#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 3.42 -0.22 0.00 0.04 -1.26 -4.94 135.00 132.03 2j1k s PRO 362 Ca 0.00 0.85 -0.18 0.00 0.04 0.00 0.00 61.00 61.71 2j1k s PRO 362 Cb 0.00 -2.06 0.06 0.00 0.04 0.00 0.00 34.50 32.55 2j1k s PRO 362 CO 0.00 -0.71 0.58 -1.50 0.04 0.00 0.00 177.00 175.40 2j1k s ILE 363 N -3.07 -0.00 -0.15 0.56 -1.16 -0.72 -5.02 121.20 111.64 2j1k s ILE 363 Ca 0.57 0.01 0.02 0.00 -0.51 0.00 0.00 60.65 60.74 2j1k s ILE 363 Cb -0.12 -0.82 0.01 0.00 0.61 0.00 0.00 42.46 42.14 2j1k s ILE 363 CO 0.52 0.01 -0.20 -0.89 -2.81 0.00 0.00 174.94 171.56 2j1k s THR 364 N 0.70 1.95 -0.14 4.00 2.01 -1.26 -0.83 115.64 122.08 2j1k s THR 364 Ca -0.03 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 61.01 2j1k s THR 364 Cb -0.05 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 2j1k s THR 364 CO -0.05 0.53 0.08 -0.76 -0.69 0.00 0.00 174.62 173.73 2j1k s LEU 365 N 1.02 4.00 0.31 4.42 1.43 -0.45 -0.45 118.68 128.96 2j1k s LEU 365 Ca -0.03 0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 53.16 2j1k s LEU 365 Cb -0.15 -1.98 0.03 0.00 0.03 0.00 0.00 46.19 44.12 2j1k s LEU 365 CO -0.06 0.31 0.68 -1.66 0.23 0.00 0.00 176.35 175.85 2j1k s TRP 366 N -0.44 0.10 -0.60 0.29 1.48 0.71 -0.04 118.94 120.44 2j1k s TRP 366 Ca 0.10 -0.59 0.24 0.00 -1.06 0.00 0.00 56.10 54.80 2j1k s TRP 366 Cb -0.12 0.60 0.37 0.00 -1.16 0.00 0.00 33.47 33.16 2j1k s TRP 366 CO 0.02 -1.29 1.37 1.79 -4.06 0.00 0.00 176.95 174.77 2j1k h THR 367 N 2.05 0.00 0.00 0.66 1.35 -1.51 -2.17 112.91 113.30 2j1k h THR 367 Ca -0.25 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 2j1k h THR 367 Cb 1.25 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2j1k h THR 367 CO 0.32 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.20 2j1k n GLY 368 N 1.30 -0.89 3.85 5.82 0.00 -1.26 -4.66 105.19 109.34 2j1k n GLY 368 Ca 0.03 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.81 3.26 -1.13 1.61 0.04 -1.26 -4.04 135.00 131.67 2j1k s PRO 369 Ca 0.00 0.81 -0.20 0.00 0.04 0.00 0.00 61.00 61.65 2j1k s PRO 369 Cb 0.00 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 2j1k s PRO 369 CO 0.00 -0.83 0.80 0.41 0.04 0.00 0.00 177.00 177.42 2j1k n GLY 370 N -2.45 -1.00 3.76 0.56 0.00 -1.26 -4.88 105.19 99.92 2j1k n GLY 370 Ca 0.07 0.46 -0.37 0.00 0.00 0.00 0.00 46.02 46.18 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 -5.91 3.26 1.02 1.61 0.04 -1.26 -5.03 135.00 128.73 2j1k s PRO 371 Ca 0.47 1.90 -0.16 0.00 0.04 0.00 0.00 61.00 63.26 2j1k s PRO 371 Cb -0.16 -2.15 0.21 0.00 0.04 0.00 0.00 34.50 32.43 2j1k s PRO 371 CO 0.86 -1.00 1.20 -1.54 0.04 0.00 0.00 177.00 176.56 2j1k s SER 372 N -1.37 2.58 -0.59 6.66 1.04 -1.26 -4.79 113.70 115.97 2j1k s SER 372 Ca 0.72 0.60 -0.28 0.00 0.48 0.00 0.00 55.95 57.47 2j1k s SER 372 Cb -0.32 -0.88 0.02 0.00 0.10 0.00 0.00 66.02 64.94 2j1k s SER 372 CO 0.37 -3.09 1.33 -0.63 0.98 0.00 0.00 173.24 172.20 2j1k s ILE 373 N -3.43 3.85 0.00 -1.02 1.01 -1.26 -3.81 121.20 116.54 2j1k s ILE 373 Ca 0.70 0.71 0.00 0.00 0.00 0.00 0.00 60.65 62.06 2j1k s ILE 373 Cb -0.09 -4.58 0.00 0.00 0.01 0.00 0.00 42.46 37.80 2j1k s ILE 373 CO 0.54 -1.30 0.61 -0.46 0.00 0.00 0.00 174.94 174.33 2j1k n ASN 374 N 9.23 0.80 -4.30 3.58 0.23 -0.65 -4.83 115.26 119.32 2j1k n ASN 374 Ca 0.10 -1.35 -0.38 0.00 -0.53 0.00 0.00 54.58 52.43 2j1k n ASN 374 Cb 0.49 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.07 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 -0.35 1.84 -0.05 4.83 0.00 0.29 -4.15 107.32 109.74 2j1k s GLY 375 Ca 0.00 -1.68 -0.23 0.00 0.00 0.00 0.00 44.72 42.81 2j1k s GLY 375 CO 0.00 0.75 0.68 -1.36 0.00 0.00 0.00 173.10 173.17 2j1k s PHE 376 N 1.44 3.61 -0.09 1.90 0.08 -0.09 -0.87 117.98 123.96 2j1k s PHE 376 Ca -0.00 1.25 0.02 0.00 0.12 0.00 0.00 56.93 58.31 2j1k s PHE 376 Cb -0.19 -2.76 0.02 0.00 -0.57 0.00 0.00 43.02 39.52 2j1k s PHE 376 CO 0.03 0.16 -0.13 0.42 -0.10 0.00 0.00 175.22 175.60 2j1k s ILE 377 N 0.53 1.25 -1.59 0.64 1.01 -0.57 -4.79 121.20 117.68 2j1k s ILE 377 Ca 0.36 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.38 2j1k s ILE 377 Cb -0.18 -1.16 0.10 0.00 0.01 0.00 0.00 42.46 41.23 2j1k s ILE 377 CO 0.18 0.39 0.69 0.59 0.00 0.00 0.00 174.94 176.79 2j1k n ASN 378 N 4.17 -2.55 -0.42 3.58 3.02 -1.26 -2.38 115.26 119.40 2j1k n ASN 378 Ca -0.19 -0.98 -0.06 0.00 -0.03 0.00 0.00 54.58 53.32 2j1k n ASN 378 Cb 0.51 -2.97 -0.02 0.00 -0.61 0.00 0.00 39.78 36.69 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 -2.78 -4.38 -4.29 6.41 8.00 -1.26 -5.01 116.55 113.24 2j1k n ASP 379 Ca -0.05 0.14 -0.32 0.00 0.71 0.00 0.00 54.79 55.27 2j1k n ASP 379 Cb 0.56 -2.37 -0.16 0.00 -0.02 0.00 0.00 41.12 39.13 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 -1.97 2.19 -0.24 -3.53 2.01 -1.00 -5.09 115.64 108.00 2j1k s THR 380 Ca 0.00 -1.02 -0.29 0.00 0.31 0.00 0.00 61.69 60.69 2j1k s THR 380 Cb 0.00 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.69 2j1k s THR 380 CO 0.00 0.57 1.49 -2.16 -0.69 0.00 0.00 174.62 173.83 2j1k s PRO 381 N -0.21 3.86 0.00 4.92 0.04 -1.26 -1.51 135.00 140.84 2j1k s PRO 381 Ca -0.02 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.54 2j1k s PRO 381 Cb -0.13 -3.97 0.00 0.00 0.04 0.00 0.00 34.50 30.44 2j1k s PRO 381 CO 0.03 -1.20 0.00 1.33 0.04 0.00 0.00 177.00 177.20 2j1k n VAL 382 N 6.28 0.00 -4.26 -0.36 0.24 -0.05 -4.91 118.33 115.28 2j1k n VAL 382 Ca 0.17 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 62.13 2j1k n VAL 382 Cb 0.46 0.29 -0.12 0.00 -1.47 0.00 0.00 33.84 32.99 2j1k n VAL 382 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2j1k s ILE 383 N -1.60 3.84 -0.52 1.34 -1.09 -0.74 0.01 121.20 122.43 2j1k s ILE 383 Ca 0.00 -0.36 -0.22 0.00 -2.23 0.00 0.00 60.65 57.83 2j1k s ILE 383 Cb 0.00 -2.71 0.04 0.00 -1.58 0.00 0.00 42.46 38.22 2j1k s ILE 383 CO 0.00 0.46 0.82 -0.60 -1.23 0.00 0.00 174.94 174.39 2j1k s ARG 384 N 0.68 3.28 -0.32 2.79 3.52 0.58 -0.55 118.95 128.94 2j1k s ARG 384 Ca -0.02 -0.43 -0.09 0.00 -0.13 0.00 0.00 55.73 55.07 2j1k s ARG 384 Cb -0.14 -4.05 0.01 0.00 -1.56 0.00 0.00 34.95 29.21 2j1k s ARG 384 CO 0.02 -1.34 0.14 0.00 -0.81 0.00 0.00 175.30 173.31 2j1k s PHE 386 N 1.56 3.23 -0.04 0.00 5.36 0.58 -4.79 117.98 123.87 2j1k s PHE 386 Ca 0.03 0.95 0.03 0.00 -0.96 0.00 0.00 56.93 56.98 2j1k s PHE 386 Cb -0.18 -3.23 0.00 0.00 -0.34 0.00 0.00 43.02 39.28 2j1k s PHE 386 CO 0.05 -0.55 -0.11 0.42 -1.46 0.00 0.00 175.22 173.57 2j1k s ILE 387 N 3.01 0.97 -0.07 3.12 1.01 -1.26 -0.83 121.20 127.15 2j1k s ILE 387 Ca 0.35 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.54 2j1k s ILE 387 Cb -0.14 -0.86 0.03 0.00 0.01 0.00 0.00 42.46 41.49 2j1k s ILE 387 CO 0.11 0.30 -0.01 0.00 0.00 0.00 0.00 174.94 175.35 2j1k s LEU 389 N 1.89 5.09 -0.29 0.00 1.43 0.94 -0.73 118.68 127.01 2j1k s LEU 389 Ca 0.04 -1.47 -0.07 0.00 -1.03 0.00 0.00 54.13 51.60 2j1k s LEU 389 Cb -0.12 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2j1k s LEU 389 CO -0.05 -0.52 0.08 -0.89 0.23 0.00 0.00 176.35 175.20 2j1k s THR 390 N 1.43 4.05 -0.24 5.49 2.01 0.17 -1.34 115.64 127.20 2j1k s THR 390 Ca 0.03 -0.61 -0.15 0.00 0.31 0.00 0.00 61.69 61.27 2j1k s THR 390 Cb -0.23 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 2j1k s THR 390 CO 0.02 0.11 0.36 -0.60 -0.69 0.00 0.00 174.62 173.83 2j1k s ARG 391 N 1.52 4.08 0.00 4.92 6.06 -0.01 -0.52 118.95 135.00 2j1k s ARG 391 Ca 0.03 0.07 0.00 0.00 -2.50 0.00 0.00 55.73 53.33 2j1k s ARG 391 Cb -0.17 -3.60 0.00 0.00 0.06 0.00 0.00 34.95 31.24 2j1k s ARG 391 CO 0.03 -0.17 0.00 -0.25 -2.50 0.00 0.00 175.30 172.41 2j1k n ASP 392 N 4.95 0.00 -0.05 -2.12 8.00 -0.99 -1.76 116.55 124.57 2j1k n ASP 392 Ca -0.09 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.29 2j1k n ASP 392 Cb 0.51 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.61 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 0.83 0.00 -2.24 4.64 -1.96 -3.42 113.55 111.40 2j1k h SER 393 Ca 0.00 -0.43 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2j1k h SER 393 Cb 0.00 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 2j1k h SER 393 CO 0.00 1.19 0.00 -3.20 -0.87 0.00 0.00 176.83 173.95 2j1k n ASN 394 N -4.00 0.00 -4.90 4.97 5.15 -1.26 -5.05 115.26 110.17 2j1k n ASN 394 Ca -0.03 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.63 2j1k n ASN 394 Cb 0.60 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.81 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 -2.56 4.31 -0.23 1.20 1.43 -1.26 -0.54 118.68 121.03 2j1k s LEU 395 Ca 0.00 0.51 -0.09 0.00 -1.03 0.00 0.00 54.13 53.52 2j1k s LEU 395 Cb 0.00 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 2j1k s LEU 395 CO 0.00 0.12 0.12 -0.69 0.23 0.00 0.00 176.35 176.13 2j1k s VAL 396 N -1.55 5.08 -0.20 -1.59 1.01 0.33 -2.35 120.40 121.13 2j1k s VAL 396 Ca 0.37 0.08 -0.17 0.00 0.00 0.00 0.00 61.98 62.26 2j1k s VAL 396 Cb -0.13 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 2j1k s VAL 396 CO 0.24 0.37 0.47 -0.89 0.00 0.00 0.00 175.10 175.29 2j1k s THR 397 N 0.95 5.15 -0.35 3.92 2.01 0.32 -1.97 115.64 125.67 2j1k s THR 397 Ca 0.06 0.85 -0.20 0.00 0.31 0.00 0.00 61.69 62.71 2j1k s THR 397 Cb -0.13 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.58 2j1k s THR 397 CO 0.03 0.21 0.61 -0.69 -0.69 0.00 0.00 174.62 174.09 2j1k s VAL 398 N 1.47 4.92 -0.17 3.82 1.01 0.33 -0.66 120.40 131.13 2j1k s VAL 398 Ca 0.22 0.55 -0.00 0.00 0.00 0.00 0.00 61.98 62.75 2j1k s VAL 398 Cb -0.15 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2j1k s VAL 398 CO 0.09 -0.28 -0.15 0.21 0.00 0.00 0.00 175.10 174.98 2j1k s ASN 399 N 1.77 3.63 0.00 3.32 3.84 0.09 -1.11 114.94 126.49 2j1k s ASN 399 Ca 0.23 -0.49 -0.19 0.00 0.21 0.00 0.00 52.86 52.62 2j1k s ASN 399 Cb -0.15 -1.57 0.03 0.00 -0.55 0.00 0.00 41.25 39.02 2j1k s ASN 399 CO 0.14 0.06 0.40 0.00 -2.79 0.00 0.00 177.10 174.91 2j1k s ALA 400 N 0.98 -1.01 0.00 1.71 0.00 -0.36 -0.43 121.76 122.64 2j1k s ALA 400 Ca -0.02 0.47 -0.13 0.00 0.00 0.00 0.00 51.96 52.27 2j1k s ALA 400 Cb -0.15 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.15 2j1k s ALA 400 CO -0.03 -0.35 0.28 -1.54 0.00 0.00 0.00 175.76 174.12 2j1k s SER 401 N -1.56 -0.14 -0.03 0.00 1.04 -0.01 0.16 113.70 113.17 2j1k s SER 401 Ca -0.10 -0.03 0.02 0.00 0.48 0.00 0.00 55.95 56.32 2j1k s SER 401 Cb -0.03 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.41 2j1k s SER 401 CO 0.03 -0.47 -0.06 -0.36 0.98 0.00 0.00 173.24 173.35 2j1k s PHE 402 N -1.61 0.74 -0.17 5.02 0.08 -1.26 -0.31 117.98 120.46 2j1k s PHE 402 Ca -0.12 -0.18 0.01 0.00 0.12 0.00 0.00 56.93 56.76 2j1k s PHE 402 Cb -0.05 -0.57 0.03 0.00 -0.57 0.00 0.00 43.02 41.86 2j1k s PHE 402 CO 0.02 -0.11 -0.16 0.08 -0.10 0.00 0.00 175.22 174.95 2j1k s VAL 403 N 0.42 1.80 0.36 -0.44 1.01 -0.10 -1.00 120.40 122.44 2j1k s VAL 403 Ca -0.06 -0.84 -0.27 0.00 0.00 0.00 0.00 61.98 60.81 2j1k s VAL 403 Cb -0.10 -1.69 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 2j1k s VAL 403 CO 0.00 0.43 1.19 -0.83 0.00 0.00 0.00 175.10 175.90 2j1k s GLY 404 N 1.38 2.95 0.23 4.51 0.00 -0.11 -0.30 107.32 115.98 2j1k s GLY 404 Ca 0.04 1.04 0.09 0.00 0.00 0.00 0.00 44.72 45.89 2j1k s GLY 404 CO -0.11 1.61 -0.16 -0.54 0.00 0.00 0.00 173.10 173.90 2j1k s GLU 405 N -1.98 1.46 7.75 2.90 0.41 0.10 -3.72 118.70 125.62 2j1k s GLU 405 Ca 0.52 -1.66 0.00 0.00 -0.41 0.00 0.00 54.97 53.42 2j1k s GLU 405 Cb -0.34 -1.36 0.00 0.00 -1.78 0.00 0.00 34.13 30.65 2j1k s GLU 405 CO 0.43 0.24 0.00 0.41 -0.49 0.00 0.00 175.26 175.85 2j1k n GLY 406 N -0.47 3.17 0.00 -1.39 0.00 -1.26 -1.88 105.19 103.35 2j1k n GLY 406 Ca -0.07 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 45.88 2j1k n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j1k n GLY 407 N 0.00 -1.02 0.92 -0.02 0.00 -1.26 -2.64 105.19 101.16 2j1k n GLY 407 Ca 0.00 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.02 2j1k n GLY 407 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j1k n TYR 408 N -1.37 0.52 -0.34 1.61 4.01 -0.79 -4.52 117.16 116.28 2j1k n TYR 408 Ca 0.08 -0.35 -0.04 0.00 -0.16 0.00 0.00 57.90 57.42 2j1k n TYR 408 Cb 0.18 -0.01 0.09 0.00 -0.31 0.00 0.00 39.34 39.29 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 3.26 1.25 -5.46 -0.72 2.43 -1.56 -3.35 114.38 110.22 2j1k h ARG 409 Ca 0.00 -0.13 -0.68 0.00 -0.81 0.00 0.00 59.98 58.36 2j1k h ARG 409 Cb 0.83 -0.25 -0.33 0.00 -0.42 0.00 0.00 29.97 29.79 2j1k h ARG 409 CO 0.00 0.89 -0.88 0.42 -1.51 0.00 0.00 179.97 178.89 2j1k s ILE 410 N -5.91 2.06 0.08 1.20 -1.09 -1.26 -0.80 121.20 115.48 2j1k s ILE 410 Ca -0.13 -1.03 0.07 0.00 -2.23 0.00 0.00 60.65 57.34 2j1k s ILE 410 Cb 0.17 -1.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.24 2j1k s ILE 410 CO 0.82 0.56 -0.15 0.68 -1.23 0.00 0.00 174.94 175.63 2j1k s VAL 411 N 0.25 3.06 0.36 2.92 -7.23 -0.37 -4.91 120.40 114.48 2j1k s VAL 411 Ca -0.16 -1.25 0.08 0.00 -1.81 0.00 0.00 61.98 58.83 2j1k s VAL 411 Cb -0.17 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2j1k s VAL 411 CO 0.08 0.21 0.22 -0.94 -0.31 0.00 0.00 175.10 174.36 2j1k s SER 412 N -1.85 4.84 0.57 4.85 1.04 -1.26 -0.68 113.70 121.22 2j1k s SER 412 Ca 0.18 -0.75 0.27 0.00 0.48 0.00 0.00 55.95 56.13 2j1k s SER 412 Cb -0.11 -0.72 1.63 0.00 0.10 0.00 0.00 66.02 66.91 2j1k s SER 412 CO 0.09 -0.40 2.15 -0.65 0.98 0.00 0.00 173.24 175.41 2j1k h PRO 413 N 1.38 0.00 -0.50 4.02 0.11 -1.77 -2.12 132.00 133.12 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 0.62 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.66 2j1k n THR 414 N -3.99 0.69 -1.71 -1.15 -2.24 -1.26 -1.67 114.28 102.95 2j1k n THR 414 Ca -0.00 -0.67 -0.43 0.00 -2.27 0.00 0.00 64.05 60.69 2j1k n THR 414 Cb 0.23 0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.93 2.25 -1.82 -0.78 -0.06 -0.80 -4.92 117.38 112.18 2j1k n GLN 415 Ca 0.17 0.80 -0.42 0.00 -2.00 0.00 0.00 57.00 55.54 2j1k n GLN 415 Cb 0.43 -2.44 -0.03 0.00 -4.06 0.00 0.00 30.24 24.13 2j1k n GLN 415 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2j1k s SER 416 N -0.00 6.47 0.66 1.69 0.15 -1.26 -4.76 113.70 116.65 2j1k s SER 416 Ca 0.60 2.77 -0.16 0.00 0.70 0.00 0.00 55.95 59.86 2j1k s SER 416 Cb -0.57 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.14 2j1k s SER 416 CO 0.57 -0.90 1.17 -1.10 1.20 0.00 0.00 173.24 174.19 2j1k s GLN 417 N 0.91 2.61 0.15 5.44 -0.21 -1.26 -5.03 119.66 122.27 2j1k s GLN 417 Ca 0.71 1.66 -0.18 0.00 0.02 0.00 0.00 55.36 57.57 2j1k s GLN 417 Cb -0.47 -1.90 0.04 0.00 1.00 0.00 0.00 33.01 31.68 2j1k s GLN 417 CO 0.34 -1.45 0.48 -0.59 -2.12 0.00 0.00 175.29 171.95 2j1k s PHE 418 N -1.97 -0.26 -0.06 0.91 -0.12 -0.97 -5.01 117.98 110.50 2j1k s PHE 418 Ca 0.73 -0.04 0.04 0.00 -0.05 0.00 0.00 56.93 57.61 2j1k s PHE 418 Cb -0.27 0.37 -0.02 0.00 -0.63 0.00 0.00 43.02 42.48 2j1k s PHE 418 CO 0.40 -0.80 -0.19 -1.12 -0.05 0.00 0.00 175.22 173.46 2j1k s SER 419 N -2.81 3.60 -0.35 1.98 0.01 -1.26 -0.62 113.70 114.25 2j1k s SER 419 Ca 0.04 -0.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.90 2j1k s SER 419 Cb 0.00 -0.91 0.05 0.00 0.21 0.00 0.00 66.02 65.37 2j1k s SER 419 CO -0.09 0.28 0.11 -0.76 0.41 0.00 0.00 173.24 173.19 2j1k s LEU 420 N -0.35 4.42 -0.23 2.44 1.43 0.59 -4.95 118.68 122.04 2j1k s LEU 420 Ca 0.03 -1.29 -0.11 0.00 -1.03 0.00 0.00 54.13 51.73 2j1k s LEU 420 Cb -0.12 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 2j1k s LEU 420 CO 0.02 -0.36 0.16 -0.63 0.23 0.00 0.00 176.35 175.77 2j1k s ILE 421 N 1.35 5.37 -0.24 -0.59 1.01 -1.26 -1.28 121.20 125.56 2j1k s ILE 421 Ca -0.01 0.20 -0.11 0.00 0.00 0.00 0.00 60.65 60.73 2j1k s ILE 421 Cb -0.20 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 2j1k s ILE 421 CO 0.01 0.37 0.19 -0.04 0.00 0.00 0.00 174.94 175.48 2j1k s MET 422 N 0.86 4.08 -0.16 2.79 -1.94 0.37 -0.90 119.30 124.40 2j1k s MET 422 Ca 0.08 -0.21 -0.04 0.00 -1.71 0.00 0.00 55.69 53.82 2j1k s MET 422 Cb -0.13 -3.54 -0.03 0.00 2.01 0.00 0.00 34.83 33.14 2j1k s MET 422 CO 0.03 0.04 -0.04 -1.21 -0.01 0.00 0.00 175.02 173.83 2j1k s GLU 423 N 1.11 3.66 0.04 2.03 2.02 -1.26 -1.54 118.70 124.76 2j1k s GLU 423 Ca 0.09 -0.53 0.08 0.00 0.02 0.00 0.00 54.97 54.63 2j1k s GLU 423 Cb -0.14 -2.90 -0.03 0.00 0.10 0.00 0.00 34.13 31.16 2j1k s GLU 423 CO 0.05 0.23 -0.24 -0.06 0.02 0.00 0.00 175.26 175.27 2j1k s PHE 424 N 0.38 2.08 1.05 1.61 0.08 -0.04 0.20 117.98 123.34 2j1k s PHE 424 Ca -0.04 -0.39 -0.17 0.00 0.12 0.00 0.00 56.93 56.45 2j1k s PHE 424 Cb -0.14 -1.25 0.22 0.00 -0.57 0.00 0.00 43.02 41.28 2j1k s PHE 424 CO 0.03 0.10 1.21 0.16 -0.10 0.00 0.00 175.22 176.62 2j1k s ASP 425 N -1.15 2.33 0.13 1.36 1.47 -0.48 -1.53 116.67 118.79 2j1k s ASP 425 Ca 0.10 0.51 0.12 0.00 1.18 0.00 0.00 52.55 54.46 2j1k s ASP 425 Cb -0.09 -0.71 0.58 0.00 -0.34 0.00 0.00 42.92 42.35 2j1k s ASP 425 CO 0.02 -3.24 1.37 0.00 0.68 0.00 0.00 175.17 173.99 2j1k n GLN 426 N -4.15 0.07 -0.15 2.11 0.00 -1.26 -1.65 117.38 112.34 2j1k n GLN 426 Ca 0.13 0.49 0.08 0.00 0.00 0.00 0.00 57.00 57.69 2j1k n GLN 426 Cb 0.59 -1.68 0.15 0.00 0.00 0.00 0.00 30.24 29.30 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 -1.82 0.40 -0.84 2.61 3.72 -1.26 -4.94 117.46 115.33 2j1k n PHE 427 Ca 0.00 -0.32 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 2j1k n PHE 427 Cb 0.07 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 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 0.86 0.49 3.71 1.37 0.00 -0.66 -3.20 105.19 107.76 2j1k n GLY 428 Ca 0.13 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 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 4.24 0.30 1.61 -0.21 -1.26 -4.69 119.66 118.19 2j1k s GLN 429 Ca 0.00 0.14 -0.30 0.00 0.02 0.00 0.00 55.36 55.23 2j1k s GLN 429 Cb 0.00 -3.46 -0.11 0.00 1.00 0.00 0.00 33.01 30.44 2j1k s GLN 429 CO 0.00 0.15 1.58 -1.17 -2.12 0.00 0.00 175.29 173.73 2j1k s LEU 430 N 0.74 4.34 0.47 2.90 2.96 -1.26 -1.38 118.68 127.45 2j1k s LEU 430 Ca 0.18 2.97 0.03 0.00 -0.22 0.00 0.00 54.13 57.09 2j1k s LEU 430 Cb -0.14 -3.64 0.01 0.00 0.50 0.00 0.00 46.19 42.93 2j1k s LEU 430 CO 0.06 -0.91 0.67 -0.04 -1.32 0.00 0.00 176.35 174.80 2j1k s MET 431 N -0.71 2.80 0.00 1.98 -1.94 0.13 -4.45 119.30 117.11 2j1k s MET 431 Ca 0.62 -0.82 0.29 0.00 -1.71 0.00 0.00 55.69 54.07 2j1k s MET 431 Cb -0.48 -2.60 1.31 0.00 2.01 0.00 0.00 34.83 35.07 2j1k s MET 431 CO 0.50 -0.42 1.91 -1.13 -0.01 0.00 0.00 175.02 175.87 2j1k n SER 432 N -2.10 0.34 -0.00 3.03 3.41 -1.26 -1.65 113.62 115.39 2j1k n SER 432 Ca 0.05 -0.47 0.10 0.00 -0.26 0.00 0.00 58.87 58.29 2j1k n SER 432 Cb 0.59 -0.12 -0.12 0.00 -0.26 0.00 0.00 64.21 64.29 2j1k n SER 432 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2j1k n THR 433 N -1.05 0.00 -2.01 6.66 -2.24 -1.26 -4.71 114.28 109.67 2j1k n THR 433 Ca 0.14 -0.10 -0.29 0.00 -2.27 0.00 0.00 64.05 61.54 2j1k n THR 433 Cb 0.27 0.83 0.14 0.00 -2.10 0.00 0.00 70.33 69.46 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 -3.18 1.72 0.44 3.38 0.00 -1.26 -4.98 107.32 103.44 2j1k s GLY 434 Ca 0.05 -1.07 0.21 0.00 0.00 0.00 0.00 44.72 43.91 2j1k s GLY 434 CO 0.84 -0.44 1.89 3.43 0.00 0.00 0.00 173.10 178.82 2j1k h ASN 435 N -1.27 0.00 -3.21 1.64 4.21 -1.33 -3.37 115.58 112.24 2j1k h ASN 435 Ca -0.44 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.40 2j1k h ASN 435 Cb 1.27 0.00 -0.34 0.00 -1.12 0.00 0.00 38.32 38.13 2j1k h ASN 435 CO 0.48 0.26 -0.83 -0.63 -1.29 0.00 0.00 177.43 175.42 2j1k s ILE 436 N -3.96 2.30 0.31 2.81 1.01 -0.92 -0.91 121.20 121.84 2j1k s ILE 436 Ca -0.02 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.71 2j1k s ILE 436 Cb 0.12 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.54 2j1k s ILE 436 CO 0.65 0.45 0.32 0.54 0.00 0.00 0.00 174.94 176.90 2j1k s ASN 437 N 1.30 1.19 0.00 3.58 2.20 -1.26 -4.28 114.94 117.68 2j1k s ASN 437 Ca 0.04 -1.60 0.09 0.00 -0.94 0.00 0.00 52.86 50.44 2j1k s ASN 437 Cb -0.14 0.57 0.48 0.00 -2.00 0.00 0.00 41.25 40.15 2j1k s ASN 437 CO -0.10 -1.11 1.11 -1.54 -2.94 0.00 0.00 177.10 172.52 2j1k n SER 438 N -1.30 0.00 -0.04 3.54 3.41 -0.66 -2.19 113.62 116.38 2j1k n SER 438 Ca 0.05 0.02 0.15 0.00 -0.26 0.00 0.00 58.87 58.82 2j1k n SER 438 Cb 0.63 -0.20 0.71 0.00 -0.26 0.00 0.00 64.21 65.09 2j1k n SER 438 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2j1k n THR 439 N -1.20 0.00 -4.31 6.66 -2.24 -1.26 -4.84 114.28 107.09 2j1k n THR 439 Ca 0.05 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.55 2j1k n THR 439 Cb 0.06 -0.35 -0.09 0.00 -2.10 0.00 0.00 70.33 67.84 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 -2.53 3.10 -0.09 4.28 2.01 -0.93 -5.07 115.64 116.41 2j1k s THR 440 Ca 0.29 -1.78 -0.36 0.00 0.31 0.00 0.00 61.69 60.15 2j1k s THR 440 Cb 0.20 -2.55 -0.14 0.00 0.01 0.00 0.00 72.50 70.02 2j1k s THR 440 CO 0.47 -0.16 1.75 0.41 -0.69 0.00 0.00 174.62 176.39 2j1k n THR 441 N -0.11 0.37 -3.64 -0.82 -1.04 -1.26 -4.93 114.28 102.85 2j1k n THR 441 Ca -0.10 -0.07 -0.05 0.00 -2.04 0.00 0.00 64.05 61.80 2j1k n THR 441 Cb 0.56 -1.55 -0.07 0.00 -1.82 0.00 0.00 70.33 67.46 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 3.15 -0.58 -1.88 -1.42 -0.11 -1.26 -4.53 118.94 112.30 2j1k s TRP 442 Ca 0.92 1.22 0.00 0.00 1.22 0.00 0.00 56.10 59.46 2j1k s TRP 442 Cb -0.82 0.37 0.00 0.00 -1.50 0.00 0.00 33.47 31.52 2j1k s TRP 442 CO 0.53 -0.29 0.00 0.41 -4.62 0.00 0.00 176.95 172.99 2j1k n GLY 443 N 3.32 -0.69 3.80 5.86 0.00 -0.81 -4.59 105.19 112.07 2j1k n GLY 443 Ca -0.17 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.75 4.34 -0.37 1.61 2.12 0.38 -0.20 118.70 125.82 2j1k s GLU 444 Ca 0.00 0.94 -0.17 0.00 0.36 0.00 0.00 54.97 56.10 2j1k s GLU 444 Cb 0.00 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.36 2j1k s GLU 444 CO 0.00 0.47 0.46 0.21 -0.54 0.00 0.00 175.26 175.86 2j1k s LYS 445 N -1.63 3.44 0.33 4.30 2.20 0.41 -0.46 119.74 128.33 2j1k s LYS 445 Ca 0.39 -0.41 -0.29 0.00 -0.36 0.00 0.00 55.97 55.31 2j1k s LYS 445 Cb -0.19 -3.86 -0.10 0.00 -1.51 0.00 0.00 37.83 32.17 2j1k s LYS 445 CO 0.22 -0.69 1.37 -2.14 -0.36 0.00 0.00 175.35 173.76 2j1k s PRO 446 N 2.24 4.28 0.08 4.03 0.02 -1.26 -4.53 135.00 139.86 2j1k s PRO 446 Ca 0.15 2.32 -0.31 0.00 0.02 0.00 0.00 61.00 63.18 2j1k s PRO 446 Cb -0.16 -3.05 -0.10 0.00 0.02 0.00 0.00 34.50 31.20 2j1k s PRO 446 CO 0.13 -0.31 1.90 1.87 -0.33 0.00 0.00 177.00 180.26 2j1k n TRP 447 N 1.01 2.56 0.00 6.54 -0.00 -1.26 -2.84 117.44 123.45 2j1k n TRP 447 Ca 0.01 -0.23 0.00 0.00 -0.00 0.00 0.00 57.50 57.28 2j1k n TRP 447 Cb 0.41 -2.76 0.00 0.00 -0.00 0.00 0.00 31.31 28.96 2j1k n TRP 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2j1k n GLY 448 N 4.37 0.66 3.56 5.87 0.00 -1.26 -5.07 105.19 113.32 2j1k n GLY 448 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.06 -0.26 1.61 2.20 -1.13 -5.06 114.94 110.24 2j1k s ASN 449 Ca 0.00 -0.97 0.13 0.00 -0.94 0.00 0.00 52.86 51.08 2j1k s ASN 449 Cb 0.00 0.57 0.77 0.00 -2.00 0.00 0.00 41.25 40.60 2j1k s ASN 449 CO 0.00 -1.12 1.74 0.59 -2.94 0.00 0.00 177.10 175.37 2j1k n ASN 450 N -0.39 5.29 -4.85 3.54 3.02 -1.26 -4.36 115.26 116.25 2j1k n ASN 450 Ca -0.01 -3.04 -0.31 0.00 -0.03 0.00 0.00 54.58 51.19 2j1k n ASN 450 Cb 0.62 -0.69 0.03 0.00 -0.61 0.00 0.00 39.78 39.13 2j1k n ASN 450 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2j1k s THR 451 N -2.86 4.30 -0.25 3.41 -4.23 -1.26 -4.58 115.64 110.16 2j1k s THR 451 Ca 0.54 0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 61.78 2j1k s THR 451 Cb 0.42 -3.65 0.03 0.00 1.34 0.00 0.00 72.50 70.64 2j1k s THR 451 CO 0.14 -0.97 -0.06 -0.69 -0.54 0.00 0.00 174.62 172.50 2j1k s VAL 452 N -3.16 2.83 -0.41 2.29 1.01 -1.26 -4.24 120.40 117.46 2j1k s VAL 452 Ca 0.57 -1.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 2j1k s VAL 452 Cb -0.12 -2.47 0.02 0.00 0.00 0.00 0.00 36.38 33.81 2j1k s VAL 452 CO 0.54 0.15 0.38 -1.10 0.00 0.00 0.00 175.10 175.07 2j1k s GLN 453 N 1.30 3.11 0.28 2.72 -1.52 0.40 -4.81 119.66 121.13 2j1k s GLN 453 Ca -0.01 -0.81 0.25 0.00 -1.95 0.00 0.00 55.36 52.84 2j1k s GLN 453 Cb -0.17 -3.95 0.72 0.00 -0.22 0.00 0.00 33.01 29.39 2j1k s GLN 453 CO -0.04 -0.77 1.74 -1.00 -0.25 0.00 0.00 175.29 174.96 2j1k h PRO 454 N 8.66 0.00 -6.30 2.91 0.13 -1.88 0.11 132.00 135.64 2j1k h PRO 454 Ca -0.27 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.29 2j1k h PRO 454 Cb 1.12 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 2j1k h PRO 454 CO 0.76 0.00 1.17 0.50 -0.23 0.00 0.00 178.00 180.20 2j1k s ARG 455 N -3.16 3.64 0.54 0.86 3.00 -1.26 -4.94 118.95 117.63 2j1k s ARG 455 Ca 0.09 1.55 -0.21 0.00 -1.00 0.00 0.00 55.73 56.16 2j1k s ARG 455 Cb 0.10 -4.09 -0.05 0.00 0.00 0.00 0.00 34.95 30.92 2j1k s ARG 455 CO 0.60 -1.48 1.26 -2.14 0.00 0.00 0.00 175.30 173.53 2j1k s PRO 456 N 4.99 3.26 0.14 5.12 0.02 -1.26 -4.93 135.00 142.34 2j1k s PRO 456 Ca 0.74 1.98 0.08 0.00 0.02 0.00 0.00 61.00 63.81 2j1k s PRO 456 Cb -0.24 -2.20 -0.04 0.00 0.02 0.00 0.00 34.50 32.05 2j1k s PRO 456 CO 0.31 -1.01 -0.18 0.45 -0.33 0.00 0.00 177.00 176.23 2j1k s SER 457 N -1.27 2.53 0.54 2.53 0.15 -1.26 -5.02 113.70 111.90 2j1k s SER 457 Ca 0.71 -0.80 0.26 0.00 0.70 0.00 0.00 55.95 56.82 2j1k s SER 457 Cb -0.34 -0.14 1.41 0.00 -1.71 0.00 0.00 66.02 65.25 2j1k s SER 457 CO 0.39 -0.02 1.99 1.12 1.20 0.00 0.00 173.24 177.92 2j1k h HIS 458 N 3.54 0.00 0.00 3.44 2.07 -1.97 -1.94 115.15 120.29 2j1k h HIS 458 Ca -0.43 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.09 2j1k h HIS 458 Cb 1.20 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.18 2j1k h HIS 458 CO 0.66 0.00 -0.01 1.79 -3.07 0.00 0.00 177.93 177.30 2j1k h THR 459 N 0.00 0.09 -0.06 6.12 1.35 -1.95 -2.99 112.91 115.47 2j1k h THR 459 Ca 0.25 -0.13 0.02 0.00 -0.55 0.00 0.00 66.41 65.99 2j1k h THR 459 Cb 1.01 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 68.55 2j1k h THR 459 CO -0.00 0.01 0.04 -0.50 -0.25 0.00 0.00 175.52 174.82 2j1k h TRP 460 N 0.00 0.00 -0.13 4.73 4.06 -1.59 -1.22 115.95 121.80 2j1k h TRP 460 Ca -0.00 0.00 0.04 0.00 2.06 0.00 0.00 58.89 60.99 2j1k h TRP 460 Cb 0.12 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.27 2j1k h TRP 460 CO 0.00 0.00 0.12 -0.22 -3.56 0.00 0.00 178.44 174.78 2j1k h LYS 461 N 0.00 0.00 0.00 0.49 3.64 -1.49 -2.21 116.57 117.00 2j1k h LYS 461 Ca 0.03 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2j1k h LYS 461 Cb 0.11 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2j1k h LYS 461 CO -0.00 0.00 -0.06 -0.07 -2.27 0.00 0.00 179.45 177.05 2j1k h LEU 462 N 0.00 0.00 -0.24 5.20 3.38 -1.42 -1.83 115.31 120.40 2j1k h LEU 462 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2j1k h LEU 462 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2j1k h LEU 462 CO -0.00 0.06 -0.05 0.00 0.09 0.00 0.00 178.44 178.54 2j1k s MET 464 N -2.28 4.08 -0.14 0.00 -1.94 -0.69 -4.90 119.30 113.43 2j1k s MET 464 Ca 0.36 0.77 -0.29 0.00 -1.71 0.00 0.00 55.69 54.82 2j1k s MET 464 Cb 0.21 -2.45 -0.04 0.00 2.01 0.00 0.00 34.83 34.55 2j1k s MET 464 CO 0.42 0.16 1.72 -1.25 -0.01 0.00 0.00 175.02 176.06 2j1k s PRO 465 N -2.88 3.90 -0.48 2.03 0.04 -1.26 -0.33 135.00 136.01 2j1k s PRO 465 Ca 0.54 1.97 -0.45 0.00 0.04 0.00 0.00 61.00 63.10 2j1k s PRO 465 Cb -0.11 -4.06 -0.19 0.00 0.04 0.00 0.00 34.50 30.18 2j1k s PRO 465 CO 0.17 -1.19 1.77 -1.71 0.04 0.00 0.00 177.00 176.08 2j1k n ASN 466 N 8.22 1.21 0.18 6.66 2.85 -0.13 -4.70 115.26 129.55 2j1k n ASN 466 Ca 0.19 1.03 0.03 0.00 -0.11 0.00 0.00 54.58 55.72 2j1k n ASN 466 Cb 0.44 -0.92 0.32 0.00 1.24 0.00 0.00 39.78 40.86 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 6.41 0.00 0.18 1.20 0.11 -1.91 0.20 114.38 120.58 2j1k h ARG 467 Ca -0.35 0.00 -0.30 0.00 0.10 0.00 0.00 59.98 59.43 2j1k h ARG 467 Cb 1.38 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.48 2j1k h ARG 467 CO 1.01 0.43 -1.34 1.49 0.10 0.00 0.00 179.97 181.67 2j1k h GLU 468 N 0.00 0.42 -0.28 0.08 4.81 -1.98 -2.34 114.58 115.29 2j1k h GLU 468 Ca -0.00 -0.69 -0.08 0.00 -0.13 0.00 0.00 59.36 58.45 2j1k h GLU 468 Cb 0.85 0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 2j1k h GLU 468 CO 0.06 1.32 -0.15 0.28 -0.73 0.00 0.00 179.01 179.79 2j1k h VAL 469 N 0.13 1.30 -2.25 0.32 2.07 -1.89 -3.28 116.25 112.64 2j1k h VAL 469 Ca -0.19 -1.26 -0.76 0.00 0.82 0.00 0.00 66.70 65.32 2j1k h VAL 469 Cb 2.04 1.53 -0.31 0.00 -1.52 0.00 0.00 31.29 33.03 2j1k h VAL 469 CO 0.24 0.40 0.63 -1.22 0.02 0.00 0.00 177.57 177.64 2j1k n TYR 470 N -4.42 3.09 0.14 1.57 4.01 0.69 -4.68 117.16 117.56 2j1k n TYR 470 Ca -0.04 -2.90 0.03 0.00 -0.16 0.00 0.00 57.90 54.83 2j1k n TYR 470 Cb 0.38 -1.03 0.03 0.00 -0.31 0.00 0.00 39.34 38.41 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 3.89 0.00 -3.70 7.72 4.64 -1.48 -3.43 113.55 121.20 2j1k h SER 471 Ca 0.44 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 61.09 2j1k h SER 471 Cb 0.36 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.27 2j1k h SER 471 CO 1.10 0.46 -0.79 0.42 -0.87 0.00 0.00 176.83 177.14 2j1k s THR 472 N -2.98 2.95 0.30 2.95 -4.23 -1.26 -5.08 115.64 108.29 2j1k s THR 472 Ca 0.04 -1.44 -0.29 0.00 -1.18 0.00 0.00 61.69 58.82 2j1k s THR 472 Cb 0.07 -2.36 -0.13 0.00 1.34 0.00 0.00 72.50 71.43 2j1k s THR 472 CO 0.74 0.11 1.30 -2.65 -0.54 0.00 0.00 174.62 173.58 2j1k n PRO 473 N 0.81 1.99 -4.31 3.99 -0.02 -1.26 -4.97 135.00 131.24 2j1k n PRO 473 Ca -0.15 0.70 -0.24 0.00 -2.02 0.00 0.00 63.50 61.79 2j1k n PRO 473 Cb 0.53 -2.28 -0.08 0.00 -0.02 0.00 0.00 33.50 31.64 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 -0.72 3.18 0.02 3.55 0.00 -0.70 -4.94 121.76 122.16 2j1k s ALA 474 Ca 0.60 -1.85 -0.06 0.00 0.00 0.00 0.00 51.96 50.65 2j1k s ALA 474 Cb -0.62 -0.52 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2j1k s ALA 474 CO 0.57 0.14 0.12 0.00 0.00 0.00 0.00 175.76 176.59 2j1k s ALA 475 N -2.45 -0.21 -0.17 0.00 0.00 -1.26 0.42 121.76 118.08 2j1k s ALA 475 Ca 0.34 -0.32 -0.05 0.00 0.00 0.00 0.00 51.96 51.93 2j1k s ALA 475 Cb -0.03 0.18 0.06 0.00 0.00 0.00 0.00 23.12 23.33 2j1k s ALA 475 CO 0.19 -0.26 0.09 0.99 0.00 0.00 0.00 175.76 176.78 2j1k s THR 476 N -1.91 -0.09 -0.18 0.00 2.01 0.04 -5.00 115.64 110.51 2j1k s THR 476 Ca -0.11 -0.16 -0.16 0.00 0.31 0.00 0.00 61.69 61.58 2j1k s THR 476 Cb -0.05 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 2j1k s THR 476 CO -0.01 -0.28 0.40 -0.51 -0.69 0.00 0.00 174.62 173.53 2j1k s ILE 477 N 2.14 5.21 0.07 1.82 2.07 -1.26 -0.76 121.20 130.50 2j1k s ILE 477 Ca 0.02 0.74 0.04 0.00 -1.41 0.00 0.00 60.65 60.04 2j1k s ILE 477 Cb -0.16 -3.74 -0.03 0.00 0.13 0.00 0.00 42.46 38.67 2j1k s ILE 477 CO -0.09 0.29 -0.11 -0.44 -1.91 0.00 0.00 174.94 172.67 2j1k s SER 478 N 0.86 1.37 0.31 4.50 0.01 -0.44 -4.97 113.70 115.34 2j1k s SER 478 Ca 0.20 -0.65 -0.28 0.00 1.31 0.00 0.00 55.95 56.54 2j1k s SER 478 Cb -0.14 -0.01 -0.13 0.00 0.21 0.00 0.00 66.02 65.94 2j1k s SER 478 CO 0.08 -0.16 1.13 -1.14 0.41 0.00 0.00 173.24 173.55 2j1k n ARG 479 N 1.15 1.67 -3.70 12.44 0.63 -1.26 -0.63 116.66 126.97 2j1k n ARG 479 Ca -0.20 0.59 -0.30 0.00 -0.92 0.00 0.00 57.85 57.02 2j1k n ARG 479 Cb 0.55 -2.04 -0.13 0.00 0.45 0.00 0.00 32.46 31.28 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 0.65 2.93 -0.07 0.00 0.00 -1.26 -1.36 107.32 108.20 2j1k s GLY 481 Ca 0.16 1.50 0.04 0.00 0.00 0.00 0.00 44.72 46.42 2j1k s GLY 481 CO -0.04 2.14 -0.19 1.08 0.00 0.00 0.00 173.10 176.09 2j1k s LEU 482 N -2.51 2.40 -1.62 0.66 1.43 -0.44 -0.31 118.68 118.27 2j1k s LEU 482 Ca 0.58 -0.39 -0.13 0.00 -1.03 0.00 0.00 54.13 53.16 2j1k s LEU 482 Cb -0.45 -1.48 0.11 0.00 0.03 0.00 0.00 46.19 44.41 2j1k s LEU 482 CO 0.59 0.25 0.67 -0.67 0.23 0.00 0.00 176.35 177.42 2j1k n ASP 483 N 2.91 -2.44 0.02 2.29 2.03 0.12 -4.80 116.55 116.69 2j1k n ASP 483 Ca -0.18 -1.02 -0.02 0.00 0.52 0.00 0.00 54.79 54.10 2j1k n ASP 483 Cb 0.52 -2.81 0.25 0.00 -0.72 0.00 0.00 41.12 38.37 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 -1.61 0.45 0.03 1.67 0.02 -1.85 -1.43 113.55 110.82 2j1k h SER 484 Ca -0.60 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.22 2j1k h SER 484 Cb 1.38 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2j1k h SER 484 CO 0.74 0.64 -0.01 0.40 -1.14 0.00 0.00 176.83 177.45 2j1k h ILE 485 N 0.43 1.31 -0.76 3.27 2.04 -1.95 0.11 117.51 121.96 2j1k h ILE 485 Ca 0.08 -1.08 -0.05 0.00 1.00 0.00 0.00 64.86 64.81 2j1k h ILE 485 Cb 0.53 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 2j1k h ILE 485 CO 0.03 0.27 0.30 0.00 0.00 0.00 0.00 178.15 178.75 2j1k h ALA 486 N 0.44 1.09 -0.14 1.87 0.00 -1.88 -2.06 119.26 118.58 2j1k h ALA 486 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2j1k h ALA 486 Cb 0.48 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2j1k h ALA 486 CO 0.01 0.65 0.00 1.33 0.00 0.00 0.00 179.25 181.23 2j1k n VAL 487 N -4.28 0.17 -4.09 0.00 0.24 -0.57 -4.95 118.33 104.86 2j1k n VAL 487 Ca 0.07 -0.34 -0.31 0.00 -2.04 0.00 0.00 64.34 61.72 2j1k n VAL 487 Cb 0.19 0.41 -0.02 0.00 -1.47 0.00 0.00 33.84 32.95 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 0.32 -2.35 -2.01 -1.34 2.03 -0.04 -2.47 116.55 110.70 2j1k n ASP 488 Ca 0.17 -0.98 -0.16 0.00 0.52 0.00 0.00 54.79 54.33 2j1k n ASP 488 Cb 0.34 -3.00 0.00 0.00 -0.72 0.00 0.00 41.12 37.74 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 -1.66 -0.28 3.69 0.27 0.00 0.18 -4.94 105.19 102.45 2j1k n GLY 489 Ca -0.08 -0.17 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.23 1.90 -0.04 4.61 0.00 -1.03 -4.86 120.51 118.85 2j1k n ALA 490 Ca -0.16 0.40 0.17 0.00 0.00 0.00 0.00 53.44 53.85 2j1k n ALA 490 Cb 0.63 -2.45 0.60 0.00 0.00 0.00 0.00 19.45 18.23 2j1k n ALA 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2j1k h PRO 491 N 6.85 0.18 -0.90 0.00 0.11 -1.93 -1.04 132.00 135.27 2j1k h PRO 491 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 2j1k h PRO 491 Cb 1.23 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2j1k h PRO 491 CO 0.92 0.12 0.05 -1.13 -0.21 0.00 0.00 178.00 177.75 2j1k n SER 492 N -4.43 2.68 -0.28 -2.05 3.41 -1.26 -3.63 113.62 108.07 2j1k n SER 492 Ca 0.10 -2.35 0.06 0.00 -0.26 0.00 0.00 58.87 56.43 2j1k n SER 492 Cb 0.51 -0.57 0.12 0.00 -0.26 0.00 0.00 64.21 64.01 2j1k n SER 492 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2j1k n ARG 493 N 0.14 2.32 -4.32 4.33 5.12 -0.39 -1.61 116.66 122.25 2j1k n ARG 493 Ca 0.11 -2.23 -0.32 0.00 -1.93 0.00 0.00 57.85 53.48 2j1k n ARG 493 Cb 0.63 -1.38 -0.09 0.00 -1.16 0.00 0.00 32.46 30.46 2j1k n ARG 493 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2j1k s SER 494 N -1.89 4.98 0.00 0.55 0.01 -1.24 -1.33 113.70 114.79 2j1k s SER 494 Ca 0.23 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.44 2j1k s SER 494 Cb 0.19 -1.26 0.00 0.00 0.21 0.00 0.00 66.02 65.16 2j1k s SER 494 CO 0.05 0.28 0.00 2.30 0.41 0.00 0.00 173.24 176.28 2j1k n ILE 495 N 1.40 0.00 -4.25 1.44 -5.35 -0.47 -4.35 119.36 107.78 2j1k n ILE 495 Ca -0.15 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.05 2j1k n ILE 495 Cb 0.53 -0.36 -0.10 0.00 -1.74 0.00 0.00 39.64 37.97 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 -0.49 4.31 -0.13 7.28 1.01 -0.42 -0.39 116.67 127.84 2j1k s ASP 496 Ca 0.00 -0.47 0.00 0.00 0.71 0.00 0.00 52.55 52.79 2j1k s ASP 496 Cb 0.00 -0.78 0.02 0.00 1.01 0.00 0.00 42.92 43.18 2j1k s ASP 496 CO 0.00 0.15 -0.11 0.00 0.21 0.00 0.00 175.17 175.42 2j1k s MET 498 N 1.56 3.68 -0.12 0.00 1.75 0.10 -1.33 119.30 124.95 2j1k s MET 498 Ca 0.04 -0.46 -0.28 0.00 -1.25 0.00 0.00 55.69 53.73 2j1k s MET 498 Cb -0.13 -3.38 -0.01 0.00 2.84 0.00 0.00 34.83 34.15 2j1k s MET 498 CO -0.09 -0.20 0.96 -1.17 -0.65 0.00 0.00 175.02 173.87 2j1k s LEU 499 N 1.64 4.23 -0.16 4.11 2.96 0.06 -0.46 118.68 131.06 2j1k s LEU 499 Ca 0.06 1.44 -0.04 0.00 -0.22 0.00 0.00 54.13 55.37 2j1k s LEU 499 Cb -0.15 -3.47 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 2j1k s LEU 499 CO 0.05 -0.43 -0.03 -0.63 -1.32 0.00 0.00 176.35 173.99 2j1k s ILE 500 N 2.01 3.97 -0.28 6.68 1.01 0.29 -0.78 121.20 134.09 2j1k s ILE 500 Ca 0.46 -0.33 -0.08 0.00 0.00 0.00 0.00 60.65 60.70 2j1k s ILE 500 Cb -0.18 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 2j1k s ILE 500 CO 0.17 0.49 0.10 -0.63 0.00 0.00 0.00 174.94 175.06 2j1k s ILE 501 N 0.40 4.29 -1.16 2.92 1.01 0.17 -1.27 121.20 127.56 2j1k s ILE 501 Ca -0.03 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 2j1k s ILE 501 Cb -0.14 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.21 2j1k s ILE 501 CO 0.03 0.17 0.12 0.59 0.00 0.00 0.00 174.94 175.85 2j1k n ASN 502 N 4.92 -4.42 -4.68 3.58 3.02 -0.05 -1.71 115.26 115.93 2j1k n ASN 502 Ca -0.15 -0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 53.91 2j1k n ASN 502 Cb 0.50 -3.49 -0.03 0.00 -0.61 0.00 0.00 39.78 36.14 2j1k n ASN 502 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2j1k s LYS 503 N -4.88 4.20 0.31 3.52 2.20 -1.26 -4.34 119.74 119.48 2j1k s LYS 503 Ca 0.06 2.23 -0.29 0.00 -0.36 0.00 0.00 55.97 57.61 2j1k s LYS 503 Cb -0.03 -3.79 -0.11 0.00 -1.51 0.00 0.00 37.83 32.40 2j1k s LYS 503 CO 0.08 -0.77 1.50 -2.14 -0.36 0.00 0.00 175.35 173.65 2j1k s PRO 504 N 3.29 4.17 -0.10 4.03 0.02 -1.26 -4.71 135.00 140.45 2j1k s PRO 504 Ca 0.73 2.48 -0.04 0.00 0.02 0.00 0.00 61.00 64.19 2j1k s PRO 504 Cb -0.36 -3.03 0.05 0.00 0.02 0.00 0.00 34.50 31.18 2j1k s PRO 504 CO 0.31 -0.51 0.21 0.21 -0.33 0.00 0.00 177.00 176.89 2j1k s LYS 505 N -1.11 0.13 2.76 5.54 2.47 -1.26 -5.11 119.74 123.16 2j1k s LYS 505 Ca 0.58 0.56 0.00 0.00 -1.56 0.00 0.00 55.97 55.54 2j1k s LYS 505 Cb -0.45 -0.14 0.00 0.00 -1.46 0.00 0.00 37.83 35.78 2j1k s LYS 505 CO 0.52 -0.22 0.00 0.41 0.16 0.00 0.00 175.35 176.22 2j1k n GLY 506 N 4.71 2.92 1.23 5.54 0.00 -1.26 -1.79 105.19 116.55 2j1k n GLY 506 Ca -0.17 0.02 0.03 0.00 0.00 0.00 0.00 46.02 45.90 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 2.50 -2.10 1.61 0.24 -1.26 -4.99 118.33 114.33 2j1k n VAL 507 Ca 0.00 -1.97 -0.41 0.00 -2.04 0.00 0.00 64.34 59.92 2j1k n VAL 507 Cb 0.00 -0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 32.06 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 -2.94 3.52 -0.09 2.33 0.00 -0.74 -4.95 121.76 118.89 2j1k s ALA 508 Ca 0.46 1.26 -0.22 0.00 0.00 0.00 0.00 51.96 53.47 2j1k s ALA 508 Cb 0.38 -3.49 -0.29 0.00 0.00 0.00 0.00 23.12 19.72 2j1k s ALA 508 CO 0.09 -0.65 0.75 1.15 0.00 0.00 0.00 175.76 177.09 2j1k h THR 509 N 3.15 1.42 -3.97 0.00 2.02 -1.54 -3.44 112.91 110.54 2j1k h THR 509 Ca -0.48 -2.45 -0.63 0.00 0.77 0.00 0.00 66.41 63.62 2j1k h THR 509 Cb 1.22 3.07 -0.23 0.00 -1.74 0.00 0.00 68.15 70.48 2j1k h THR 509 CO 0.68 0.67 -0.85 -0.31 0.37 0.00 0.00 175.52 176.08 2j1k s TYR 510 N -2.40 2.06 -0.00 3.16 2.02 -0.92 -5.01 117.35 116.26 2j1k s TYR 510 Ca -0.17 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.11 2j1k s TYR 510 Cb 0.01 -1.14 -0.00 0.00 -0.40 0.00 0.00 41.96 40.43 2j1k s TYR 510 CO 0.78 0.25 0.03 0.95 -1.57 0.00 0.00 175.55 175.99 2j1k s THR 511 N -1.05 0.05 -0.11 -0.71 -4.23 -1.26 -0.86 115.64 107.47 2j1k s THR 511 Ca 0.10 -0.44 0.02 0.00 -1.18 0.00 0.00 61.69 60.19 2j1k s THR 511 Cb -0.10 -0.20 0.01 0.00 1.34 0.00 0.00 72.50 73.55 2j1k s THR 511 CO 0.05 -0.24 -0.17 -0.76 -0.54 0.00 0.00 174.62 172.96 2j1k s LEU 512 N -0.74 1.80 -0.19 4.79 1.43 -0.59 -0.87 118.68 124.31 2j1k s LEU 512 Ca -0.08 -0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 52.54 2j1k s LEU 512 Cb -0.05 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 45.01 2j1k s LEU 512 CO -0.00 0.03 -0.11 -0.89 0.23 0.00 0.00 176.35 175.61 2j1k s THR 513 N 0.92 2.88 -0.46 5.49 2.01 -0.40 -0.48 115.64 125.60 2j1k s THR 513 Ca -0.07 -0.67 -0.21 0.00 0.31 0.00 0.00 61.69 61.05 2j1k s THR 513 Cb -0.15 -2.27 0.03 0.00 0.01 0.00 0.00 72.50 70.12 2j1k s THR 513 CO -0.01 0.48 0.65 -0.36 -0.69 0.00 0.00 174.62 174.69 2j1k s PHE 514 N 1.26 3.05 -0.23 4.92 0.08 -0.41 -0.55 117.98 126.10 2j1k s PHE 514 Ca 0.03 -0.15 -0.06 0.00 0.12 0.00 0.00 56.93 56.87 2j1k s PHE 514 Cb -0.14 -3.42 -0.03 0.00 -0.57 0.00 0.00 43.02 38.87 2j1k s PHE 514 CO -0.05 -0.93 0.04 0.50 -0.10 0.00 0.00 175.22 174.68 2j1k s ARG 515 N 2.84 3.66 -0.22 0.44 3.52 0.39 -0.30 118.95 129.28 2j1k s ARG 515 Ca 0.22 -0.48 -0.09 0.00 -0.13 0.00 0.00 55.73 55.24 2j1k s ARG 515 Cb -0.15 -3.22 -0.05 0.00 -1.56 0.00 0.00 34.95 29.98 2j1k s ARG 515 CO 0.18 -0.08 0.12 -0.06 -0.81 0.00 0.00 175.30 174.65 2j1k s PHE 516 N 1.28 3.28 0.05 5.12 0.08 0.20 0.02 117.98 128.01 2j1k s PHE 516 Ca 0.04 0.13 -0.01 0.00 0.12 0.00 0.00 56.93 57.21 2j1k s PHE 516 Cb -0.15 -2.21 -0.04 0.00 -0.57 0.00 0.00 43.02 40.06 2j1k s PHE 516 CO 0.02 0.06 -0.03 -0.51 -0.10 0.00 0.00 175.22 174.66 2j1k s LEU 517 N 0.90 2.46 -1.22 -0.37 1.43 -0.60 -2.28 118.68 119.00 2j1k s LEU 517 Ca 0.06 -0.93 -0.03 0.00 -1.03 0.00 0.00 54.13 52.20 2j1k s LEU 517 Cb -0.13 0.18 -0.01 0.00 0.03 0.00 0.00 46.19 46.26 2j1k s LEU 517 CO 0.03 -0.56 0.83 0.59 0.23 0.00 0.00 176.35 177.48 2j1k n ASN 518 N 0.31 -2.61 0.26 2.29 3.02 -1.26 -1.30 115.26 115.96 2j1k n ASN 518 Ca -0.15 -0.76 0.12 0.00 -0.03 0.00 0.00 54.58 53.76 2j1k n ASN 518 Cb 0.60 -4.52 0.68 0.00 -0.61 0.00 0.00 39.78 35.94 2j1k n ASN 518 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2j1k h PHE 519 N -1.76 0.00 0.00 3.10 0.04 -1.86 -2.76 116.94 113.71 2j1k h PHE 519 Ca -0.61 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.16 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 0.42 0.14 0.00 0.27 -0.60 0.00 0.00 178.31 178.54 2j1k n ASN 520 N -3.56 0.00 0.20 2.17 0.23 -0.67 -0.89 115.26 112.73 2j1k n ASN 520 Ca -0.01 0.13 0.03 0.00 -0.53 0.00 0.00 54.58 54.20 2j1k n ASN 520 Cb 0.27 -0.27 0.40 0.00 -2.08 0.00 0.00 39.78 38.10 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 -7.00 -3.83 3.08 -1.77 -3.46 114.38 101.40 2j1k h ARG 521 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 2j1k h ARG 521 Cb 0.09 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.24 2j1k h ARG 521 CO 0.00 0.32 0.61 -0.51 -1.07 0.00 0.00 179.97 179.32 2j1k s LEU 522 N -8.27 4.05 0.21 3.04 1.43 -0.07 -4.71 118.68 114.36 2j1k s LEU 522 Ca -0.03 2.68 0.17 0.00 -1.03 0.00 0.00 54.13 55.92 2j1k s LEU 522 Cb 0.15 -4.08 0.01 0.00 0.03 0.00 0.00 46.19 42.30 2j1k s LEU 522 CO 0.72 -1.14 1.20 0.77 0.23 0.00 0.00 176.35 178.12 2j1k h SER 523 N 2.13 0.00 -1.01 2.29 4.64 -1.62 -3.43 113.55 116.54 2j1k h SER 523 Ca -0.50 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.86 2j1k h SER 523 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2j1k h SER 523 CO 0.60 0.43 0.14 0.61 -0.87 0.00 0.00 176.83 177.75 2j1k n GLY 524 N 1.27 1.10 3.66 -0.77 0.00 -1.26 -4.99 105.19 104.20 2j1k n GLY 524 Ca -0.02 -0.97 -0.47 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.17 1.07 2.91 -0.02 0.00 -1.26 -4.40 105.19 103.32 2j1k n GLY 525 Ca -0.00 0.67 -0.18 0.00 0.00 0.00 0.00 46.02 46.50 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 1.01 0.45 0.11 2.61 2.01 0.14 -4.95 115.64 117.02 2j1k s THR 526 Ca 0.80 -0.14 -0.34 0.00 0.31 0.00 0.00 61.69 62.31 2j1k s THR 526 Cb -0.71 -0.44 -0.14 0.00 0.01 0.00 0.00 72.50 71.22 2j1k s THR 526 CO 0.39 0.17 1.59 -0.11 -0.69 0.00 0.00 174.62 175.97 2j1k n LEU 527 N 3.59 2.92 -3.78 4.42 7.94 -1.26 -1.24 117.00 129.59 2j1k n LEU 527 Ca -0.21 1.07 -0.42 0.00 -1.11 0.00 0.00 56.01 55.35 2j1k n LEU 527 Cb 0.54 -1.38 0.00 0.00 0.53 0.00 0.00 43.42 43.11 2j1k n LEU 527 CO 0.24 -0.37 2.26 0.33 -1.11 0.00 0.00 177.39 178.74 2j1k n PHE 528 N 3.75 3.07 -3.96 1.96 7.35 0.02 -3.90 117.46 125.74 2j1k n PHE 528 Ca 0.18 -2.86 -0.31 0.00 -0.76 0.00 0.00 57.45 53.71 2j1k n PHE 528 Cb 0.27 -2.14 -0.15 0.00 0.35 0.00 0.00 39.48 37.81 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 1.20 1.40 0.63 -4.13 2.20 -1.26 -0.93 119.74 118.84 2j1k s LYS 529 Ca 0.44 -1.82 -0.11 0.00 -0.36 0.00 0.00 55.97 54.12 2j1k s LYS 529 Cb 0.12 -3.01 -0.03 0.00 -1.51 0.00 0.00 37.83 33.40 2j1k s LYS 529 CO -0.03 -0.97 1.04 0.95 -0.36 0.00 0.00 175.35 175.98 2j1k s THR 530 N 0.90 4.47 1.04 3.43 -4.23 -0.17 0.16 115.64 121.23 2j1k s THR 530 Ca 0.11 0.78 -0.12 0.00 -1.18 0.00 0.00 61.69 61.29 2j1k s THR 530 Cb -0.19 -3.79 0.21 0.00 1.34 0.00 0.00 72.50 70.07 2j1k s THR 530 CO -0.10 -1.04 1.08 -1.81 -0.54 0.00 0.00 174.62 172.21 2j1k s ASP 531 N -4.21 1.97 -0.14 3.99 1.01 0.57 -4.62 116.67 115.23 2j1k s ASP 531 Ca 0.55 1.78 -0.29 0.00 0.71 0.00 0.00 52.55 55.30 2j1k s ASP 531 Cb -0.11 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.40 2j1k s ASP 531 CO 0.53 -3.63 1.24 -0.69 0.21 0.00 0.00 175.17 172.83 2j1k s VAL 532 N -2.58 4.30 -0.04 -1.27 1.01 -1.26 -4.54 120.40 116.02 2j1k s VAL 532 Ca 0.67 1.58 -0.01 0.00 0.00 0.00 0.00 61.98 64.22 2j1k s VAL 532 Cb -0.23 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2j1k s VAL 532 CO 0.61 -0.11 0.03 -0.76 0.00 0.00 0.00 175.10 174.88 2j1k s LEU 533 N 3.20 3.70 -0.07 3.92 1.43 0.12 -4.95 118.68 126.04 2j1k s LEU 533 Ca 0.54 0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2j1k s LEU 533 Cb -0.22 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 43.99 2j1k s LEU 533 CO 0.16 0.32 -0.13 -0.89 0.23 0.00 0.00 176.35 176.04 2j1k s THR 534 N -1.04 1.20 0.20 5.49 2.01 -1.26 -1.23 115.64 121.01 2j1k s THR 534 Ca 0.18 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.71 2j1k s THR 534 Cb -0.12 -1.10 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 2j1k s THR 534 CO 0.08 0.37 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.97 2j1k s PHE 535 N 0.69 1.46 0.00 4.92 0.08 -0.27 -4.98 117.98 119.89 2j1k s PHE 535 Ca -0.14 -0.82 0.01 0.00 0.12 0.00 0.00 56.93 56.10 2j1k s PHE 535 Cb -0.16 -0.79 -0.01 0.00 -0.57 0.00 0.00 43.02 41.49 2j1k s PHE 535 CO 0.03 0.05 -0.04 0.99 -0.10 0.00 0.00 175.22 176.16 2j1k s THR 536 N -3.34 0.29 0.15 0.64 2.01 -1.26 -0.51 115.64 113.62 2j1k s THR 536 Ca 0.23 -0.30 -0.10 0.00 0.31 0.00 0.00 61.69 61.83 2j1k s THR 536 Cb 0.04 -0.28 -0.00 0.00 0.01 0.00 0.00 72.50 72.27 2j1k s THR 536 CO 0.05 -0.01 0.29 -0.72 -0.69 0.00 0.00 174.62 173.54 2j1k s TYR 537 N -0.31 0.29 0.06 4.92 -0.85 -0.83 -5.00 117.35 115.62 2j1k s TYR 537 Ca -0.01 -0.66 -0.31 0.00 -0.52 0.00 0.00 57.07 55.57 2j1k s TYR 537 Cb -0.03 -0.01 -0.06 0.00 0.38 0.00 0.00 41.96 42.25 2j1k s TYR 537 CO -0.00 -0.70 1.21 0.08 -1.52 0.00 0.00 175.55 174.62 2j1k s VAL 538 N -3.93 3.99 0.55 -3.49 1.01 -1.26 -0.51 120.40 116.76 2j1k s VAL 538 Ca 0.14 1.43 -0.16 0.00 0.00 0.00 0.00 61.98 63.39 2j1k s VAL 538 Cb 0.03 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 2j1k s VAL 538 CO -0.03 0.11 1.02 -0.83 0.00 0.00 0.00 175.10 175.37 2j1k s GLY 539 N 1.06 2.05 0.48 4.51 0.00 0.30 -0.95 107.32 114.76 2j1k s GLY 539 Ca 0.59 0.23 -0.22 0.00 0.00 0.00 0.00 44.72 45.33 2j1k s GLY 539 CO 0.29 0.52 1.11 1.85 0.00 0.00 0.00 173.10 176.88 2j1k s GLU 540 N -4.18 3.71 0.35 2.90 2.56 0.55 -4.23 118.70 120.35 2j1k s GLU 540 Ca 0.60 1.60 -0.23 0.00 0.00 0.00 0.00 54.97 56.95 2j1k s GLU 540 Cb -0.12 -2.25 -0.10 0.00 2.00 0.00 0.00 34.13 33.66 2j1k s GLU 540 CO 0.36 -0.55 0.92 -0.80 -0.56 0.00 0.00 175.26 174.62 2j1k s ASN 541 N -1.64 7.15 0.00 -1.70 0.01 -1.26 -4.39 114.94 113.11 2j1k s ASN 541 Ca 0.66 1.72 0.03 0.00 -0.71 0.00 0.00 52.86 54.56 2j1k s ASN 541 Cb -0.24 -2.54 0.16 0.00 0.41 0.00 0.00 41.25 39.04 2j1k s ASN 541 CO 0.28 -0.17 0.64 1.67 -1.51 0.00 0.00 177.10 178.02