#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nrw s LEU 342 N 0.00 4.51 0.30 0.99 1.43 0.33 -5.02 118.68 121.22 2nrw s LEU 342 Ca 0.00 1.42 -0.29 0.00 -1.03 0.00 0.00 54.13 54.23 2nrw s LEU 342 Cb 0.00 -3.12 -0.10 0.00 0.03 0.00 0.00 46.19 43.00 2nrw s LEU 342 CO 0.00 0.15 1.28 -0.13 0.23 0.00 0.00 176.35 177.88 2nrw s ARG 343 N -0.67 4.40 0.22 1.70 1.81 -1.26 -4.47 118.95 120.68 2nrw s ARG 343 Ca 0.34 2.13 -0.05 0.00 -1.72 0.00 0.00 55.73 56.44 2nrw s ARG 343 Cb -0.21 -3.11 0.19 0.00 -0.45 0.00 0.00 34.95 31.38 2nrw s ARG 343 CO 0.22 -0.14 1.67 0.87 -0.68 0.00 0.00 175.30 177.24 2nrw h LYS 344 N 3.75 0.87 -0.09 3.54 1.57 -1.96 -1.78 116.57 122.47 2nrw h LYS 344 Ca -0.48 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 57.96 2nrw h LYS 344 Cb 1.22 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2nrw h LYS 344 CO 0.67 0.93 -0.16 0.93 -0.57 0.00 0.00 179.45 181.25 2nrw h GLU 345 N 0.79 0.14 -0.01 3.15 4.39 -1.99 -1.66 114.58 119.39 2nrw h GLU 345 Ca 0.13 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.69 2nrw h GLU 345 Cb 0.60 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2nrw h GLU 345 CO 0.04 0.31 -0.51 0.00 -1.16 0.00 0.00 179.01 177.69 2nrw h ALA 346 N 1.70 1.13 -0.28 3.43 0.00 -1.74 -0.34 119.26 123.16 2nrw h ALA 346 Ca 0.03 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 2nrw h ALA 346 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2nrw h ALA 346 CO 0.02 0.65 0.05 -0.07 0.00 0.00 0.00 179.25 179.90 2nrw h LEU 347 N 0.02 0.44 -0.35 0.00 3.38 -0.73 -0.39 115.31 117.68 2nrw h LEU 347 Ca -0.00 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.77 2nrw h LEU 347 Cb 0.92 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.50 2nrw h LEU 347 CO 0.07 0.59 0.04 -0.08 0.09 0.00 0.00 178.44 179.14 2nrw h GLU 348 N 0.28 0.14 -0.51 1.13 4.57 -1.18 -2.01 114.58 117.00 2nrw h GLU 348 Ca 0.09 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.28 2nrw h GLU 348 Cb 0.33 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 2nrw h GLU 348 CO 0.00 0.09 0.34 0.93 -1.18 0.00 0.00 179.01 179.20 2nrw h GLU 349 N 0.15 0.61 -0.27 1.92 5.08 -0.88 -1.37 114.58 119.80 2nrw h GLU 349 Ca 0.17 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 2nrw h GLU 349 Cb 0.21 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2nrw h GLU 349 CO -0.25 0.40 -0.19 1.25 -1.00 0.00 0.00 179.01 179.23 2nrw h LEU 350 N 0.63 0.64 -0.02 1.33 5.85 -0.83 -0.74 115.31 122.16 2nrw h LEU 350 Ca 0.20 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 58.52 2nrw h LEU 350 Cb 0.03 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.84 2nrw h LEU 350 CO -0.05 0.94 -0.25 -0.03 -0.34 0.00 0.00 178.44 178.71 2nrw h MET 351 N 0.34 -0.36 0.10 1.25 4.05 -0.99 -1.29 114.93 118.02 2nrw h MET 351 Ca 0.05 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2nrw h MET 351 Cb 0.72 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.61 2nrw h MET 351 CO 0.05 -0.24 -0.05 0.87 0.23 0.00 0.00 176.91 177.77 2nrw h LYS 352 N -0.38 -0.13 -0.43 0.39 1.57 -1.23 -1.13 116.57 115.24 2nrw h LYS 352 Ca 0.07 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.93 2nrw h LYS 352 Cb 0.47 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.74 2nrw h LYS 352 CO -0.23 -0.05 0.02 1.25 -0.57 0.00 0.00 179.45 179.87 2nrw h LEU 353 N -0.17 -0.13 -0.43 2.94 5.85 -1.00 -2.37 115.31 120.00 2nrw h LEU 353 Ca -0.01 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2nrw h LEU 353 Cb 0.13 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.32 2nrw h LEU 353 CO 0.02 -0.03 0.00 0.18 -0.34 0.00 0.00 178.44 178.27 2nrw n LEU 354 N -5.18 0.66 -4.09 2.25 4.77 -0.50 -4.93 117.00 109.98 2nrw n LEU 354 Ca 0.03 -0.25 -0.32 0.00 -0.03 0.00 0.00 56.01 55.44 2nrw n LEU 354 Cb 0.22 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2nrw n LEU 354 CO 0.19 0.13 -0.06 0.59 -1.33 0.00 0.00 177.39 176.90 2nrw n ASN 355 N -0.41 -2.68 -4.78 -1.43 5.03 -0.85 -4.97 115.26 105.17 2nrw n ASN 355 Ca 0.18 -0.97 -0.36 0.00 0.87 0.00 0.00 54.58 54.30 2nrw n ASN 355 Cb 0.19 -3.05 -0.03 0.00 -1.02 0.00 0.00 39.78 35.87 2nrw n ASN 355 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 2nrw s MET 356 N -6.76 3.91 0.12 3.52 -1.94 -0.49 -4.95 119.30 112.71 2nrw s MET 356 Ca 0.51 1.51 -0.08 0.00 -1.71 0.00 0.00 55.69 55.92 2nrw s MET 356 Cb -0.27 -2.32 -0.12 0.00 2.01 0.00 0.00 34.83 34.13 2nrw s MET 356 CO 0.90 -0.37 1.29 -0.22 -0.01 0.00 0.00 175.02 176.61 2nrw h LYS 357 N 1.99 0.54 -6.38 2.03 3.64 -1.93 -3.46 116.57 113.01 2nrw h LYS 357 Ca -0.49 -0.54 -0.68 0.00 -1.27 0.00 0.00 60.65 57.67 2nrw h LYS 357 Cb 1.23 0.14 -0.20 0.00 -0.41 0.00 0.00 32.23 32.99 2nrw h LYS 357 CO 0.60 1.17 -0.75 -0.51 -2.27 0.00 0.00 179.45 177.69 2nrw s ASP 358 N -7.13 4.23 0.24 4.20 1.01 -1.26 -5.10 116.67 112.86 2nrw s ASP 358 Ca -0.07 -0.24 -0.31 0.00 0.71 0.00 0.00 52.55 52.64 2nrw s ASP 358 Cb 0.08 -0.89 -0.13 0.00 1.01 0.00 0.00 42.92 43.00 2nrw s ASP 358 CO 0.88 0.29 1.43 0.33 0.21 0.00 0.00 175.17 178.31 2nrw n PHE 359 N 1.76 2.21 -1.48 4.23 7.35 -1.26 -4.89 117.46 125.38 2nrw n PHE 359 Ca -0.16 0.41 -0.40 0.00 -0.76 0.00 0.00 57.45 56.54 2nrw n PHE 359 Cb 0.52 -2.47 -0.02 0.00 0.35 0.00 0.00 39.48 37.86 2nrw n PHE 359 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2nrw n PRO 360 N 2.09 2.75 -0.07 -7.13 -0.04 -1.26 -4.65 135.00 126.69 2nrw n PRO 360 Ca 0.12 -2.32 -0.12 0.00 -0.04 0.00 0.00 63.50 61.14 2nrw n PRO 360 Cb 0.32 -3.07 -0.05 0.00 -0.04 0.00 0.00 33.50 30.65 2nrw n PRO 360 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2nrw h TYR 361 N 6.13 0.47 -3.36 0.54 3.20 -1.92 -3.40 116.97 118.62 2nrw h TYR 361 Ca 0.60 -0.10 -0.66 0.00 3.14 0.00 0.00 58.73 61.72 2nrw h TYR 361 Cb 0.54 -0.11 -0.27 0.00 1.54 0.00 0.00 36.73 38.42 2nrw h TYR 361 CO 1.55 0.66 -0.73 0.50 -1.64 0.00 0.00 178.16 178.50 2nrw s ARG 362 N -4.72 3.40 -0.07 1.82 3.52 -1.26 -0.24 118.95 121.39 2nrw s ARG 362 Ca -0.14 -0.63 0.05 0.00 -0.13 0.00 0.00 55.73 54.88 2nrw s ARG 362 Cb 0.07 -2.91 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 2nrw s ARG 362 CO 0.75 -0.08 -0.22 0.42 -0.81 0.00 0.00 175.30 175.37 2nrw s ILE 363 N 1.15 1.82 0.04 4.11 1.01 -0.38 -0.62 121.20 128.33 2nrw s ILE 363 Ca 0.02 -0.91 0.06 0.00 0.00 0.00 0.00 60.65 59.81 2nrw s ILE 363 Cb -0.14 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.73 2nrw s ILE 363 CO -0.01 0.51 -0.13 -1.61 0.00 0.00 0.00 174.94 173.70 2nrw s GLU 364 N 0.15 2.24 -0.03 2.79 2.02 -0.96 -0.25 118.70 124.66 2nrw s GLU 364 Ca -0.10 -0.90 0.04 0.00 0.02 0.00 0.00 54.97 54.03 2nrw s GLU 364 Cb -0.15 -2.31 -0.01 0.00 0.10 0.00 0.00 34.13 31.76 2nrw s GLU 364 CO 0.05 0.56 -0.16 0.20 0.02 0.00 0.00 175.26 175.93 2nrw s GLY 365 N -1.53 0.85 -0.04 -1.39 0.00 0.09 -0.55 107.32 104.76 2nrw s GLY 365 Ca 0.16 -0.67 0.06 0.00 0.00 0.00 0.00 44.72 44.27 2nrw s GLY 365 CO 0.07 -0.42 -0.21 -0.42 0.00 0.00 0.00 173.10 172.13 2nrw s ILE 366 N -0.10 1.69 0.04 0.90 1.01 -0.44 -0.55 121.20 123.74 2nrw s ILE 366 Ca -0.00 -0.88 0.06 0.00 0.00 0.00 0.00 60.65 59.83 2nrw s ILE 366 Cb -0.09 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 2nrw s ILE 366 CO 0.01 0.48 -0.18 -0.62 0.00 0.00 0.00 174.94 174.63 2nrw s ASP 367 N -0.24 2.17 -0.16 3.58 2.15 -0.30 -1.17 116.67 122.70 2nrw s ASP 367 Ca 0.01 -0.48 -0.03 0.00 0.43 0.00 0.00 52.55 52.49 2nrw s ASP 367 Cb -0.11 -0.18 -0.02 0.00 -0.30 0.00 0.00 42.92 42.31 2nrw s ASP 367 CO 0.01 0.13 -0.06 -0.63 -0.17 0.00 0.00 175.17 174.45 2nrw s ILE 368 N -0.77 3.65 0.07 4.11 -1.09 -1.26 -0.64 121.20 125.27 2nrw s ILE 368 Ca 0.06 -0.44 0.05 0.00 -2.23 0.00 0.00 60.65 58.09 2nrw s ILE 368 Cb -0.08 -2.60 -0.03 0.00 -1.58 0.00 0.00 42.46 38.17 2nrw s ILE 368 CO 0.01 0.49 -0.13 -0.44 -1.23 0.00 0.00 174.94 173.64 2nrw s SER 369 N 0.54 1.52 -0.32 3.58 0.01 -0.51 -5.01 113.70 113.51 2nrw s SER 369 Ca -0.04 -0.61 -0.10 0.00 1.31 0.00 0.00 55.95 56.52 2nrw s SER 369 Cb -0.15 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.05 2nrw s SER 369 CO 0.03 -0.10 0.16 -1.00 0.41 0.00 0.00 173.24 172.74 2nrw s HIS 370 N -1.30 3.19 -0.14 2.43 3.76 -1.26 -0.89 115.29 121.09 2nrw s HIS 370 Ca -0.03 -0.68 0.00 0.00 -0.15 0.00 0.00 55.06 54.20 2nrw s HIS 370 Cb -0.10 -2.37 -0.01 0.00 1.11 0.00 0.00 32.58 31.21 2nrw s HIS 370 CO 0.02 -0.50 -0.14 0.99 -0.85 0.00 0.00 174.74 174.25 2nrw s THR 376 N 1.59 2.88 -0.08 1.30 2.01 -1.26 -5.23 115.64 116.86 2nrw s THR 376 Ca 0.04 -0.71 0.04 0.00 0.31 0.00 0.00 61.69 61.36 2nrw s THR 376 Cb -0.18 -2.21 0.00 0.00 0.01 0.00 0.00 72.50 70.13 2nrw s THR 376 CO 0.06 0.52 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.62 2nrw s VAL 377 N 0.53 1.71 -0.12 3.82 1.01 -0.06 -0.92 120.40 126.37 2nrw s VAL 377 Ca -0.09 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 60.88 2nrw s VAL 377 Cb -0.16 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2nrw s VAL 377 CO 0.04 0.48 0.46 0.00 0.00 0.00 0.00 175.10 176.09 2nrw s ALA 378 N 0.33 3.48 -0.22 5.51 0.00 0.75 -1.42 121.76 130.20 2nrw s ALA 378 Ca -0.14 -0.21 -0.07 0.00 0.00 0.00 0.00 51.96 51.54 2nrw s ALA 378 Cb -0.16 -2.63 -0.03 0.00 0.00 0.00 0.00 23.12 20.30 2nrw s ALA 378 CO 0.06 0.01 0.06 -1.12 0.00 0.00 0.00 175.76 174.77 2nrw s SER 379 N 0.59 5.24 -0.19 0.00 0.01 0.19 -0.86 113.70 118.69 2nrw s SER 379 Ca 0.25 -0.12 -0.03 0.00 1.31 0.00 0.00 55.95 57.37 2nrw s SER 379 Cb -0.15 -1.92 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 2nrw s SER 379 CO 0.10 0.04 -0.07 -0.22 0.41 0.00 0.00 173.24 173.50 2nrw s LEU 380 N 1.16 2.85 0.24 2.44 0.20 0.71 -1.15 118.68 125.13 2nrw s LEU 380 Ca 0.04 -0.36 0.09 0.00 0.69 0.00 0.00 54.13 54.60 2nrw s LEU 380 Cb -0.14 -1.70 -0.04 0.00 -0.43 0.00 0.00 46.19 43.88 2nrw s LEU 380 CO 0.03 0.05 -0.03 0.68 -0.29 0.00 0.00 176.35 176.79 2nrw s VAL 381 N 1.04 3.36 -0.06 1.68 -7.23 0.28 -1.68 120.40 117.80 2nrw s VAL 381 Ca 0.00 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.31 2nrw s VAL 381 Cb -0.15 -2.76 0.02 0.00 0.56 0.00 0.00 36.38 34.06 2nrw s VAL 381 CO -0.01 -0.31 -0.02 -0.69 -0.31 0.00 0.00 175.10 173.76 2nrw s VAL 382 N -2.17 0.46 -0.13 1.32 1.01 -1.26 -0.73 120.40 118.91 2nrw s VAL 382 Ca 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.25 2nrw s VAL 382 Cb -0.07 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.75 2nrw s VAL 382 CO 0.19 0.24 -0.10 -0.36 0.00 0.00 0.00 175.10 175.06 2nrw s PHE 383 N 1.34 2.86 -0.24 5.22 0.08 0.65 -1.11 117.98 126.78 2nrw s PHE 383 Ca -0.05 -0.48 0.02 0.00 0.12 0.00 0.00 56.93 56.55 2nrw s PHE 383 Cb -0.13 -1.85 0.06 0.00 -0.57 0.00 0.00 43.02 40.52 2nrw s PHE 383 CO -0.02 -0.10 -0.10 -2.00 -0.10 0.00 0.00 175.22 172.89 2nrw s GLU 384 N 0.20 2.14 -1.47 0.44 2.12 0.53 -1.24 118.70 121.42 2nrw s GLU 384 Ca -0.06 -1.19 -0.07 0.00 0.36 0.00 0.00 54.97 54.01 2nrw s GLU 384 Cb -0.15 -2.76 0.03 0.00 0.26 0.00 0.00 34.13 31.51 2nrw s GLU 384 CO 0.04 -0.54 0.67 -3.47 -0.54 0.00 0.00 175.26 171.43 2nrw n ASP 385 N 4.52 -5.50 0.00 -1.70 2.03 0.67 -1.23 116.55 115.33 2nrw n ASP 385 Ca -0.14 -0.37 0.00 0.00 0.52 0.00 0.00 54.79 54.79 2nrw n ASP 385 Cb 0.43 -4.45 0.00 0.00 -0.72 0.00 0.00 41.12 36.39 2nrw n ASP 385 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nrw n GLY 386 N -1.51 2.22 3.72 0.27 0.00 -1.26 -4.81 105.19 103.82 2nrw n GLY 386 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2nrw n GLY 386 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nrw s PHE 387 N -3.37 3.49 0.13 1.61 0.08 -0.37 -0.51 117.98 119.05 2nrw s PHE 387 Ca 0.00 0.83 -0.31 0.00 0.12 0.00 0.00 56.93 57.56 2nrw s PHE 387 Cb 0.00 -2.53 -0.09 0.00 -0.57 0.00 0.00 43.02 39.84 2nrw s PHE 387 CO 0.00 0.16 1.47 -2.14 -0.10 0.00 0.00 175.22 174.60 2nrw s PRO 388 N 0.69 4.27 -0.77 0.24 0.02 -1.26 -0.34 135.00 137.84 2nrw s PRO 388 Ca 0.24 2.20 -0.09 0.00 0.02 0.00 0.00 61.00 63.38 2nrw s PRO 388 Cb -0.15 -3.21 0.20 0.00 0.02 0.00 0.00 34.50 31.36 2nrw s PRO 388 CO 0.09 -0.51 0.67 0.15 -0.33 0.00 0.00 177.00 177.06 2nrw s LYS 389 N 1.14 3.22 0.45 5.54 1.02 -0.27 -4.90 119.74 125.95 2nrw s LYS 389 Ca 0.67 -2.61 0.20 0.00 0.02 0.00 0.00 55.97 54.26 2nrw s LYS 389 Cb -0.40 -4.14 1.08 0.00 -0.52 0.00 0.00 37.83 33.86 2nrw s LYS 389 CO 0.31 -1.24 1.95 0.87 -0.92 0.00 0.00 175.35 176.32 2nrw h LYS 390 N 7.28 0.00 0.00 1.68 1.57 -1.92 -1.21 116.57 123.96 2nrw h LYS 390 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2nrw h LYS 390 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2nrw h LYS 390 CO 0.76 0.22 0.00 0.41 -0.57 0.00 0.00 179.45 180.27 2nrw n GLY 391 N -0.58 -1.22 0.41 3.86 0.00 -1.26 -2.47 105.19 103.94 2nrw n GLY 391 Ca -0.02 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.17 2nrw n GLY 391 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nrw n ASP 392 N -2.09 1.82 -4.76 1.61 9.92 -0.46 -4.97 116.55 117.63 2nrw n ASP 392 Ca 0.02 -1.40 -0.37 0.00 -0.53 0.00 0.00 54.79 52.51 2nrw n ASP 392 Cb 0.21 0.53 0.03 0.00 -0.64 0.00 0.00 41.12 41.25 2nrw n ASP 392 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2nrw s TYR 393 N -2.56 2.47 0.03 1.24 1.51 -1.03 -4.84 117.35 114.18 2nrw s TYR 393 Ca 0.17 1.46 -0.01 0.00 -1.01 0.00 0.00 57.07 57.69 2nrw s TYR 393 Cb 0.18 -3.60 -0.03 0.00 -0.11 0.00 0.00 41.96 38.40 2nrw s TYR 393 CO 0.61 -2.33 -0.02 1.03 -1.11 0.00 0.00 175.55 173.73 2nrw s ARG 394 N -2.97 0.43 -0.02 -0.62 1.81 -0.68 -5.01 118.95 111.90 2nrw s ARG 394 Ca 0.71 -0.83 0.07 0.00 -1.72 0.00 0.00 55.73 53.96 2nrw s ARG 394 Cb -0.34 0.15 -0.02 0.00 -0.45 0.00 0.00 34.95 34.29 2nrw s ARG 394 CO 0.40 -0.08 -0.23 1.03 -0.68 0.00 0.00 175.30 175.74 2nrw s ARG 395 N -2.39 1.87 -0.09 3.54 0.52 -1.26 -0.21 118.95 120.92 2nrw s ARG 395 Ca -0.07 -0.84 0.03 0.00 -0.52 0.00 0.00 55.73 54.33 2nrw s ARG 395 Cb -0.03 -1.82 0.01 0.00 0.52 0.00 0.00 34.95 33.63 2nrw s ARG 395 CO -0.04 0.50 -0.18 0.71 0.02 0.00 0.00 175.30 176.31 2nrw s TYR 396 N -0.56 2.06 -0.19 -0.53 2.02 -0.04 -4.96 117.35 115.15 2nrw s TYR 396 Ca 0.09 -0.87 -0.18 0.00 -0.37 0.00 0.00 57.07 55.74 2nrw s TYR 396 Cb -0.09 -1.44 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 2nrw s TYR 396 CO -0.01 -0.40 0.50 0.15 -1.57 0.00 0.00 175.55 174.22 2nrw s LYS 397 N 0.66 4.20 -0.29 -0.62 1.02 -1.26 -0.18 119.74 123.26 2nrw s LYS 397 Ca -0.13 0.39 -0.06 0.00 0.02 0.00 0.00 55.97 56.18 2nrw s LYS 397 Cb -0.16 -3.55 0.01 0.00 -0.52 0.00 0.00 37.83 33.61 2nrw s LYS 397 CO 0.04 -0.11 0.07 0.42 -0.92 0.00 0.00 175.35 174.85 2nrw s ILE 398 N 1.51 3.89 0.08 2.17 1.09 -0.10 -4.99 121.20 124.86 2nrw s ILE 398 Ca 0.24 -0.73 -0.28 0.00 -1.10 0.00 0.00 60.65 58.78 2nrw s ILE 398 Cb -0.15 -3.01 -0.06 0.00 -1.06 0.00 0.00 42.46 38.18 2nrw s ILE 398 CO 0.09 0.08 0.87 -1.61 -0.10 0.00 0.00 174.94 174.27 2nrw s GLU 399 N 1.48 4.60 0.00 2.79 2.02 -1.26 -4.07 118.70 124.27 2nrw s GLU 399 Ca 0.02 1.27 0.00 0.00 0.02 0.00 0.00 54.97 56.28 2nrw s GLU 399 Cb -0.17 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.69 2nrw s GLU 399 CO 0.02 0.26 0.00 1.04 0.02 0.00 0.00 175.26 176.60 2nrw n GLN 400 N 2.76 0.00 -1.63 1.61 6.02 -1.26 -5.13 117.38 119.75 2nrw n GLN 400 Ca -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2nrw n GLN 400 Cb 0.50 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.75 2nrw n GLN 400 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2nrw n ASP 404 N 0.00 -2.07 0.21 1.08 -0.08 -1.26 -5.16 116.55 109.26 2nrw n ASP 404 Ca 0.00 0.15 0.07 0.00 -1.51 0.00 0.00 54.79 53.50 2nrw n ASP 404 Cb 0.00 -1.48 0.44 0.00 2.34 0.00 0.00 41.12 42.42 2nrw n ASP 404 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 2nrw h ASP 405 N 0.42 0.00 0.11 1.67 3.32 -2.01 -2.46 116.42 117.47 2nrw h ASP 405 Ca -0.04 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.03 2nrw h ASP 405 Cb 0.10 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 2nrw h ASP 405 CO 0.00 0.30 -0.34 0.22 -1.72 0.00 0.00 179.24 177.71 2nrw h TYR 406 N 0.00 -0.94 -0.93 4.55 3.20 -1.97 -0.13 116.97 120.76 2nrw h TYR 406 Ca -0.00 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.90 2nrw h TYR 406 Cb 0.71 0.40 -0.05 0.00 1.54 0.00 0.00 36.73 39.33 2nrw h TYR 406 CO 0.00 -0.45 0.60 1.49 -1.64 0.00 0.00 178.16 178.17 2nrw h GLU 407 N -0.57 1.23 -0.46 1.82 4.57 -1.93 -1.93 114.58 117.30 2nrw h GLU 407 Ca 0.03 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2nrw h GLU 407 Cb 0.60 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.89 2nrw h GLU 407 CO -0.21 0.82 0.26 0.77 -1.18 0.00 0.00 179.01 179.47 2nrw h SER 408 N 1.26 0.57 -0.46 1.04 0.02 -1.22 -0.35 113.55 114.41 2nrw h SER 408 Ca 0.34 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2nrw h SER 408 Cb -0.13 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 2nrw h SER 408 CO -0.07 0.49 0.28 0.40 -1.14 0.00 0.00 176.83 176.79 2nrw h ILE 409 N 0.61 1.07 -0.27 3.27 1.08 -0.85 -1.18 117.51 121.25 2nrw h ILE 409 Ca 0.16 -0.20 -0.00 0.00 -0.39 0.00 0.00 64.86 64.43 2nrw h ILE 409 Cb 0.04 0.45 -0.01 0.00 -3.07 0.00 0.00 36.82 34.23 2nrw h ILE 409 CO -0.03 0.10 0.15 -0.09 -0.69 0.00 0.00 178.15 177.60 2nrw h ARG 410 N 0.57 0.37 0.14 2.37 2.43 -1.04 0.10 114.38 119.33 2nrw h ARG 410 Ca 0.18 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2nrw h ARG 410 Cb -0.02 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2nrw h ARG 410 CO -0.06 0.32 -0.16 1.15 -1.51 0.00 0.00 179.97 179.70 2nrw h THR 411 N 0.32 0.63 -0.78 0.20 2.02 -1.03 -2.37 112.91 111.90 2nrw h THR 411 Ca 0.09 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 2nrw h THR 411 Cb 0.05 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2nrw h THR 411 CO -0.02 0.00 0.28 0.58 0.37 0.00 0.00 175.52 176.73 2nrw h VAL 412 N -0.35 1.26 -0.26 3.16 2.07 -0.87 -0.63 116.25 120.63 2nrw h VAL 412 Ca 0.01 -0.86 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 2nrw h VAL 412 Cb 0.34 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2nrw h VAL 412 CO -0.06 0.35 0.02 0.58 0.02 0.00 0.00 177.57 178.48 2nrw h VAL 413 N 1.14 1.24 -0.49 2.57 2.07 -0.79 0.33 116.25 122.32 2nrw h VAL 413 Ca 0.25 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2nrw h VAL 413 Cb 0.26 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2nrw h VAL 413 CO -0.02 0.27 0.32 0.11 0.02 0.00 0.00 177.57 178.27 2nrw h LYS 414 N 0.25 0.66 0.29 1.57 1.57 -1.32 -2.14 116.57 117.45 2nrw h LYS 414 Ca 0.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2nrw h LYS 414 Cb 0.38 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2nrw h LYS 414 CO 0.01 0.45 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.11 2nrw h ARG 415 N 0.67 -0.37 0.18 3.15 2.43 -0.90 -2.61 114.38 116.93 2nrw h ARG 415 Ca 0.18 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2nrw h ARG 415 Cb -0.06 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2nrw h ARG 415 CO -0.04 -0.20 -0.08 -0.09 -1.51 0.00 0.00 179.97 178.05 2nrw h ARG 416 N -0.45 -0.23 -0.00 0.20 2.43 -0.91 -3.17 114.38 112.26 2nrw h ARG 416 Ca -0.04 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2nrw h ARG 416 Cb 0.34 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2nrw h ARG 416 CO 0.06 -0.07 -0.01 0.66 -1.51 0.00 0.00 179.97 179.10 2nrw n TYR 417 N -5.15 0.00 0.72 2.20 4.01 -0.81 -1.00 117.16 117.13 2nrw n TYR 417 Ca -0.09 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.78 2nrw n TYR 417 Cb 0.15 -0.21 0.48 0.00 -0.31 0.00 0.00 39.34 39.46 2nrw n TYR 417 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2nrw n SER 418 N -1.18 0.42 -0.00 7.72 3.41 -0.98 -4.18 113.62 118.82 2nrw n SER 418 Ca 0.16 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.33 2nrw n SER 418 Cb 0.22 -0.66 -0.01 0.00 -0.26 0.00 0.00 64.21 63.50 2nrw n SER 418 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2nrw n LYS 419 N -1.91 1.01 -4.29 4.33 5.02 -0.55 -5.08 118.16 116.68 2nrw n LYS 419 Ca 0.05 -0.01 -0.23 0.00 -2.02 0.00 0.00 58.31 56.11 2nrw n LYS 419 Cb 0.35 -0.95 -0.12 0.00 -0.02 0.00 0.00 35.03 34.28 2nrw n LYS 419 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2nrw s HIS 420 N -1.92 1.76 0.64 2.13 3.76 -0.17 -5.13 115.29 116.36 2nrw s HIS 420 Ca -0.00 -0.44 -0.18 0.00 -0.15 0.00 0.00 55.06 54.29 2nrw s HIS 420 Cb 0.01 -0.94 -0.02 0.00 1.11 0.00 0.00 32.58 32.74 2nrw s HIS 420 CO 0.04 0.24 1.22 -2.30 -0.85 0.00 0.00 174.74 173.09 2nrw n PRO 421 N 0.82 1.06 -2.16 8.40 -0.02 -1.26 -4.49 135.00 137.36 2nrw n PRO 421 Ca -0.17 0.42 -0.38 0.00 -2.02 0.00 0.00 63.50 61.34 2nrw n PRO 421 Cb 0.55 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 2nrw n PRO 421 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nrw s LEU 422 N -3.84 4.10 1.09 2.45 1.43 -1.26 -4.96 118.68 117.69 2nrw s LEU 422 Ca 0.81 2.47 -0.18 0.00 -1.03 0.00 0.00 54.13 56.20 2nrw s LEU 422 Cb -0.39 -4.08 0.25 0.00 0.03 0.00 0.00 46.19 42.00 2nrw s LEU 422 CO 0.42 -0.90 1.23 -2.16 0.23 0.00 0.00 176.35 175.17 2nrw s PRO 423 N -2.47 -0.33 0.32 1.29 0.04 -1.26 -4.97 135.00 127.62 2nrw s PRO 423 Ca 0.61 -0.30 0.16 0.00 0.04 0.00 0.00 61.00 61.51 2nrw s PRO 423 Cb -0.33 -1.72 0.46 0.00 0.04 0.00 0.00 34.50 32.95 2nrw s PRO 423 CO 0.41 -3.08 1.63 -0.91 0.04 0.00 0.00 177.00 175.10 2nrw h ASN 424 N -2.12 0.00 -3.74 6.66 4.21 -1.21 -3.46 115.58 115.92 2nrw h ASN 424 Ca -0.44 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 56.97 2nrw h ASN 424 Cb 1.26 0.00 -0.24 0.00 -1.12 0.00 0.00 38.32 38.22 2nrw h ASN 424 CO 0.34 0.48 -0.17 -0.22 -1.29 0.00 0.00 177.43 176.57 2nrw s LEU 425 N -7.04 0.07 -0.20 1.61 2.96 -1.02 -4.42 118.68 110.65 2nrw s LEU 425 Ca 0.00 0.98 -0.05 0.00 -0.22 0.00 0.00 54.13 54.84 2nrw s LEU 425 Cb 0.11 1.62 -0.02 0.00 0.50 0.00 0.00 46.19 48.39 2nrw s LEU 425 CO 0.72 -0.17 0.00 -0.22 -1.32 0.00 0.00 176.35 175.35 2nrw s LEU 426 N 0.52 3.26 -0.19 -0.68 2.96 -0.42 -2.26 118.68 121.88 2nrw s LEU 426 Ca -0.02 -0.20 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 2nrw s LEU 426 Cb -0.04 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 2nrw s LEU 426 CO -0.03 0.06 0.15 0.12 -1.32 0.00 0.00 176.35 175.34 2nrw s PHE 427 N 1.01 3.43 -0.04 5.38 5.36 0.29 -1.07 117.98 132.33 2nrw s PHE 427 Ca 0.02 0.38 0.07 0.00 -0.96 0.00 0.00 56.93 56.44 2nrw s PHE 427 Cb -0.14 -2.17 -0.01 0.00 -0.34 0.00 0.00 43.02 40.35 2nrw s PHE 427 CO 0.02 0.31 -0.24 0.14 -1.46 0.00 0.00 175.22 173.98 2nrw s VAL 428 N 0.28 1.97 0.82 3.12 -7.23 -0.92 -1.33 120.40 117.11 2nrw s VAL 428 Ca 0.10 -1.04 -0.10 0.00 -1.81 0.00 0.00 61.98 59.12 2nrw s VAL 428 Cb -0.11 -1.66 0.08 0.00 0.56 0.00 0.00 36.38 35.25 2nrw s VAL 428 CO -0.01 0.55 1.11 -1.81 -0.31 0.00 0.00 175.10 174.63 2nrw s ASP 429 N -0.31 4.01 0.10 4.85 1.11 -0.31 -4.40 116.67 121.72 2nrw s ASP 429 Ca 0.01 1.92 0.00 0.00 0.18 0.00 0.00 52.55 54.66 2nrw s ASP 429 Cb -0.12 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.34 2nrw s ASP 429 CO 0.02 -2.37 0.00 0.61 1.18 0.00 0.00 175.17 174.61 2nrw n GLY 430 N -0.79 -2.29 0.00 0.21 0.00 -1.26 -4.74 105.19 96.32 2nrw n GLY 430 Ca 0.10 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2nrw n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nrw n GLY 431 N -2.70 0.32 0.13 -0.02 0.00 -1.26 -4.40 105.19 97.26 2nrw n GLY 431 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2nrw n GLY 431 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2nrw h ILE 432 N 0.00 0.80 -0.58 -0.61 2.04 -1.95 -2.29 117.51 114.92 2nrw h ILE 432 Ca 0.00 -0.02 0.12 0.00 1.00 0.00 0.00 64.86 65.95 2nrw h ILE 432 Cb 0.00 0.72 -0.10 0.00 -0.74 0.00 0.00 36.82 36.70 2nrw h ILE 432 CO 0.00 0.01 -0.01 1.23 0.00 0.00 0.00 178.15 179.39 2nrw h GLY 433 N 0.07 0.60 1.56 5.37 0.00 -1.98 -0.31 103.07 108.39 2nrw h GLY 433 Ca 0.13 0.08 -0.22 0.00 0.00 0.00 0.00 47.33 47.33 2nrw h GLY 433 CO -0.23 -0.18 -0.90 1.46 0.00 0.00 0.00 176.54 176.69 2nrw h GLN 434 N 0.11 0.40 -0.18 4.80 1.08 -1.78 0.22 115.11 119.77 2nrw h GLN 434 Ca 0.30 -0.41 -0.00 0.00 -1.45 0.00 0.00 58.65 57.09 2nrw h GLN 434 Cb 0.48 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.01 2nrw h GLN 434 CO -0.50 1.08 0.11 0.28 -0.95 0.00 0.00 178.83 178.85 2nrw h VAL 435 N 0.23 1.07 -0.79 -0.54 2.07 -1.25 -1.89 116.25 115.15 2nrw h VAL 435 Ca -0.07 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2nrw h VAL 435 Cb 1.53 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 32.13 2nrw h VAL 435 CO 0.16 0.07 0.50 -1.13 0.02 0.00 0.00 177.57 177.19 2nrw h ASN 436 N 0.22 0.92 -0.05 0.57 -0.73 -0.64 -1.60 115.58 114.28 2nrw h ASN 436 Ca 0.06 -0.04 -0.00 0.00 1.87 0.00 0.00 56.30 58.20 2nrw h ASN 436 Cb 0.02 -0.23 -0.00 0.00 0.27 0.00 0.00 38.32 38.37 2nrw h ASN 436 CO -0.01 0.69 0.03 0.00 -0.37 0.00 0.00 177.43 177.76 2nrw h ALA 437 N 1.48 0.06 -0.49 1.57 0.00 -0.33 -0.60 119.26 120.95 2nrw h ALA 437 Ca 0.29 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.23 2nrw h ALA 437 Cb -0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.61 2nrw h ALA 437 CO -0.06 -0.40 0.12 0.00 0.00 0.00 0.00 179.25 178.91 2nrw h ALA 438 N 0.94 0.56 -0.30 0.00 0.00 -1.12 0.29 119.26 119.62 2nrw h ALA 438 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nrw h ALA 438 Cb 0.07 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2nrw h ALA 438 CO -0.00 -0.29 0.19 0.82 0.00 0.00 0.00 179.25 179.97 2nrw h ILE 439 N 0.26 1.09 -0.67 0.00 2.04 -1.19 -0.99 117.51 118.04 2nrw h ILE 439 Ca 0.24 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 2nrw h ILE 439 Cb 0.30 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2nrw h ILE 439 CO -0.30 0.08 0.33 -0.08 0.00 0.00 0.00 178.15 178.19 2nrw h GLU 440 N 0.40 0.97 -0.47 2.37 4.57 -0.62 -0.89 114.58 120.91 2nrw h GLU 440 Ca 0.11 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2nrw h GLU 440 Cb -0.03 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.36 2nrw h GLU 440 CO -0.02 0.76 0.28 0.00 -1.18 0.00 0.00 179.01 178.85 2nrw h ALA 441 N 1.15 0.61 -1.00 2.92 0.00 -0.81 -1.60 119.26 120.53 2nrw h ALA 441 Ca 0.23 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2nrw h ALA 441 Cb 0.11 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2nrw h ALA 441 CO -0.03 0.11 0.66 -0.07 0.00 0.00 0.00 179.25 179.92 2nrw h LEU 442 N 0.63 1.12 -0.13 0.00 3.38 -0.49 -2.51 115.31 117.31 2nrw h LEU 442 Ca 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2nrw h LEU 442 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2nrw h LEU 442 CO -0.03 0.78 0.05 0.11 0.09 0.00 0.00 178.44 179.44 2nrw h LYS 443 N 1.31 0.19 -0.36 1.13 1.57 -0.86 0.13 116.57 119.67 2nrw h LYS 443 Ca 0.39 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.24 2nrw h LYS 443 Cb -0.07 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2nrw h LYS 443 CO -0.11 0.29 0.29 0.93 -0.57 0.00 0.00 179.45 180.28 2nrw h GLU 444 N 0.05 0.00 -0.35 3.15 5.08 -0.93 0.07 114.58 121.65 2nrw h GLU 444 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2nrw h GLU 444 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2nrw h GLU 444 CO -0.00 0.00 0.00 0.44 -1.00 0.00 0.00 179.01 178.45 2nrw n ILE 445 N -4.22 0.48 -2.59 3.13 -5.35 -0.98 -4.98 119.36 104.84 2nrw n ILE 445 Ca 0.06 -0.74 -0.13 0.00 -0.27 0.00 0.00 62.75 61.67 2nrw n ILE 445 Cb 0.47 1.01 0.02 0.00 -1.74 0.00 0.00 39.64 39.39 2nrw n ILE 445 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nrw n GLY 446 N 1.42 -0.03 3.65 3.28 0.00 0.01 -5.02 105.19 108.49 2nrw n GLY 446 Ca 0.18 -0.29 -0.27 0.00 0.00 0.00 0.00 46.02 45.65 2nrw n GLY 446 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nrw s LYS 447 N -5.07 2.34 -0.19 1.61 3.01 0.40 -5.01 119.74 116.83 2nrw s LYS 447 Ca 0.14 -1.13 0.01 0.00 -1.01 0.00 0.00 55.97 53.98 2nrw s LYS 447 Cb -0.06 -2.33 0.04 0.00 -1.01 0.00 0.00 37.83 34.47 2nrw s LYS 447 CO 0.17 0.45 -0.12 0.34 0.51 0.00 0.00 175.35 176.70 2nrw s ASP 448 N -2.90 3.31 -0.28 2.83 -1.08 -1.26 -4.28 116.67 113.01 2nrw s ASP 448 Ca 0.27 -0.82 -0.16 0.00 -0.52 0.00 0.00 52.55 51.31 2nrw s ASP 448 Cb -0.09 -1.27 0.09 0.00 -1.46 0.00 0.00 42.92 40.18 2nrw s ASP 448 CO 0.18 -0.12 0.73 0.00 0.52 0.00 0.00 175.17 176.49 2nrw s PRO 450 N 1.55 4.14 -0.05 0.00 0.04 -1.26 -4.91 135.00 134.51 2nrw s PRO 450 Ca -0.09 2.50 0.03 0.00 0.04 0.00 0.00 61.00 63.48 2nrw s PRO 450 Cb -0.05 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2nrw s PRO 450 CO -0.19 -0.47 -0.14 0.08 0.04 0.00 0.00 177.00 176.32 2nrw s VAL 451 N -1.13 1.23 0.07 -0.36 1.01 -1.26 -1.30 120.40 118.66 2nrw s VAL 451 Ca 0.52 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.96 2nrw s VAL 451 Cb -0.45 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2nrw s VAL 451 CO 0.61 0.36 -0.13 0.54 0.00 0.00 0.00 175.10 176.49 2nrw s VAL 452 N 0.24 1.00 0.00 2.92 0.11 -0.23 -4.29 120.40 120.15 2nrw s VAL 452 Ca -0.07 -1.32 0.00 0.00 -2.93 0.00 0.00 61.98 57.66 2nrw s VAL 452 Cb -0.12 -1.04 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 2nrw s VAL 452 CO 0.02 -0.30 0.00 0.61 -3.33 0.00 0.00 175.10 172.10 2nrw n GLY 453 N 1.20 3.98 2.94 6.54 0.00 -0.56 -2.17 105.19 117.12 2nrw n GLY 453 Ca -0.21 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 2nrw n GLY 453 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nrw s LEU 454 N 0.00 1.31 0.89 0.99 1.02 -1.26 -1.40 118.68 120.22 2nrw s LEU 454 Ca 0.00 -0.32 -0.11 0.00 0.02 0.00 0.00 54.13 53.72 2nrw s LEU 454 Cb 0.00 -0.88 0.13 0.00 0.02 0.00 0.00 46.19 45.46 2nrw s LEU 454 CO 0.00 -0.09 1.11 0.00 0.02 0.00 0.00 176.35 177.39 2nrw s ALA 455 N 1.53 1.56 0.12 4.21 0.00 0.30 -4.05 121.76 125.43 2nrw s ALA 455 Ca 0.02 0.33 0.27 0.00 0.00 0.00 0.00 51.96 52.59 2nrw s ALA 455 Cb -0.13 -3.34 1.07 0.00 0.00 0.00 0.00 23.12 20.72 2nrw s ALA 455 CO -0.07 -2.49 1.88 0.87 0.00 0.00 0.00 175.76 175.96 2nrw h LYS 456 N -1.66 0.00 -6.67 0.00 1.57 -1.92 -3.42 116.57 104.46 2nrw h LYS 456 Ca -0.46 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.80 2nrw h LYS 456 Cb 1.26 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.63 2nrw h LYS 456 CO 0.47 0.14 0.90 0.21 -0.57 0.00 0.00 179.45 180.60 2nrw s LYS 457 N -3.66 4.18 0.45 3.15 2.20 -1.26 -4.98 119.74 119.82 2nrw s LYS 457 Ca 0.01 2.45 -0.24 0.00 -0.36 0.00 0.00 55.97 57.83 2nrw s LYS 457 Cb 0.10 -3.11 -0.09 0.00 -1.51 0.00 0.00 37.83 33.22 2nrw s LYS 457 CO 0.60 -0.62 1.20 -1.91 -0.36 0.00 0.00 175.35 174.26 2nrw n GLU 458 N 3.44 1.68 -2.45 4.03 2.13 -1.26 -3.64 120.64 124.57 2nrw n GLU 458 Ca 0.12 0.60 -0.19 0.00 0.66 0.00 0.00 57.16 58.36 2nrw n GLU 458 Cb 0.38 -2.31 -0.00 0.00 0.27 0.00 0.00 31.44 29.77 2nrw n GLU 458 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2nrw n GLU 459 N -0.15 -1.99 -3.99 5.31 1.02 -1.26 -4.95 120.64 114.63 2nrw n GLU 459 Ca 0.08 0.88 -0.26 0.00 -0.02 0.00 0.00 57.16 57.85 2nrw n GLU 459 Cb 0.41 -5.43 -0.17 0.00 -0.02 0.00 0.00 31.44 26.22 2nrw n GLU 459 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2nrw s THR 460 N -2.96 0.94 -0.05 2.62 2.01 -1.24 -0.68 115.64 116.28 2nrw s THR 460 Ca 0.05 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 2nrw s THR 460 Cb -0.02 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 2nrw s THR 460 CO 0.06 0.35 0.25 -0.69 -0.69 0.00 0.00 174.62 173.90 2nrw s VAL 461 N 1.57 5.32 -0.21 3.82 1.01 -0.14 -0.54 120.40 131.22 2nrw s VAL 461 Ca 0.02 0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.31 2nrw s VAL 461 Cb -0.13 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 2nrw s VAL 461 CO -0.06 0.52 -0.02 -0.69 0.00 0.00 0.00 175.10 174.85 2nrw s VAL 462 N -1.13 3.64 -0.20 2.92 1.01 -0.49 -0.78 120.40 125.37 2nrw s VAL 462 Ca 0.21 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 2nrw s VAL 462 Cb -0.14 -2.66 0.09 0.00 0.00 0.00 0.00 36.38 33.68 2nrw s VAL 462 CO 0.10 0.42 0.41 0.12 0.00 0.00 0.00 175.10 176.16 2nrw s PHE 463 N 1.29 -0.80 -1.31 5.22 5.36 -0.07 -1.50 117.98 126.18 2nrw s PHE 463 Ca 0.04 1.46 -0.04 0.00 -0.96 0.00 0.00 56.93 57.43 2nrw s PHE 463 Cb -0.14 0.28 0.01 0.00 -0.34 0.00 0.00 43.02 42.83 2nrw s PHE 463 CO -0.00 -0.50 0.97 0.39 -1.46 0.00 0.00 175.22 174.62 2nrw n GLU 464 N 5.39 -6.42 -0.90 10.12 1.02 -1.26 -1.08 120.64 127.51 2nrw n GLU 464 Ca -0.08 0.76 -0.05 0.00 -0.02 0.00 0.00 57.16 57.77 2nrw n GLU 464 Cb 0.49 -5.66 -0.02 0.00 -0.02 0.00 0.00 31.44 26.23 2nrw n GLU 464 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2nrw n ASN 465 N -3.05 -3.45 -4.91 1.62 5.15 -1.26 -4.97 115.26 104.39 2nrw n ASN 465 Ca -0.17 0.12 -0.32 0.00 -0.60 0.00 0.00 54.58 53.61 2nrw n ASN 465 Cb 0.62 -2.60 -0.04 0.00 -0.53 0.00 0.00 39.78 37.23 2nrw n ASN 465 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nrw s ARG 466 N -1.92 3.46 -0.21 1.20 1.70 -0.24 -5.10 118.95 117.83 2nrw s ARG 466 Ca 0.00 -0.36 -0.06 0.00 -0.47 0.00 0.00 55.73 54.85 2nrw s ARG 466 Cb 0.00 -3.04 -0.03 0.00 -0.57 0.00 0.00 34.95 31.31 2nrw s ARG 466 CO 0.00 0.62 0.02 -1.21 -1.08 0.00 0.00 175.30 173.65 2nrw s GLU 467 N -2.32 3.64 -0.21 3.89 2.02 -1.26 -0.89 118.70 123.57 2nrw s GLU 467 Ca 0.33 -0.50 -0.04 0.00 0.02 0.00 0.00 54.97 54.78 2nrw s GLU 467 Cb -0.13 -3.14 -0.01 0.00 0.10 0.00 0.00 34.13 30.95 2nrw s GLU 467 CO 0.24 -0.02 -0.03 0.42 0.02 0.00 0.00 175.26 175.90 2nrw s ILE 468 N 1.10 3.55 -0.03 -1.63 1.01 0.04 -4.94 121.20 120.30 2nrw s ILE 468 Ca 0.03 -0.44 -0.24 0.00 0.00 0.00 0.00 60.65 60.00 2nrw s ILE 468 Cb -0.14 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 2nrw s ILE 468 CO 0.02 0.42 0.72 -2.28 0.00 0.00 0.00 174.94 173.82 2nrw s HIS 469 N 1.33 3.62 -0.00 3.97 5.65 -1.26 -0.97 115.29 127.63 2nrw s HIS 469 Ca 0.04 1.31 0.04 0.00 0.25 0.00 0.00 55.06 56.70 2nrw s HIS 469 Cb -0.14 -2.81 -0.01 0.00 -1.18 0.00 0.00 32.58 28.44 2nrw s HIS 469 CO -0.01 0.14 -0.12 -0.51 -0.65 0.00 0.00 174.74 173.59 2nrw s LEU 470 N 0.55 2.04 0.97 8.88 1.43 0.14 -5.00 118.68 127.69 2nrw s LEU 470 Ca 0.38 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.12 2nrw s LEU 470 Cb -0.18 -0.62 0.18 0.00 0.03 0.00 0.00 46.19 45.59 2nrw s LEU 470 CO 0.19 0.14 1.09 -2.16 0.23 0.00 0.00 176.35 175.84 2nrw s PRO 471 N -0.38 0.60 0.25 1.29 0.04 -1.26 -4.72 135.00 130.82 2nrw s PRO 471 Ca 0.04 1.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.16 2nrw s PRO 471 Cb -0.05 -1.71 0.46 0.00 0.04 0.00 0.00 34.50 33.24 2nrw s PRO 471 CO -0.00 -2.78 1.73 1.25 0.04 0.00 0.00 177.00 177.24 2nrw h HIS 472 N -1.95 0.51 -0.46 0.56 -0.00 -2.01 -2.20 115.15 109.60 2nrw h HIS 472 Ca -0.50 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 2nrw h HIS 472 Cb 1.29 -0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 2nrw h HIS 472 CO 0.42 0.06 0.00 -0.25 -0.00 0.00 0.00 177.93 178.16 2nrw n ASP 473 N -5.00 4.32 -4.75 3.26 8.00 -1.26 -4.53 116.55 116.58 2nrw n ASP 473 Ca 0.14 -2.62 -0.41 0.00 0.71 0.00 0.00 54.79 52.61 2nrw n ASP 473 Cb 0.42 -0.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.98 2nrw n ASP 473 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2nrw s HIS 474 N -2.15 2.72 0.39 1.24 2.46 -0.83 -4.83 115.29 114.29 2nrw s HIS 474 Ca 0.44 0.82 0.18 0.00 0.47 0.00 0.00 55.06 56.97 2nrw s HIS 474 Cb 0.31 -4.07 1.01 0.00 -0.13 0.00 0.00 32.58 29.70 2nrw s HIS 474 CO 0.17 -3.55 1.94 -1.00 -2.47 0.00 0.00 174.74 169.83 2nrw h PRO 475 N 4.61 0.00 -0.33 2.88 0.13 -1.92 -1.17 132.00 136.20 2nrw h PRO 475 Ca -0.48 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 2nrw h PRO 475 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2nrw h PRO 475 CO 0.77 0.24 -0.36 0.28 -0.23 0.00 0.00 178.00 178.71 2nrw h VAL 476 N 0.00 1.29 -0.28 1.56 2.07 -1.90 -0.93 116.25 118.06 2nrw h VAL 476 Ca -0.00 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 2nrw h VAL 476 Cb 0.48 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2nrw h VAL 476 CO 0.03 0.50 0.12 0.25 0.02 0.00 0.00 177.57 178.49 2nrw h LEU 477 N 0.61 0.38 -0.75 2.57 5.85 -1.71 -1.46 115.31 120.80 2nrw h LEU 477 Ca 0.05 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2nrw h LEU 477 Cb 0.94 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.82 2nrw h LEU 477 CO 0.09 0.43 0.45 0.03 -0.34 0.00 0.00 178.44 179.10 2nrw h ARG 478 N 0.30 0.83 -0.12 1.25 2.47 -1.28 -1.78 114.38 116.06 2nrw h ARG 478 Ca 0.09 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.76 2nrw h ARG 478 Cb 0.16 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.29 2nrw h ARG 478 CO -0.01 0.55 0.06 1.25 0.56 0.00 0.00 179.97 182.38 2nrw h LEU 479 N 0.85 0.15 -0.85 3.04 6.46 -0.88 -0.97 115.31 123.11 2nrw h LEU 479 Ca 0.32 -0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.99 2nrw h LEU 479 Cb 0.12 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 39.97 2nrw h LEU 479 CO -0.15 0.20 0.54 -0.07 -0.62 0.00 0.00 178.44 178.33 2nrw h LEU 480 N 0.08 1.00 -0.65 2.25 3.38 -1.06 -1.80 115.31 118.51 2nrw h LEU 480 Ca 0.04 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2nrw h LEU 480 Cb 0.09 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2nrw h LEU 480 CO -0.01 0.75 0.24 0.58 0.09 0.00 0.00 178.44 180.09 2nrw h VAL 481 N 1.16 1.24 -0.35 1.22 2.07 -1.21 -0.79 116.25 119.60 2nrw h VAL 481 Ca 0.31 -0.80 0.04 0.00 0.82 0.00 0.00 66.70 67.07 2nrw h VAL 481 Cb -0.09 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 2nrw h VAL 481 CO -0.06 0.31 0.10 1.56 0.02 0.00 0.00 177.57 179.50 2nrw h GLN 482 N 0.93 0.23 -0.29 1.57 4.20 -0.58 -1.17 115.11 120.00 2nrw h GLN 482 Ca 0.21 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.95 2nrw h GLN 482 Cb 0.25 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2nrw h GLN 482 CO -0.01 0.15 0.08 0.82 -0.67 0.00 0.00 178.83 179.20 2nrw h ILE 483 N 0.24 0.90 -0.82 2.54 2.04 -1.06 -1.72 117.51 119.62 2nrw h ILE 483 Ca 0.16 -0.07 0.02 0.00 1.00 0.00 0.00 64.86 65.97 2nrw h ILE 483 Cb 0.15 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 2nrw h ILE 483 CO -0.18 0.04 0.54 -0.09 0.00 0.00 0.00 178.15 178.45 2nrw h ARG 484 N 0.20 1.05 -0.17 2.37 2.43 -0.90 -1.82 114.38 117.53 2nrw h ARG 484 Ca 0.13 -0.06 -0.21 0.00 -0.81 0.00 0.00 59.98 59.02 2nrw h ARG 484 Cb 0.12 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2nrw h ARG 484 CO -0.15 0.69 -0.74 -0.44 -1.51 0.00 0.00 179.97 177.83 2nrw h ASP 485 N 1.08 0.91 -0.99 -3.80 3.32 -1.06 -2.18 116.42 113.70 2nrw h ASP 485 Ca 0.31 -0.57 0.05 0.00 0.02 0.00 0.00 57.03 56.84 2nrw h ASP 485 Cb -0.07 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.15 2nrw h ASP 485 CO -0.09 1.37 0.64 -0.08 -1.72 0.00 0.00 179.24 179.37 2nrw h GLU 486 N 0.54 1.17 -0.80 3.56 4.57 -1.13 0.16 114.58 122.65 2nrw h GLU 486 Ca -0.04 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2nrw h GLU 486 Cb 1.36 -0.26 -0.04 0.00 -0.16 0.00 0.00 28.75 29.64 2nrw h GLU 486 CO 0.15 0.77 0.52 1.79 -1.18 0.00 0.00 179.01 181.06 2nrw h THR 487 N 1.20 1.21 -0.28 0.32 1.35 -0.73 -2.08 112.91 113.90 2nrw h THR 487 Ca 0.41 -0.40 -0.05 0.00 -0.55 0.00 0.00 66.41 65.81 2nrw h THR 487 Cb 0.09 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 66.55 2nrw h THR 487 CO -0.15 0.21 -0.03 0.45 -0.25 0.00 0.00 175.52 175.75 2nrw h HIS 488 N 1.08 0.58 -0.90 4.73 3.86 -1.07 0.25 115.15 123.68 2nrw h HIS 488 Ca 0.29 -0.11 0.08 0.00 -1.16 0.00 0.00 60.37 59.47 2nrw h HIS 488 Cb -0.10 -0.15 -0.07 0.00 1.06 0.00 0.00 27.41 28.15 2nrw h HIS 488 CO -0.01 0.69 0.56 -0.09 0.86 0.00 0.00 177.93 179.93 2nrw h ARG 489 N 0.30 0.95 -0.11 2.45 2.43 -0.54 -1.47 114.38 118.38 2nrw h ARG 489 Ca 0.08 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 2nrw h ARG 489 Cb 0.48 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2nrw h ARG 489 CO 0.02 0.63 -0.05 0.35 -1.51 0.00 0.00 179.97 179.41 2nrw h PHE 490 N 0.98 0.27 -0.84 2.20 3.57 -1.28 -3.23 116.94 118.62 2nrw h PHE 490 Ca 0.41 -0.07 0.15 0.00 3.53 0.00 0.00 57.97 62.00 2nrw h PHE 490 Cb 0.25 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.84 2nrw h PHE 490 CO -0.03 0.58 0.41 0.00 -2.23 0.00 0.00 178.31 177.04 2nrw h ALA 491 N 0.65 1.26 0.00 2.41 0.00 -0.57 -2.05 119.26 120.96 2nrw h ALA 491 Ca 0.03 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2nrw h ALA 491 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2nrw h ALA 491 CO 0.02 -0.13 0.00 1.33 0.00 0.00 0.00 179.25 180.46 2nrw n VAL 492 N -4.91 1.12 1.74 0.00 0.24 -0.59 -1.14 118.33 114.80 2nrw n VAL 492 Ca 0.17 0.28 0.15 0.00 -2.04 0.00 0.00 64.34 62.90 2nrw n VAL 492 Cb 0.45 -1.06 0.73 0.00 -1.47 0.00 0.00 33.84 32.49 2nrw n VAL 492 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2nrw n SER 493 N -1.50 0.76 -0.10 -1.34 3.41 -0.77 -3.19 113.62 110.90 2nrw n SER 493 Ca 0.03 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 2nrw n SER 493 Cb 0.15 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2nrw n SER 493 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nrw n TYR 494 N -0.41 0.00 -2.26 7.33 9.36 -0.29 -3.38 117.16 127.50 2nrw n TYR 494 Ca 0.21 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.45 2nrw n TYR 494 Cb 0.24 -0.02 0.01 0.00 -0.63 0.00 0.00 39.34 38.94 2nrw n TYR 494 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2nrw n HIS 495 N -0.40 0.00 -3.22 2.98 8.25 -1.19 -5.18 115.22 116.45 2nrw n HIS 495 Ca 0.00 -0.27 -0.37 0.00 -0.26 0.00 0.00 57.72 56.82 2nrw n HIS 495 Cb 0.05 -0.10 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 2nrw n HIS 495 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2nrw n ARG 496 N 0.26 3.61 0.00 -0.41 1.74 -1.22 -5.13 116.66 115.52 2nrw n ARG 496 Ca 0.03 -4.59 0.00 0.00 -0.77 0.00 0.00 57.85 52.52 2nrw n ARG 496 Cb 0.94 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 2nrw n ARG 496 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2nrw n GLU 502 N 1.30 0.00 0.01 5.56 4.71 -1.26 -5.07 120.64 125.89 2nrw n GLU 502 Ca 0.27 0.00 -0.18 0.00 -0.01 0.00 0.00 57.16 57.23 2nrw n GLU 502 Cb 0.36 0.00 -0.14 0.00 -1.01 0.00 0.00 31.44 30.65 2nrw n GLU 502 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2nrw h SER 503 N 0.06 0.33 -0.60 1.62 0.02 -1.99 -2.68 113.55 110.30 2nrw h SER 503 Ca 0.00 -0.96 -0.04 0.00 -0.84 0.00 0.00 61.79 59.95 2nrw h SER 503 Cb 0.00 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 2nrw h SER 503 CO 0.00 1.29 0.25 0.25 -1.14 0.00 0.00 176.83 177.48 2nrw h LEU 504 N -0.56 0.85 0.09 5.07 5.85 -1.95 -2.68 115.31 121.99 2nrw h LEU 504 Ca -0.11 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2nrw h LEU 504 Cb 1.46 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2nrw h LEU 504 CO 0.10 0.76 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.83 2nrw h ARG 505 N 0.91 -0.12 -0.92 1.25 2.43 -1.97 -1.32 114.38 114.64 2nrw h ARG 505 Ca 0.22 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 2nrw h ARG 505 Cb 0.18 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 2nrw h ARG 505 CO -0.02 0.18 0.59 1.03 -1.51 0.00 0.00 179.97 180.25 2nrw h SER 506 N -0.43 0.98 -0.13 -3.80 0.87 -1.47 -2.30 113.55 107.28 2nrw h SER 506 Ca -0.01 -0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.38 2nrw h SER 506 Cb 0.36 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 62.11 2nrw h SER 506 CO 0.02 0.67 -0.57 0.58 -0.53 0.00 0.00 176.83 177.00 2nrw h VAL 507 N 1.14 1.34 0.00 2.23 2.07 -1.48 -3.17 116.25 118.38 2nrw h VAL 507 Ca 0.37 -1.84 0.00 0.00 0.82 0.00 0.00 66.70 66.05 2nrw h VAL 507 Cb 0.03 2.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2nrw h VAL 507 CO -0.13 0.57 0.00 0.18 0.02 0.00 0.00 177.57 178.21 2nrw n LEU 508 N -4.15 0.60 0.11 2.57 4.77 -0.50 -1.28 117.00 119.12 2nrw n LEU 508 Ca -0.08 0.68 0.04 0.00 -0.03 0.00 0.00 56.01 56.63 2nrw n LEU 508 Cb 0.63 -0.64 0.45 0.00 -2.33 0.00 0.00 43.42 41.53 2nrw n LEU 508 CO 0.48 -0.66 1.01 0.44 -1.33 0.00 0.00 177.39 177.33 2nrw h ASP 509 N 0.00 0.26 0.00 -1.43 3.32 -1.38 -2.27 116.42 114.92 2nrw h ASP 509 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2nrw h ASP 509 Cb 0.25 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2nrw h ASP 509 CO 0.00 0.30 0.00 0.59 -1.72 0.00 0.00 179.24 178.41 2nrw n ASN 510 N -4.39 0.00 -4.37 6.45 3.02 -0.40 -4.74 115.26 110.83 2nrw n ASN 510 Ca -0.00 -0.84 -0.42 0.00 -0.03 0.00 0.00 54.58 53.29 2nrw n ASN 510 Cb 0.17 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.24 2nrw n ASN 510 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2nrw s VAL 511 N -2.00 4.81 0.36 2.41 1.01 -0.85 -5.07 120.40 121.07 2nrw s VAL 511 Ca 0.23 -1.03 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 2nrw s VAL 511 Cb 0.11 -3.81 -0.09 0.00 0.00 0.00 0.00 36.38 32.59 2nrw s VAL 511 CO 0.18 -0.43 1.08 -2.84 0.00 0.00 0.00 175.10 173.10 2nrw s PRO 512 N 1.57 4.28 -0.74 2.72 0.02 -1.26 -4.17 135.00 137.42 2nrw s PRO 512 Ca 0.03 1.65 -0.01 0.00 0.02 0.00 0.00 61.00 62.70 2nrw s PRO 512 Cb -0.22 -2.76 -0.01 0.00 0.02 0.00 0.00 34.50 31.54 2nrw s PRO 512 CO 0.06 -0.07 0.62 0.41 -0.33 0.00 0.00 177.00 177.69 2nrw n GLY 513 N 0.65 -0.13 1.38 0.52 0.00 -1.26 -4.98 105.19 101.37 2nrw n GLY 513 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2nrw n GLY 513 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2nrw n ILE 514 N -2.89 0.33 0.00 -0.61 3.06 -1.26 -5.04 119.36 112.95 2nrw n ILE 514 Ca -0.15 0.11 0.00 0.00 -2.50 0.00 0.00 62.75 60.21 2nrw n ILE 514 Cb 0.60 -1.16 0.00 0.00 0.54 0.00 0.00 39.64 39.62 2nrw n ILE 514 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2nrw n GLY 515 N 2.59 0.17 0.43 4.50 0.00 -1.26 -4.43 105.19 107.18 2nrw n GLY 515 Ca 0.00 -1.65 0.25 0.00 0.00 0.00 0.00 46.02 44.62 2nrw n GLY 515 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nrw h PRO 516 N 0.00 0.00 0.33 1.61 0.13 -2.02 -2.52 132.00 129.54 2nrw h PRO 516 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 2nrw h PRO 516 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2nrw h PRO 516 CO 0.00 0.00 -0.16 0.82 -0.23 0.00 0.00 178.00 178.43 2nrw h ILE 517 N 0.00 0.23 -0.08 -3.56 2.04 -2.01 -3.11 117.51 111.02 2nrw h ILE 517 Ca 0.34 -0.74 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 2nrw h ILE 517 Cb 1.42 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 2nrw h ILE 517 CO -0.00 0.06 -0.16 0.03 0.00 0.00 0.00 178.15 178.08 2nrw h ARG 518 N -1.06 0.13 -0.14 2.37 3.08 -1.74 -2.50 114.38 114.51 2nrw h ARG 518 Ca -0.05 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.02 2nrw h ARG 518 Cb 0.44 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.42 2nrw h ARG 518 CO 0.07 0.29 -0.15 0.87 -1.07 0.00 0.00 179.97 179.98 2nrw h LYS 519 N 0.12 -0.18 -0.02 0.04 1.57 -1.55 -1.83 116.57 114.72 2nrw h LYS 519 Ca 0.02 0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2nrw h LYS 519 Cb 0.36 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2nrw h LYS 519 CO 0.02 -0.12 -0.43 -0.22 -0.57 0.00 0.00 179.45 178.13 2nrw h LYS 520 N -0.19 0.05 0.38 3.15 3.64 -1.41 -1.11 116.57 121.09 2nrw h LYS 520 Ca 0.10 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2nrw h LYS 520 Cb 0.33 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2nrw h LYS 520 CO -0.25 0.48 -0.36 0.87 -2.27 0.00 0.00 179.45 177.91 2nrw h LYS 521 N 0.04 -0.73 -0.17 1.90 1.57 -1.18 -0.38 116.57 117.62 2nrw h LYS 521 Ca 0.00 0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 2nrw h LYS 521 Cb 0.79 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 2nrw h LYS 521 CO 0.06 -0.49 -0.16 -0.07 -0.57 0.00 0.00 179.45 178.22 2nrw h LEU 522 N -0.76 0.27 -0.66 2.94 3.38 -1.17 -0.05 115.31 119.27 2nrw h LEU 522 Ca -0.03 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 2nrw h LEU 522 Cb 0.68 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2nrw h LEU 522 CO -0.05 0.46 -0.15 0.40 0.09 0.00 0.00 178.44 179.19 2nrw h ILE 523 N 0.26 1.27 0.11 1.22 2.04 -1.15 -2.45 117.51 118.81 2nrw h ILE 523 Ca 0.05 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.63 2nrw h ILE 523 Cb 0.45 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2nrw h ILE 523 CO 0.03 0.44 -0.05 -0.33 0.00 0.00 0.00 178.15 178.23 2nrw h GLU 524 N 0.79 -0.14 -0.61 2.37 4.39 -0.01 0.28 114.58 121.66 2nrw h GLU 524 Ca 0.12 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.78 2nrw h GLU 524 Cb 0.68 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.34 2nrw h GLU 524 CO 0.05 0.33 0.18 1.25 -1.16 0.00 0.00 179.01 179.66 2nrw h HIS 525 N -0.70 0.95 0.00 4.33 2.76 -1.16 -3.35 115.15 117.98 2nrw h HIS 525 Ca -0.01 -0.08 -0.25 0.00 -2.20 0.00 0.00 60.37 57.82 2nrw h HIS 525 Cb 0.53 -0.28 -0.05 0.00 1.55 0.00 0.00 27.41 29.17 2nrw h HIS 525 CO 0.09 0.77 -1.95 1.19 -1.30 0.00 0.00 177.93 176.73 2nrw n PHE 526 N -4.27 0.00 0.00 5.26 3.72 -0.92 -5.01 117.46 116.23 2nrw n PHE 526 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2nrw n PHE 526 Cb 0.22 -0.67 0.00 0.00 -0.94 0.00 0.00 39.48 38.09 2nrw n PHE 526 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nrw n GLY 527 N 2.38 0.72 3.26 1.37 0.00 1.00 -4.64 105.19 109.29 2nrw n GLY 527 Ca -0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 2nrw n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nrw s SER 528 N 0.00 1.25 0.28 1.61 1.04 -1.26 -4.90 113.70 111.72 2nrw s SER 528 Ca 0.00 -1.22 -0.02 0.00 0.48 0.00 0.00 55.95 55.18 2nrw s SER 528 Cb 0.00 0.12 0.38 0.00 0.10 0.00 0.00 66.02 66.62 2nrw s SER 528 CO 0.00 -0.60 1.87 -0.07 0.98 0.00 0.00 173.24 175.42 2nrw h LEU 529 N 2.61 0.88 -0.75 2.42 3.38 -1.94 -2.65 115.31 119.26 2nrw h LEU 529 Ca -0.37 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 2nrw h LEU 529 Cb 1.22 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 2nrw h LEU 529 CO 0.62 0.77 0.46 -0.08 0.09 0.00 0.00 178.44 180.30 2nrw h GLU 530 N 0.96 1.01 -0.12 1.13 4.81 -1.96 -1.49 114.58 118.93 2nrw h GLU 530 Ca 0.23 -0.09 -0.20 0.00 -0.13 0.00 0.00 59.36 59.17 2nrw h GLU 530 Cb 0.14 -0.21 0.01 0.00 0.63 0.00 0.00 28.75 29.32 2nrw h GLU 530 CO -0.03 0.71 -0.72 -0.91 -0.73 0.00 0.00 179.01 177.33 2nrw h ASN 531 N 1.02 0.84 -0.12 1.04 2.35 -1.80 -2.86 115.58 116.05 2nrw h ASN 531 Ca 0.27 -0.65 -0.08 0.00 -0.55 0.00 0.00 56.30 55.29 2nrw h ASN 531 Cb -0.05 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 2nrw h ASN 531 CO -0.05 1.36 -0.15 -0.29 -1.65 0.00 0.00 177.43 176.65 2nrw h ILE 532 N 0.38 1.24 -0.06 2.81 2.10 -1.41 -2.49 117.51 120.08 2nrw h ILE 532 Ca -0.06 -1.06 -0.18 0.00 1.08 0.00 0.00 64.86 64.65 2nrw h ILE 532 Cb 1.36 1.18 -0.01 0.00 -1.09 0.00 0.00 36.82 38.27 2nrw h ILE 532 CO 0.15 0.34 -0.73 0.03 -1.08 0.00 0.00 178.15 176.86 2nrw h ARG 533 N 0.45 0.32 -0.33 2.19 3.08 -1.30 -3.06 114.38 115.74 2nrw h ARG 533 Ca 0.08 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2nrw h ARG 533 Cb 0.52 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2nrw h ARG 533 CO 0.03 0.92 0.00 -1.13 -1.07 0.00 0.00 179.97 178.72 2nrw n SER 534 N -3.81 2.49 -4.83 7.04 3.41 -1.08 -4.90 113.62 111.93 2nrw n SER 534 Ca -0.04 -1.89 -0.33 0.00 -0.26 0.00 0.00 58.87 56.36 2nrw n SER 534 Cb 0.70 -0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 2nrw n SER 534 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nrw s ALA 535 N -1.56 3.08 0.60 7.33 0.00 -0.94 -5.07 121.76 125.19 2nrw s ALA 535 Ca 0.34 0.28 -0.13 0.00 0.00 0.00 0.00 51.96 52.45 2nrw s ALA 535 Cb 0.19 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.17 2nrw s ALA 535 CO 0.27 0.01 1.03 -1.54 0.00 0.00 0.00 175.76 175.52 2nrw s SER 536 N -2.53 6.08 0.19 0.00 1.04 -1.26 -4.98 113.70 112.23 2nrw s SER 536 Ca 0.60 1.56 -0.12 0.00 0.48 0.00 0.00 55.95 58.47 2nrw s SER 536 Cb -0.09 -2.50 0.18 0.00 0.10 0.00 0.00 66.02 63.71 2nrw s SER 536 CO 0.20 -0.97 1.76 0.25 0.98 0.00 0.00 173.24 175.47 2nrw h LEU 537 N 0.04 0.25 -0.74 2.42 5.85 -1.97 -3.07 115.31 118.10 2nrw h LEU 537 Ca -0.45 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.41 2nrw h LEU 537 Cb 1.20 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 2nrw h LEU 537 CO 0.60 0.17 0.39 -0.33 -0.34 0.00 0.00 178.44 178.93 2nrw h GLU 538 N 0.42 0.65 -0.18 1.25 3.07 -1.99 -2.08 114.58 115.72 2nrw h GLU 538 Ca 0.25 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.04 2nrw h GLU 538 Cb 0.24 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 2nrw h GLU 538 CO -0.23 0.43 0.00 1.49 -1.40 0.00 0.00 179.01 179.30 2nrw h GLU 539 N 0.67 0.31 -0.68 2.33 4.81 -1.94 -2.94 114.58 117.14 2nrw h GLU 539 Ca 0.36 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 2nrw h GLU 539 Cb 0.34 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2nrw h GLU 539 CO -0.25 0.52 0.23 0.82 -0.73 0.00 0.00 179.01 179.60 2nrw h ILE 540 N 0.06 1.24 -0.72 2.32 2.04 -1.42 -1.94 117.51 119.09 2nrw h ILE 540 Ca 0.05 -0.82 0.11 0.00 1.00 0.00 0.00 64.86 65.20 2nrw h ILE 540 Cb 0.38 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 36.87 2nrw h ILE 540 CO 0.01 0.32 0.34 0.00 0.00 0.00 0.00 178.15 178.82 2nrw h ALA 541 N 1.25 1.01 -0.39 1.87 0.00 -1.38 -2.47 119.26 119.15 2nrw h ALA 541 Ca 0.22 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2nrw h ALA 541 Cb 0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2nrw h ALA 541 CO -0.01 -0.10 -0.15 0.00 0.00 0.00 0.00 179.25 178.99 2nrw h ARG 542 N 0.56 0.71 0.00 0.00 3.08 -1.18 0.89 114.38 118.44 2nrw h ARG 542 Ca 0.37 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 2nrw h ARG 542 Cb 0.45 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2nrw h ARG 542 CO -0.31 0.83 -0.21 0.28 -1.07 0.00 0.00 179.97 179.48 2nrw h VAL 543 N 0.64 1.09 0.00 2.04 2.07 -1.04 -3.34 116.25 117.71 2nrw h VAL 543 Ca 0.10 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2nrw h VAL 543 Cb 0.62 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2nrw h VAL 543 CO 0.04 0.21 -0.60 2.30 0.02 0.00 0.00 177.57 179.54 2nrw n ILE 544 N -4.20 0.00 -1.34 4.57 -6.64 -1.12 -4.86 119.36 105.77 2nrw n ILE 544 Ca -0.02 -0.16 0.00 0.00 -1.77 0.00 0.00 62.75 60.80 2nrw n ILE 544 Cb 0.28 0.65 0.00 0.00 -1.44 0.00 0.00 39.64 39.12 2nrw n ILE 544 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2nrw n GLY 545 N 1.81 0.67 3.17 3.28 0.00 0.30 -5.08 105.19 109.34 2nrw n GLY 545 Ca 0.00 -0.34 0.05 0.00 0.00 0.00 0.00 46.02 45.73 2nrw n GLY 545 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nrw s SER 546 N -2.37 -0.08 0.23 1.61 0.15 -0.97 -5.03 113.70 107.24 2nrw s SER 546 Ca 0.00 0.08 -0.06 0.00 0.70 0.00 0.00 55.95 56.68 2nrw s SER 546 Cb 0.00 1.08 0.23 0.00 -1.71 0.00 0.00 66.02 65.62 2nrw s SER 546 CO 0.00 -0.01 1.77 0.74 1.20 0.00 0.00 173.24 176.94 2nrw h THR 547 N 5.06 1.25 -0.55 6.45 2.02 -1.94 -2.33 112.91 122.87 2nrw h THR 547 Ca -0.12 -0.88 -0.08 0.00 0.77 0.00 0.00 66.41 66.10 2nrw h THR 547 Cb 1.15 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 2nrw h THR 547 CO -0.06 0.34 0.03 -0.08 0.37 0.00 0.00 175.52 176.12 2nrw h GLU 548 N 1.01 0.96 -0.08 6.66 4.81 -1.98 0.23 114.58 126.19 2nrw h GLU 548 Ca 0.22 -0.29 -0.19 0.00 -0.13 0.00 0.00 59.36 58.97 2nrw h GLU 548 Cb 0.30 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.60 2nrw h GLU 548 CO -0.01 0.95 -0.68 0.82 -0.73 0.00 0.00 179.01 179.37 2nrw h ILE 549 N 0.85 1.34 -0.84 2.32 2.04 -1.97 -2.59 117.51 118.66 2nrw h ILE 549 Ca 0.16 -1.98 0.01 0.00 1.00 0.00 0.00 64.86 64.05 2nrw h ILE 549 Cb 0.50 2.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.79 2nrw h ILE 549 CO 0.02 0.60 0.56 0.00 0.00 0.00 0.00 178.15 179.33 2nrw h ALA 550 N 0.45 1.41 -0.72 1.87 0.00 -1.30 0.25 119.26 121.21 2nrw h ALA 550 Ca -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2nrw h ALA 550 Cb 1.33 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2nrw h ALA 550 CO 0.14 0.54 0.42 0.00 0.00 0.00 0.00 179.25 180.35 2nrw h ARG 551 N 1.13 0.98 -0.58 0.00 3.08 -0.59 -2.55 114.38 115.86 2nrw h ARG 551 Ca 0.31 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 60.16 2nrw h ARG 551 Cb -0.11 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.72 2nrw h ARG 551 CO -0.07 0.71 -0.04 -0.09 -1.07 0.00 0.00 179.97 179.41 2nrw h ARG 552 N 0.98 1.04 -0.10 0.04 2.43 -0.92 -0.54 114.38 117.32 2nrw h ARG 552 Ca 0.26 -0.35 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2nrw h ARG 552 Cb -0.02 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2nrw h ARG 552 CO -0.05 1.05 -0.00 0.28 -1.51 0.00 0.00 179.97 179.74 2nrw h VAL 553 N 0.93 0.93 -0.36 0.20 2.07 -0.91 0.16 116.25 119.27 2nrw h VAL 553 Ca 0.16 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 2nrw h VAL 553 Cb 0.60 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2nrw h VAL 553 CO 0.04 0.01 -0.05 -0.07 0.02 0.00 0.00 177.57 177.52 2nrw h LEU 554 N 0.03 0.66 -0.25 2.57 3.38 -1.44 0.03 115.31 120.29 2nrw h LEU 554 Ca 0.05 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2nrw h LEU 554 Cb 0.06 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2nrw h LEU 554 CO -0.08 0.84 -0.10 -0.78 0.09 0.00 0.00 178.44 178.41 2nrw h ASP 555 N 0.46 -0.33 0.11 -0.43 3.58 -0.94 -3.19 116.42 115.67 2nrw h ASP 555 Ca 0.10 0.09 -0.25 0.00 0.42 0.00 0.00 57.03 57.38 2nrw h ASP 555 Cb 0.53 0.20 0.01 0.00 1.72 0.00 0.00 39.33 41.79 2nrw h ASP 555 CO 0.03 -0.13 -0.99 0.40 -2.88 0.00 0.00 179.24 175.67 2nrw h ILE 556 N -0.05 1.32 0.00 2.25 2.04 -0.58 -3.51 117.51 118.98 2nrw h ILE 556 Ca 0.13 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 63.69 2nrw h ILE 556 Cb 0.25 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 2nrw h ILE 556 CO -0.28 0.70 0.00 0.18 0.00 0.00 0.00 178.15 178.75