126.24 2j1k s THR 513 Ca -0.09 -0.74 -0.16 0.00 0.31 0.00 0.00 61.69 61.01 2j1k s THR 513 Cb -0.16 -2.16 0.03 0.00 0.01 0.00 0.00 72.50 70.22 2j1k s THR 513 CO -0.00 0.53 0.37 -0.36 -0.69 0.00 0.00 174.62 174.47 2j1k s PHE 514 N 0.49 3.21 -0.32 4.92 0.08 -0.01 -0.86 117.98 125.50 2j1k s PHE 514 Ca -0.11 -0.60 -0.08 0.00 0.12 0.00 0.00 56.93 56.26 2j1k s PHE 514 Cb -0.16 -2.85 0.01 0.00 -0.57 0.00 0.00 43.02 39.46 2j1k s PHE 514 CO 0.05 -0.69 0.11 0.50 -0.10 0.00 0.00 175.22 175.09 2j1k s ARG 515 N 1.84 3.01 -0.22 0.44 3.52 0.13 -0.91 118.95 126.77 2j1k s ARG 515 Ca 0.07 -0.92 -0.19 0.00 -0.13 0.00 0.00 55.73 54.56 2j1k s ARG 515 Cb -0.20 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.70 2j1k s ARG 515 CO 0.10 -0.51 0.56 -0.06 -0.81 0.00 0.00 175.30 174.58 2j1k s PHE 516 N 1.51 3.34 0.06 5.12 0.08 -0.13 -0.66 117.98 127.30 2j1k s PHE 516 Ca 0.02 0.80 0.01 0.00 0.12 0.00 0.00 56.93 57.88 2j1k s PHE 516 Cb -0.18 -2.74 -0.04 0.00 -0.57 0.00 0.00 43.02 39.50 2j1k s PHE 516 CO 0.04 -0.18 -0.05 -0.51 -0.10 0.00 0.00 175.22 174.41 2j1k s LEU 517 N 1.94 2.42 -1.23 -0.37 1.43 0.25 -2.67 118.68 120.45 2j1k s LEU 517 Ca 0.25 -0.85 -0.06 0.00 -1.03 0.00 0.00 54.13 52.44 2j1k s LEU 517 Cb -0.16 0.03 0.01 0.00 0.03 0.00 0.00 46.19 46.10 2j1k s LEU 517 CO 0.10 -0.44 1.06 0.59 0.23 0.00 0.00 176.35 177.88 2j1k n ASN 518 N 0.51 -5.12 0.21 2.29 3.02 -1.26 -0.77 115.26 114.14 2j1k n ASN 518 Ca -0.16 -0.52 0.16 0.00 -0.03 0.00 0.00 54.58 54.03 2j1k n ASN 518 Cb 0.59 -4.73 0.81 0.00 -0.61 0.00 0.00 39.78 35.83 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 -2.34 0.00 0.00 3.10 0.04 -1.84 -2.34 116.94 113.56 2j1k h PHE 519 Ca -0.53 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.24 2j1k h PHE 519 Cb 1.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.49 2j1k h PHE 519 CO 0.45 0.00 0.00 0.27 -0.60 0.00 0.00 178.31 178.43 2j1k n ASN 520 N -3.96 0.00 0.22 2.17 0.23 -1.02 -1.35 115.26 111.55 2j1k n ASN 520 Ca 0.01 -0.19 0.15 0.00 -0.53 0.00 0.00 54.58 54.02 2j1k n ASN 520 Cb 0.27 -0.13 0.49 0.00 -2.08 0.00 0.00 39.78 38.32 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 -6.75 -3.83 3.08 -1.72 -3.46 114.38 101.70 2j1k h ARG 521 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.54 2j1k h ARG 521 Cb 0.06 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.13 2j1k h ARG 521 CO 0.00 0.00 0.54 -0.51 -1.07 0.00 0.00 179.97 178.93 2j1k s LEU 522 N -5.71 4.48 0.24 3.04 1.43 -0.45 -4.65 118.68 117.06 2j1k s LEU 522 Ca 0.04 2.32 0.06 0.00 -1.03 0.00 0.00 54.13 55.52 2j1k s LEU 522 Cb 0.08 -3.62 0.28 0.00 0.03 0.00 0.00 46.19 42.96 2j1k s LEU 522 CO 0.56 -0.31 1.57 0.77 0.23 0.00 0.00 176.35 179.17 2j1k h SER 523 N 4.45 0.22 -0.41 2.29 4.64 -1.66 -3.42 113.55 119.67 2j1k h SER 523 Ca -0.46 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 2j1k h SER 523 Cb 1.21 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2j1k h SER 523 CO 0.70 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 178.04 2j1k n GLY 524 N 0.25 1.65 3.67 -0.77 0.00 -1.26 -4.99 105.19 103.73 2j1k n GLY 524 Ca -0.02 -0.85 -0.44 0.00 0.00 0.00 0.00 46.02 44.71 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 0.00 1.77 3.19 -0.02 0.00 -1.26 -4.48 105.19 104.38 2j1k n GLY 525 Ca 0.00 0.82 -0.27 0.00 0.00 0.00 0.00 46.02 46.58 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 4.29 1.58 -0.02 2.61 2.01 0.18 -4.97 115.64 121.33 2j1k s THR 526 Ca 0.90 -0.83 -0.33 0.00 0.31 0.00 0.00 61.69 61.73 2j1k s THR 526 Cb -0.49 -1.33 -0.12 0.00 0.01 0.00 0.00 72.50 70.57 2j1k s THR 526 CO 0.44 0.45 1.85 -0.11 -0.69 0.00 0.00 174.62 176.56 2j1k n LEU 527 N 2.82 3.57 -3.78 4.42 7.94 -1.26 -0.93 117.00 129.78 2j1k n LEU 527 Ca -0.16 0.98 -0.42 0.00 -1.11 0.00 0.00 56.01 55.30 2j1k n LEU 527 Cb 0.53 -1.42 -0.03 0.00 0.53 0.00 0.00 43.42 43.03 2j1k n LEU 527 CO 0.24 -0.03 2.28 0.33 -1.11 0.00 0.00 177.39 179.11 2j1k n PHE 528 N 6.24 2.70 -3.87 1.96 7.35 -0.19 -3.90 117.46 127.75 2j1k n PHE 528 Ca 0.21 -2.28 -0.30 0.00 -0.76 0.00 0.00 57.45 54.32 2j1k n PHE 528 Cb 0.32 -2.13 -0.14 0.00 0.35 0.00 0.00 39.48 37.88 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 4.39 1.56 0.69 -4.13 2.20 -1.26 -0.76 119.74 122.43 2j1k s LYS 529 Ca 0.54 -2.16 -0.11 0.00 -0.36 0.00 0.00 55.97 53.88 2j1k s LYS 529 Cb 0.13 -2.88 0.01 0.00 -1.51 0.00 0.00 37.83 33.58 2j1k s LYS 529 CO 0.04 -1.08 1.06 0.95 -0.36 0.00 0.00 175.35 175.96 2j1k s THR 530 N 0.29 4.01 0.96 3.43 -4.23 0.43 -0.62 115.64 119.92 2j1k s THR 530 Ca 0.15 0.65 -0.11 0.00 -1.18 0.00 0.00 61.69 61.21 2j1k s THR 530 Cb -0.24 -3.45 0.17 0.00 1.34 0.00 0.00 72.50 70.32 2j1k s THR 530 CO -0.04 -0.85 1.10 -1.81 -0.54 0.00 0.00 174.62 172.48 2j1k s ASP 531 N -3.90 2.67 -0.10 3.99 1.11 -0.22 -4.58 116.67 115.64 2j1k s ASP 531 Ca 0.58 1.81 -0.30 0.00 0.18 0.00 0.00 52.55 54.82 2j1k s ASP 531 Cb -0.13 -2.40 -0.04 0.00 1.07 0.00 0.00 42.92 41.42 2j1k s ASP 531 CO 0.55 -3.19 1.45 -0.69 1.18 0.00 0.00 175.17 174.46 2j1k s VAL 532 N -2.69 3.91 -0.03 -1.27 1.01 -1.26 -4.55 120.40 115.53 2j1k s VAL 532 Ca 0.66 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.76 2j1k s VAL 532 Cb -0.22 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2j1k s VAL 532 CO 0.59 -0.09 0.04 -0.76 0.00 0.00 0.00 175.10 174.89 2j1k s LEU 533 N 3.62 3.75 -0.06 3.92 1.43 0.98 -4.94 118.68 127.37 2j1k s LEU 533 Ca 0.64 0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.89 2j1k s LEU 533 Cb -0.28 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 43.87 2j1k s LEU 533 CO 0.22 0.31 -0.12 -0.89 0.23 0.00 0.00 176.35 176.11 2j1k s THR 534 N -1.08 1.10 0.12 5.49 2.01 -1.26 -0.93 115.64 121.09 2j1k s THR 534 Ca 0.19 -0.47 0.04 0.00 0.31 0.00 0.00 61.69 61.76 2j1k s THR 534 Cb -0.12 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 2j1k s THR 534 CO 0.09 0.35 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.91 2j1k s PHE 535 N 0.62 1.13 -0.00 4.92 0.08 -0.25 -4.98 117.98 119.50 2j1k s PHE 535 Ca -0.13 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.21 2j1k s PHE 535 Cb -0.15 -0.60 -0.00 0.00 -0.57 0.00 0.00 43.02 41.69 2j1k s PHE 535 CO 0.03 0.02 -0.04 0.99 -0.10 0.00 0.00 175.22 176.12 2j1k s THR 536 N -2.90 0.29 0.18 0.64 2.01 -1.26 0.26 115.64 114.86 2j1k s THR 536 Ca 0.10 -0.15 -0.08 0.00 0.31 0.00 0.00 61.69 61.87 2j1k s THR 536 Cb 0.00 -0.25 -0.01 0.00 0.01 0.00 0.00 72.50 72.24 2j1k s THR 536 CO -0.00 0.08 0.28 -0.72 -0.69 0.00 0.00 174.62 173.57 2j1k s TYR 537 N -0.07 0.52 -0.01 4.92 -0.85 -0.58 -5.00 117.35 116.29 2j1k s TYR 537 Ca 0.01 -0.87 -0.30 0.00 -0.52 0.00 0.00 57.07 55.39 2j1k s TYR 537 Cb -0.02 -0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.18 2j1k s TYR 537 CO -0.00 -0.74 1.07 0.08 -1.52 0.00 0.00 175.55 174.44 2j1k s VAL 538 N -4.01 4.55 0.57 -3.49 1.01 -1.26 -0.18 120.40 117.59 2j1k s VAL 538 Ca 0.21 1.83 -0.18 0.00 0.00 0.00 0.00 61.98 63.84 2j1k s VAL 538 Cb 0.03 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 2j1k s VAL 538 CO 0.03 0.10 1.10 -0.83 0.00 0.00 0.00 175.10 175.50 2j1k s GLY 539 N 1.10 2.42 0.63 4.51 0.00 0.53 -1.49 107.32 115.01 2j1k s GLY 539 Ca 0.54 0.65 -0.15 0.00 0.00 0.00 0.00 44.72 45.76 2j1k s GLY 539 CO 0.26 1.00 1.08 1.85 0.00 0.00 0.00 173.10 177.28 2j1k s GLU 540 N -3.59 3.09 0.27 2.90 2.56 0.64 -4.24 118.70 120.33 2j1k s GLU 540 Ca 0.69 1.25 -0.10 0.00 0.00 0.00 0.00 54.97 56.81 2j1k s GLU 540 Cb -0.21 -2.00 -0.07 0.00 2.00 0.00 0.00 34.13 33.85 2j1k s GLU 540 CO 0.31 -1.00 0.61 -0.80 -0.56 0.00 0.00 175.26 173.82 2j1k s ASN 541 N -2.80 6.63 0.00 -1.70 0.01 -1.26 -4.46 114.94 111.36 2j1k s ASN 541 Ca 0.64 1.00 0.11 0.00 -0.71 0.00 0.00 52.86 53.90 2j1k s ASN 541 Cb -0.17 -2.26 0.66 0.00 0.41 0.00 0.00 41.25 39.89 2j1k s ASN 541 CO 0.40 -0.14 1.10 1.67 -1.51 0.00 0.00 177.10 178.62