#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xkz s TYR 339 N 0.00 3.24 -0.44 1.20 5.04 0.44 -4.94 117.35 121.90 1xkz s TYR 339 Ca 0.00 1.11 0.15 0.00 -2.44 0.00 0.00 57.07 55.89 1xkz s TYR 339 Cb 0.00 -3.30 -0.20 0.00 0.35 0.00 0.00 41.96 38.82 1xkz s TYR 339 CO 0.00 -0.55 0.52 0.36 -1.34 0.00 0.00 175.55 174.54 1xkz n LYS 340 N 6.33 1.39 -1.80 4.97 2.85 -1.26 -4.85 118.16 125.79 1xkz n LYS 340 Ca 0.08 -0.06 -0.42 0.00 -1.05 0.00 0.00 58.31 56.86 1xkz n LYS 340 Cb 0.47 -1.28 -0.03 0.00 -0.65 0.00 0.00 35.03 33.55 1xkz n LYS 340 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1xkz s LYS 341 N -2.69 4.05 0.63 -1.58 -2.85 -1.26 -4.97 119.74 111.07 1xkz s LYS 341 Ca 0.01 2.37 -0.17 0.00 -1.00 0.00 0.00 55.97 57.18 1xkz s LYS 341 Cb 0.11 -4.12 -0.02 0.00 -2.06 0.00 0.00 37.83 31.75 1xkz s LYS 341 CO 0.63 -1.04 1.13 -1.25 0.10 0.00 0.00 175.35 174.93 1xkz s PRO 342 N 4.49 2.92 0.25 1.78 0.04 -1.26 -4.99 135.00 138.23 1xkz s PRO 342 Ca 0.83 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 63.09 1xkz s PRO 342 Cb -0.38 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 1xkz s PRO 342 CO 0.36 -1.18 1.06 -0.51 0.04 0.00 0.00 177.00 176.78 1xkz s LEU 343 N -4.53 4.56 -0.06 -3.56 1.43 -1.26 -4.96 118.68 110.30 1xkz s LEU 343 Ca 0.70 2.16 0.19 0.00 -1.03 0.00 0.00 54.13 56.14 1xkz s LEU 343 Cb -0.23 -3.62 -0.23 0.00 0.03 0.00 0.00 46.19 42.14 1xkz s LEU 343 CO 0.37 -0.09 0.45 0.00 0.23 0.00 0.00 176.35 177.31 1xkz n HIS 344 N 1.53 0.36 -2.49 0.29 -0.00 -1.26 -4.99 115.22 108.66 1xkz n HIS 344 Ca -0.00 0.12 -0.23 0.00 -0.00 0.00 0.00 57.72 57.60 1xkz n HIS 344 Cb 0.46 -0.90 0.07 0.00 -0.00 0.00 0.00 29.99 29.61 1xkz n HIS 344 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1xkz s ASN 345 N -5.34 4.86 0.41 4.39 2.20 -1.26 -5.04 114.94 115.15 1xkz s ASN 345 Ca -0.07 0.03 -0.27 0.00 -0.94 0.00 0.00 52.86 51.62 1xkz s ASN 345 Cb 0.09 -0.71 -0.10 0.00 -2.00 0.00 0.00 41.25 38.54 1xkz s ASN 345 CO 0.84 -1.49 1.46 -0.62 -2.94 0.00 0.00 177.10 174.36 1xkz s ASP 346 N -4.54 6.15 0.12 3.54 2.15 -1.25 -4.90 116.67 117.93 1xkz s ASP 346 Ca 0.61 3.00 -0.11 0.00 0.43 0.00 0.00 52.55 56.48 1xkz s ASP 346 Cb -0.09 -2.66 0.01 0.00 -0.30 0.00 0.00 42.92 39.87 1xkz s ASP 346 CO 0.42 -1.00 0.28 -0.72 -0.17 0.00 0.00 175.17 173.98 1xkz s TYR 347 N -1.15 0.11 -0.02 -5.34 -0.85 -1.26 -1.76 117.35 107.08 1xkz s TYR 347 Ca 0.56 -0.50 0.01 0.00 -0.52 0.00 0.00 57.07 56.62 1xkz s TYR 347 Cb -0.45 0.04 0.01 0.00 0.38 0.00 0.00 41.96 41.94 1xkz s TYR 347 CO 0.60 -0.64 -0.03 -1.14 -1.52 0.00 0.00 175.55 172.82 1xkz s GLN 348 N -3.87 0.47 -0.19 -3.49 0.74 0.34 -4.94 119.66 108.72 1xkz s GLN 348 Ca 0.07 -0.08 -0.20 0.00 0.05 0.00 0.00 55.36 55.21 1xkz s GLN 348 Cb 0.03 -0.52 -0.03 0.00 1.10 0.00 0.00 33.01 33.59 1xkz s GLN 348 CO -0.08 -0.02 0.58 0.42 -0.55 0.00 0.00 175.29 175.64 1xkz s ILE 349 N 0.49 5.06 0.35 -2.34 1.01 -1.26 -0.80 121.20 123.72 1xkz s ILE 349 Ca -0.05 1.09 0.07 0.00 0.00 0.00 0.00 60.65 61.76 1xkz s ILE 349 Cb -0.09 -3.90 -0.02 0.00 0.01 0.00 0.00 42.46 38.46 1xkz s ILE 349 CO -0.01 0.15 0.37 -0.76 0.00 0.00 0.00 174.94 174.69 1xkz s LEU 350 N 1.71 3.67 -0.38 2.97 1.43 0.57 -4.91 118.68 123.74 1xkz s LEU 350 Ca 0.27 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 1xkz s LEU 350 Cb -0.16 -2.36 0.11 0.00 0.03 0.00 0.00 46.19 43.82 1xkz s LEU 350 CO 0.10 -0.44 0.15 -0.62 0.23 0.00 0.00 176.35 175.77 1xkz s ASP 351 N -4.08 4.11 -0.28 2.29 2.15 -1.26 -4.34 116.67 115.26 1xkz s ASP 351 Ca 0.44 -2.21 0.11 0.00 0.43 0.00 0.00 52.55 51.32 1xkz s ASP 351 Cb -0.07 -1.17 0.57 0.00 -0.30 0.00 0.00 42.92 41.95 1xkz s ASP 351 CO 0.28 -0.34 1.56 0.29 -0.17 0.00 0.00 175.17 176.79 1xkz n LYS 352 N 4.13 2.53 -0.18 4.34 4.76 -1.26 -4.72 118.16 127.75 1xkz n LYS 352 Ca 0.03 -3.05 0.07 0.00 -2.87 0.00 0.00 58.31 52.50 1xkz n LYS 352 Cb 0.39 -1.93 0.36 0.00 -1.84 0.00 0.00 35.03 32.01 1xkz n LYS 352 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1xkz h SER 353 N 1.52 0.64 -0.52 4.39 4.64 -2.00 -1.88 113.55 120.35 1xkz h SER 353 Ca 0.20 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1xkz h SER 353 Cb 1.83 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 63.76 1xkz h SER 353 CO 0.47 0.41 0.32 0.11 -0.87 0.00 0.00 176.83 177.27 1xkz h LYS 354 N 0.73 0.69 -0.73 4.77 6.56 -1.94 -1.36 116.57 125.29 1xkz h LYS 354 Ca 0.32 -0.06 -0.02 0.00 -1.06 0.00 0.00 60.65 59.83 1xkz h LYS 354 Cb 0.30 -0.15 -0.03 0.00 -0.57 0.00 0.00 32.23 31.78 1xkz h LYS 354 CO -0.11 0.49 0.38 0.82 -2.06 0.00 0.00 179.45 178.97 1xkz h ILE 355 N 0.69 1.23 -0.54 1.86 1.08 -1.74 -2.83 117.51 117.27 1xkz h ILE 355 Ca 0.19 -0.60 -0.06 0.00 -0.39 0.00 0.00 64.86 63.99 1xkz h ILE 355 Cb -0.03 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 33.98 1xkz h ILE 355 CO -0.04 0.26 0.08 -0.26 -0.69 0.00 0.00 178.15 177.50 1xkz h PHE 356 N 1.01 0.90 0.00 1.37 -1.00 -1.19 -3.47 116.94 114.56 1xkz h PHE 356 Ca 0.25 -0.10 0.00 0.00 2.81 0.00 0.00 57.97 60.93 1xkz h PHE 356 Cb 0.07 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.38 1xkz h PHE 356 CO 0.00 0.78 0.00 0.41 -1.61 0.00 0.00 178.31 177.89 1xkz n GLY 357 N -0.74 3.70 0.01 -1.45 0.00 -0.53 -1.64 105.19 104.53 1xkz n GLY 357 Ca 0.03 0.22 0.14 0.00 0.00 0.00 0.00 46.02 46.41 1xkz n GLY 357 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xkz n SER 358 N 9.13 0.09 -4.88 1.61 3.41 -1.26 -4.79 113.62 116.94 1xkz n SER 358 Ca 0.00 0.51 -0.33 0.00 -0.26 0.00 0.00 58.87 58.79 1xkz n SER 358 Cb 0.00 -0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 63.37 1xkz n SER 358 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1xkz s ASN 359 N -3.17 6.58 0.03 4.04 0.01 -0.65 -4.21 114.94 117.58 1xkz s ASN 359 Ca 0.13 0.73 0.07 0.00 -0.71 0.00 0.00 52.86 53.08 1xkz s ASN 359 Cb 0.18 -2.15 -0.03 0.00 0.41 0.00 0.00 41.25 39.66 1xkz s ASN 359 CO 0.53 0.11 -0.17 -0.44 -1.51 0.00 0.00 177.10 175.62 1xkz s SER 360 N -2.05 3.85 0.00 -1.22 0.01 -0.63 -4.77 113.70 108.89 1xkz s SER 360 Ca 0.37 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.23 1xkz s SER 360 Cb -0.13 -0.65 0.00 0.00 0.21 0.00 0.00 66.02 65.45 1xkz s SER 360 CO 0.21 0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.73 1xkz n GLY 361 N 1.60 -0.67 3.23 3.44 0.00 -1.26 -0.79 105.19 110.74 1xkz n GLY 361 Ca -0.16 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 1xkz n GLY 361 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xkz s SER 362 N -4.00 0.03 -0.02 1.61 1.04 -0.53 -4.78 113.70 107.05 1xkz s SER 362 Ca 0.00 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.87 1xkz s SER 362 Cb 0.00 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.51 1xkz s SER 362 CO 0.00 -0.76 -0.02 0.12 0.98 0.00 0.00 173.24 173.57 1xkz s PHE 363 N -3.83 0.36 -0.03 5.02 5.36 -0.93 -1.63 117.98 122.29 1xkz s PHE 363 Ca 0.04 -0.04 0.02 0.00 -0.96 0.00 0.00 56.93 55.99 1xkz s PHE 363 Cb 0.04 -0.36 0.01 0.00 -0.34 0.00 0.00 43.02 42.37 1xkz s PHE 363 CO -0.11 -0.09 -0.10 0.08 -1.46 0.00 0.00 175.22 173.54 1xkz s VAL 364 N 0.59 0.86 0.05 3.12 1.01 -0.19 -0.70 120.40 125.14 1xkz s VAL 364 Ca -0.06 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.58 1xkz s VAL 364 Cb -0.09 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1xkz s VAL 364 CO -0.01 0.27 -0.12 -0.32 0.00 0.00 0.00 175.10 174.92 1xkz s MET 365 N 0.32 0.77 -0.07 2.72 1.75 0.21 -0.82 119.30 124.19 1xkz s MET 365 Ca -0.06 -0.81 0.02 0.00 -1.25 0.00 0.00 55.69 53.59 1xkz s MET 365 Cb -0.10 -0.73 0.02 0.00 2.84 0.00 0.00 34.83 36.85 1xkz s MET 365 CO 0.01 0.17 -0.10 -0.47 -0.65 0.00 0.00 175.02 173.98 1xkz s TYR 366 N -1.11 1.31 -0.25 4.11 5.04 0.94 -0.51 117.35 126.88 1xkz s TYR 366 Ca -0.02 -0.49 -0.14 0.00 -2.44 0.00 0.00 57.07 53.98 1xkz s TYR 366 Cb -0.09 -1.00 -0.04 0.00 0.35 0.00 0.00 41.96 41.18 1xkz s TYR 366 CO 0.01 -0.29 0.32 0.45 -1.34 0.00 0.00 175.55 174.71 1xkz s SER 367 N 0.83 6.24 0.08 4.32 0.15 -0.08 -1.21 113.70 124.03 1xkz s SER 367 Ca -0.12 0.26 -0.23 0.00 0.70 0.00 0.00 55.95 56.57 1xkz s SER 367 Cb -0.15 -2.18 -0.14 0.00 -1.71 0.00 0.00 66.02 61.83 1xkz s SER 367 CO 0.02 -0.10 1.66 0.24 1.20 0.00 0.00 173.24 176.26 1xkz h MET 368 N 7.93 0.06 -0.64 5.44 0.00 -1.67 0.81 114.93 126.86 1xkz h MET 368 Ca -0.34 -0.01 -0.09 0.00 0.00 0.00 0.00 59.70 59.27 1xkz h MET 368 Cb 1.17 -0.01 -0.02 0.00 0.00 0.00 0.00 31.60 32.73 1xkz h MET 368 CO 0.65 0.13 0.07 0.87 0.00 0.00 0.00 176.91 178.63 1xkz h LYS 369 N -0.02 1.08 0.00 1.72 6.56 -1.94 -2.86 116.57 121.12 1xkz h LYS 369 Ca 0.02 -0.31 0.00 0.00 -1.06 0.00 0.00 60.65 59.30 1xkz h LYS 369 Cb 0.09 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.63 1xkz h LYS 369 CO -0.00 1.01 -0.60 1.63 -2.06 0.00 0.00 179.45 179.44 1xkz n LYS 370 N -4.20 0.15 -3.88 3.15 5.02 -1.24 -4.97 118.16 112.20 1xkz n LYS 370 Ca 0.04 0.04 -0.25 0.00 -2.02 0.00 0.00 58.31 56.12 1xkz n LYS 370 Cb 0.31 -1.59 -0.00 0.00 -0.02 0.00 0.00 35.03 33.73 1xkz n LYS 370 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xkz n ASP 371 N -1.80 -0.90 -4.01 4.39 2.03 0.26 -4.94 116.55 111.57 1xkz n ASP 371 Ca 0.04 -0.94 -0.18 0.00 0.52 0.00 0.00 54.79 54.24 1xkz n ASP 371 Cb 0.39 -3.41 -0.14 0.00 -0.72 0.00 0.00 41.12 37.24 1xkz n ASP 371 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1xkz s LYS 372 N -6.38 0.66 0.03 -0.67 2.20 -1.14 -3.96 119.74 110.48 1xkz s LYS 372 Ca 0.06 -0.33 -0.01 0.00 -0.36 0.00 0.00 55.97 55.34 1xkz s LYS 372 Cb -0.03 -0.63 -0.04 0.00 -1.51 0.00 0.00 37.83 35.62 1xkz s LYS 372 CO 0.86 0.17 0.15 0.71 -0.36 0.00 0.00 175.35 176.89 1xkz s TYR 373 N -0.27 3.43 -0.10 4.03 1.51 -0.72 -0.90 117.35 124.33 1xkz s TYR 373 Ca 0.02 0.25 0.01 0.00 -1.01 0.00 0.00 57.07 56.34 1xkz s TYR 373 Cb -0.04 -1.76 0.02 0.00 -0.11 0.00 0.00 41.96 40.08 1xkz s TYR 373 CO -0.00 0.59 -0.10 0.71 -1.11 0.00 0.00 175.55 175.64 1xkz s TYR 374 N -1.36 1.57 -0.05 2.71 2.02 0.33 -0.50 117.35 122.07 1xkz s TYR 374 Ca 0.29 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 56.27 1xkz s TYR 374 Cb -0.13 -1.22 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 1xkz s TYR 374 CO 0.21 -0.44 -0.02 0.42 -1.57 0.00 0.00 175.55 174.15 1xkz s ILE 375 N 1.27 0.40 -0.17 2.71 1.01 0.02 -0.62 121.20 125.83 1xkz s ILE 375 Ca -0.03 -0.00 -0.07 0.00 0.00 0.00 0.00 60.65 60.55 1xkz s ILE 375 Cb -0.14 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1xkz s ILE 375 CO -0.04 0.21 0.06 -0.47 0.00 0.00 0.00 174.94 174.70 1xkz s TYR 376 N 1.21 3.26 -0.59 3.97 5.04 0.12 -0.31 117.35 130.04 1xkz s TYR 376 Ca -0.07 0.10 -0.04 0.00 -2.44 0.00 0.00 57.07 54.63 1xkz s TYR 376 Cb -0.14 -2.04 0.00 0.00 0.35 0.00 0.00 41.96 40.14 1xkz s TYR 376 CO -0.02 0.22 0.61 -1.71 -1.34 0.00 0.00 175.55 173.31 1xkz n ASN 377 N 3.28 -7.27 -0.05 4.32 2.85 -1.26 -2.20 115.26 114.93 1xkz n ASN 377 Ca -0.17 0.08 -0.08 0.00 -0.11 0.00 0.00 54.58 54.30 1xkz n ASN 377 Cb 0.53 -4.91 -0.01 0.00 1.24 0.00 0.00 39.78 36.62 1xkz n ASN 377 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1xkz h GLU 378 N 0.77 -0.08 -0.57 1.20 4.81 -1.94 0.30 114.58 119.06 1xkz h GLU 378 Ca 0.00 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1xkz h GLU 378 Cb 0.97 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.35 1xkz h GLU 378 CO 0.25 -0.06 0.30 0.87 -0.73 0.00 0.00 179.01 179.64 1xkz h LYS 379 N -0.09 0.81 -0.04 1.92 1.57 -2.00 -2.59 116.57 116.15 1xkz h LYS 379 Ca 0.13 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 1xkz h LYS 379 Cb 0.28 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1xkz h LYS 379 CO -0.30 0.63 -0.38 1.49 -0.57 0.00 0.00 179.45 180.32 1xkz h GLU 380 N 0.78 0.07 0.00 3.15 4.57 -1.87 -2.27 114.58 119.01 1xkz h GLU 380 Ca 0.20 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1xkz h GLU 380 Cb 0.07 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1xkz h GLU 380 CO -0.03 0.45 0.00 0.66 -1.18 0.00 0.00 179.01 178.91 1xkz h SER 381 N 0.06 0.00 0.01 1.04 4.64 -0.54 -2.16 113.55 116.61 1xkz h SER 381 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xkz h SER 381 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1xkz h SER 381 CO 0.05 0.00 -0.33 0.54 -0.87 0.00 0.00 176.83 176.22 1xkz n ARG 382 N -2.65 1.42 -2.62 4.77 1.74 -0.86 -0.84 116.66 117.62 1xkz n ARG 382 Ca 0.00 -1.14 -0.42 0.00 -0.77 0.00 0.00 57.85 55.53 1xkz n ARG 382 Cb 0.21 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1xkz n ARG 382 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1xkz s LYS 383 N -2.36 4.57 -0.02 5.56 -0.14 -0.81 -0.42 119.74 126.11 1xkz s LYS 383 Ca 0.22 1.54 -0.20 0.00 -1.36 0.00 0.00 55.97 56.18 1xkz s LYS 383 Cb 0.19 -3.39 -0.05 0.00 -1.68 0.00 0.00 37.83 32.89 1xkz s LYS 383 CO 0.50 -0.02 0.56 1.03 -0.76 0.00 0.00 175.35 176.66 1xkz s ARG 384 N 0.61 4.29 0.07 1.68 0.52 -1.26 -4.07 118.95 120.78 1xkz s ARG 384 Ca 0.52 0.67 0.02 0.00 -0.52 0.00 0.00 55.73 56.41 1xkz s ARG 384 Cb -0.25 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 31.84 1xkz s ARG 384 CO 0.30 0.36 -0.07 0.71 0.02 0.00 0.00 175.30 176.62 1xkz s TYR 385 N -0.12 0.76 0.31 -0.53 1.51 -0.23 -4.76 117.35 114.28 1xkz s TYR 385 Ca 0.30 -0.77 -0.30 0.00 -1.01 0.00 0.00 57.07 55.30 1xkz s TYR 385 Cb -0.18 -0.45 -0.12 0.00 -0.11 0.00 0.00 41.96 41.10 1xkz s TYR 385 CO 0.16 -0.15 1.53 0.45 -1.11 0.00 0.00 175.55 176.43 1xkz n SER 386 N 0.56 3.64 0.00 2.29 2.88 -1.26 -0.67 113.62 121.06 1xkz n SER 386 Ca -0.17 1.17 0.14 0.00 -1.33 0.00 0.00 58.87 58.68 1xkz n SER 386 Cb 0.58 -1.57 0.73 0.00 -0.75 0.00 0.00 64.21 63.20 1xkz n SER 386 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1xkz n PRO 387 N 1.62 0.49 0.00 -1.46 -0.04 -1.26 -4.86 135.00 129.49 1xkz n PRO 387 Ca 0.07 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1xkz n PRO 387 Cb 0.37 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1xkz n PRO 387 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1xkz n ASN 388 N -1.24 0.00 0.21 3.54 0.23 -0.90 -0.89 115.26 116.22 1xkz n ASN 388 Ca 0.15 0.00 0.15 0.00 -0.53 0.00 0.00 54.58 54.34 1xkz n ASN 388 Cb 0.20 0.00 0.66 0.00 -2.08 0.00 0.00 39.78 38.56 1xkz n ASN 388 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1xkz h SER 389 N 0.00 0.00 0.52 0.53 0.02 -1.83 -1.85 113.55 110.94 1xkz h SER 389 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xkz h SER 389 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1xkz h SER 389 CO 0.00 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.04 1xkz n THR 390 N -2.60 0.99 0.35 -2.27 -2.24 -0.07 -1.32 114.28 107.13 1xkz n THR 390 Ca 0.00 0.32 0.14 0.00 -2.27 0.00 0.00 64.05 62.24 1xkz n THR 390 Cb 0.20 -1.21 0.57 0.00 -2.10 0.00 0.00 70.33 67.79 1xkz n THR 390 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1xkz h TYR 391 N 0.00 0.00 -0.02 4.78 5.03 -1.44 -2.33 116.97 122.99 1xkz h TYR 391 Ca 0.00 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.32 1xkz h TYR 391 Cb 0.26 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.54 1xkz h TYR 391 CO 0.00 0.00 0.02 0.87 -1.32 0.00 0.00 178.16 177.73 1xkz h LYS 392 N 0.00 0.00 -0.52 1.82 1.57 -1.41 -0.11 116.57 117.92 1xkz h LYS 392 Ca 0.00 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1xkz h LYS 392 Cb 0.43 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.70 1xkz h LYS 392 CO 0.00 0.00 0.28 0.82 -0.57 0.00 0.00 179.45 179.98 1xkz h ILE 393 N 0.00 0.97 0.03 1.86 2.04 -1.62 0.07 117.51 120.86 1xkz h ILE 393 Ca 0.01 -0.18 -0.23 0.00 1.00 0.00 0.00 64.86 65.45 1xkz h ILE 393 Cb 0.05 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1xkz h ILE 393 CO -0.00 0.10 -0.99 1.88 0.00 0.00 0.00 178.15 179.13 1xkz h TYR 394 N 0.54 0.55 -0.40 1.37 -1.99 -1.31 -2.29 116.97 113.44 1xkz h TYR 394 Ca 0.23 -0.32 -0.08 0.00 2.00 0.00 0.00 58.73 60.56 1xkz h TYR 394 Cb 0.12 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 38.77 1xkz h TYR 394 CO -0.09 1.16 -0.08 -0.07 -0.00 0.00 0.00 178.16 179.07 1xkz h LEU 395 N 0.18 0.67 -0.10 3.88 3.38 -0.88 -0.10 115.31 122.34 1xkz h LEU 395 Ca -0.09 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1xkz h LEU 395 Cb 1.65 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 42.21 1xkz h LEU 395 CO 0.17 0.79 0.06 0.00 0.09 0.00 0.00 178.44 179.55 1xkz h ALA 396 N 1.28 0.13 -0.87 1.53 0.00 -0.96 0.81 119.26 121.17 1xkz h ALA 396 Ca 0.11 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1xkz h ALA 396 Cb 0.52 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1xkz h ALA 396 CO 0.03 -0.35 0.58 0.52 0.00 0.00 0.00 179.25 180.03 1xkz h MET 397 N 0.08 1.15 -0.47 0.00 2.86 -0.98 0.38 114.93 117.95 1xkz h MET 397 Ca 0.03 -0.07 -0.13 0.00 -2.06 0.00 0.00 59.70 57.48 1xkz h MET 397 Cb 0.06 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1xkz h MET 397 CO -0.01 0.76 -0.22 0.74 1.06 0.00 0.00 176.91 179.25 1xkz h PHE 398 N 1.18 1.12 -0.82 -0.22 0.05 -0.87 0.32 116.94 117.71 1xkz h PHE 398 Ca 0.32 -0.28 -0.01 0.00 3.82 0.00 0.00 57.97 61.83 1xkz h PHE 398 Cb -0.13 -0.26 -0.04 0.00 2.00 0.00 0.00 35.95 37.52 1xkz h PHE 398 CO -0.01 1.10 0.47 0.78 -0.18 0.00 0.00 178.31 180.47 1xkz h GLY 399 N 0.83 1.21 1.07 -1.45 0.00 -0.36 0.22 103.07 104.58 1xkz h GLY 399 Ca 0.11 -0.52 -0.22 0.00 0.00 0.00 0.00 47.33 46.70 1xkz h GLY 399 CO 0.07 0.50 -0.82 1.41 0.00 0.00 0.00 176.54 177.70 1xkz h LEU 400 N 1.14 0.80 -1.36 3.11 3.38 -0.49 -0.57 115.31 121.33 1xkz h LEU 400 Ca 0.29 -0.71 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 1xkz h LEU 400 Cb -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1xkz h LEU 400 CO -0.05 1.40 -0.07 -0.78 0.09 0.00 0.00 178.44 179.03 1xkz h ASP 401 N 0.28 0.32 -0.38 -0.43 -0.00 0.04 -2.55 116.42 113.71 1xkz h ASP 401 Ca -0.09 -0.06 0.00 0.00 -0.00 0.00 0.00 57.03 56.88 1xkz h ASP 401 Cb 1.48 -0.08 0.00 0.00 -0.00 0.00 0.00 39.33 40.73 1xkz h ASP 401 CO 0.16 0.43 0.00 0.54 -0.00 0.00 0.00 179.24 180.38 1xkz n ARG 402 N -4.29 2.05 -2.14 0.28 1.74 0.03 -4.94 116.66 109.40 1xkz n ARG 402 Ca 0.00 -1.61 -0.19 0.00 -0.77 0.00 0.00 57.85 55.28 1xkz n ARG 402 Cb 0.25 -1.40 -0.03 0.00 -1.02 0.00 0.00 32.46 30.26 1xkz n ARG 402 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1xkz n HIS 403 N 0.81 -0.77 -0.08 -1.55 8.25 -0.96 -4.87 115.22 116.06 1xkz n HIS 403 Ca 0.16 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.49 1xkz n HIS 403 Cb 0.41 -3.59 -0.02 0.00 1.12 0.00 0.00 29.99 27.91 1xkz n HIS 403 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1xkz h ILE 404 N 0.00 1.28 -3.29 1.59 1.08 -1.37 -3.44 117.51 113.37 1xkz h ILE 404 Ca -0.44 -1.70 -0.36 0.00 -0.39 0.00 0.00 64.86 61.98 1xkz h ILE 404 Cb 1.31 1.58 -0.15 0.00 -3.07 0.00 0.00 36.82 36.50 1xkz h ILE 404 CO 0.55 0.55 -0.72 0.27 -0.69 0.00 0.00 178.15 178.11 1xkz s ILE 405 N -4.18 1.30 0.20 -0.67 -4.36 -1.14 -5.01 121.20 107.35 1xkz s ILE 405 Ca -0.10 -2.07 -0.02 0.00 -0.26 0.00 0.00 60.65 58.20 1xkz s ILE 405 Cb 0.11 -1.86 0.01 0.00 1.25 0.00 0.00 42.46 41.96 1xkz s ILE 405 CO 0.88 -0.69 0.29 -0.46 0.24 0.00 0.00 174.94 175.21 1xkz n ASN 406 N -0.18 -0.83 0.10 4.36 0.23 -0.77 -4.35 115.26 113.82 1xkz n ASN 406 Ca -0.10 -2.05 0.12 0.00 -0.53 0.00 0.00 54.58 52.02 1xkz n ASN 406 Cb 0.60 1.51 0.45 0.00 -2.08 0.00 0.00 39.78 40.27 1xkz n ASN 406 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1xkz n ASP 407 N -1.79 0.59 -0.02 0.53 5.75 -1.26 -2.97 116.55 117.38 1xkz n ASP 407 Ca -0.00 0.60 -0.15 0.00 -0.01 0.00 0.00 54.79 55.23 1xkz n ASP 407 Cb 0.33 -0.74 -0.14 0.00 -1.03 0.00 0.00 41.12 39.54 1xkz n ASP 407 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1xkz n GLU 408 N -2.10 0.70 -3.66 0.11 4.07 -1.26 -4.91 120.64 113.59 1xkz n GLU 408 Ca 0.04 0.26 -0.07 0.00 -0.06 0.00 0.00 57.16 57.33 1xkz n GLU 408 Cb 0.30 -1.73 -0.08 0.00 -0.06 0.00 0.00 31.44 29.86 1xkz n GLU 408 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1xkz s ASN 409 N -6.54 -0.45 -0.05 4.31 2.47 -1.16 -4.98 114.94 108.54 1xkz s ASN 409 Ca -0.15 1.12 0.08 0.00 0.42 0.00 0.00 52.86 54.33 1xkz s ASN 409 Cb 0.07 1.54 0.12 0.00 -1.45 0.00 0.00 41.25 41.53 1xkz s ASN 409 CO 0.79 -0.23 1.00 -1.54 -3.72 0.00 0.00 177.10 173.40 1xkz n SER 410 N 5.37 1.61 -4.76 -4.21 3.41 -1.25 -1.85 113.62 111.94 1xkz n SER 410 Ca -0.10 -2.32 -0.40 0.00 -0.26 0.00 0.00 58.87 55.80 1xkz n SER 410 Cb 0.50 -0.20 -0.04 0.00 -0.26 0.00 0.00 64.21 64.21 1xkz n SER 410 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1xkz s ARG 411 N -1.49 4.51 -0.04 4.33 3.00 -1.26 -3.35 118.95 124.65 1xkz s ARG 411 Ca 0.13 1.89 0.01 0.00 0.00 0.00 0.00 55.73 57.75 1xkz s ARG 411 Cb 0.11 -3.09 0.02 0.00 0.00 0.00 0.00 34.95 31.99 1xkz s ARG 411 CO 0.01 0.06 -0.03 -1.64 0.00 0.00 0.00 175.30 173.70 1xkz s MET 412 N -1.64 0.65 0.43 3.54 -1.94 0.13 -4.99 119.30 115.47 1xkz s MET 412 Ca 0.47 -0.07 -0.22 0.00 -1.71 0.00 0.00 55.69 54.17 1xkz s MET 412 Cb -0.33 -0.69 -0.10 0.00 2.01 0.00 0.00 34.83 35.71 1xkz s MET 412 CO 0.43 -0.07 0.98 -1.12 -0.01 0.00 0.00 175.02 175.23 1xkz s SER 413 N 0.82 6.84 0.29 3.03 0.01 -1.26 -1.51 113.70 121.92 1xkz s SER 413 Ca -0.10 1.80 -0.29 0.00 1.31 0.00 0.00 55.95 58.67 1xkz s SER 413 Cb -0.13 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 1xkz s SER 413 CO -0.00 -0.43 1.08 0.86 0.41 0.00 0.00 173.24 175.15 1xkz s TRP 414 N -2.00 3.57 -2.19 2.43 -0.00 -1.26 -4.89 118.94 114.59 1xkz s TRP 414 Ca 0.61 1.71 0.18 0.00 -0.00 0.00 0.00 56.10 58.61 1xkz s TRP 414 Cb -0.13 -3.24 0.73 0.00 -0.00 0.00 0.00 33.47 30.83 1xkz s TRP 414 CO 0.18 -0.48 1.52 0.27 -0.00 0.00 0.00 176.95 178.43 1xkz n ASN 415 N 1.02 1.37 0.00 5.86 0.23 -1.26 -4.91 115.26 117.57 1xkz n ASN 415 Ca -0.00 -1.71 0.00 0.00 -0.53 0.00 0.00 54.58 52.34 1xkz n ASN 415 Cb 0.46 -0.10 0.00 0.00 -2.08 0.00 0.00 39.78 38.05 1xkz n ASN 415 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1xkz n HIS 416 N 0.15 0.00 -2.62 -2.53 8.25 -1.26 -5.01 115.22 112.19 1xkz n HIS 416 Ca 0.15 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.21 1xkz n HIS 416 Cb 0.27 -0.54 -0.05 0.00 1.12 0.00 0.00 29.99 30.79 1xkz n HIS 416 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1xkz s LYS 417 N -0.52 4.75 -0.25 -0.41 1.02 -1.26 -4.97 119.74 118.09 1xkz s LYS 417 Ca 0.00 1.63 -0.28 0.00 0.02 0.00 0.00 55.97 57.34 1xkz s LYS 417 Cb 0.00 -3.22 0.01 0.00 -0.52 0.00 0.00 37.83 34.10 1xkz s LYS 417 CO 0.00 0.37 1.02 -1.58 -0.92 0.00 0.00 175.35 174.24 1xkz s HIS 418 N -1.19 3.29 0.11 3.18 2.46 -1.26 -4.92 115.29 116.96 1xkz s HIS 418 Ca 0.43 1.36 0.03 0.00 0.47 0.00 0.00 55.06 57.35 1xkz s HIS 418 Cb -0.29 -3.34 -0.04 0.00 -0.13 0.00 0.00 32.58 28.79 1xkz s HIS 418 CO 0.36 -0.54 0.17 0.71 -2.47 0.00 0.00 174.74 172.97 1xkz s TYR 419 N 3.26 3.33 -0.31 3.88 1.51 -1.26 -5.01 117.35 122.74 1xkz s TYR 419 Ca 0.43 0.11 0.23 0.00 -1.01 0.00 0.00 57.07 56.84 1xkz s TYR 419 Cb -0.14 -1.64 1.11 0.00 -0.11 0.00 0.00 41.96 41.17 1xkz s TYR 419 CO 0.08 0.54 1.71 -0.35 -1.11 0.00 0.00 175.55 176.42 1xkz n PRO 420 N 0.04 0.18 -4.33 -1.71 -0.04 -1.26 -4.62 135.00 123.25 1xkz n PRO 420 Ca -0.07 0.53 -0.34 0.00 -0.04 0.00 0.00 63.50 63.58 1xkz n PRO 420 Cb 0.53 -1.94 -0.14 0.00 -0.04 0.00 0.00 33.50 31.90 1xkz n PRO 420 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1xkz s PHE 421 N -3.45 2.87 0.48 0.54 0.40 -1.26 -5.01 117.98 112.55 1xkz s PHE 421 Ca 0.01 -0.89 0.21 0.00 -0.60 0.00 0.00 56.93 55.66 1xkz s PHE 421 Cb 0.08 -1.96 1.24 0.00 0.51 0.00 0.00 43.02 42.88 1xkz s PHE 421 CO 0.31 -0.42 1.97 0.38 0.70 0.00 0.00 175.22 178.15 1xkz h ASP 422 N 7.44 0.18 0.51 1.36 3.04 -1.98 0.46 116.42 127.42 1xkz h ASP 422 Ca -0.35 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.45 1xkz h ASP 422 Cb 1.18 -0.03 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 1xkz h ASP 422 CO 0.59 0.10 0.00 0.00 -2.04 0.00 0.00 179.24 177.88 1xkz h ALA 423 N 1.70 1.00 0.00 4.15 0.00 -1.96 -1.31 119.26 122.83 1xkz h ALA 423 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1xkz h ALA 423 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xkz h ALA 423 CO -0.05 0.00 -1.12 0.91 0.00 0.00 0.00 179.25 178.99 1xkz n TRP 424 N -2.74 0.48 -1.51 0.00 7.02 0.15 -4.46 117.44 116.37 1xkz n TRP 424 Ca -0.00 0.14 -0.28 0.00 -1.02 0.00 0.00 57.50 56.33 1xkz n TRP 424 Cb 0.18 -0.63 -0.06 0.00 -2.42 0.00 0.00 31.31 28.38 1xkz n TRP 424 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1xkz n ASN 425 N -2.24 6.82 -3.55 -0.99 5.03 -0.50 -4.83 115.26 115.00 1xkz n ASN 425 Ca 0.01 -3.01 -0.03 0.00 0.87 0.00 0.00 54.58 52.42 1xkz n ASN 425 Cb 0.49 -1.32 0.00 0.00 -1.02 0.00 0.00 39.78 37.93 1xkz n ASN 425 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1xkz s LYS 426 N -0.78 1.15 0.54 3.52 -2.85 -1.26 -5.06 119.74 114.99 1xkz s LYS 426 Ca 0.60 -0.70 -0.21 0.00 -1.00 0.00 0.00 55.97 54.66 1xkz s LYS 426 Cb 0.31 0.35 -0.05 0.00 -2.06 0.00 0.00 37.83 36.38 1xkz s LYS 426 CO -0.14 -0.53 1.28 -2.00 0.10 0.00 0.00 175.35 174.05 1xkz s GLU 427 N -2.63 3.23 0.11 1.78 2.12 -1.26 -4.32 118.70 117.74 1xkz s GLU 427 Ca 0.17 2.03 0.04 0.00 0.36 0.00 0.00 54.97 57.58 1xkz s GLU 427 Cb -0.01 -2.21 -0.04 0.00 0.26 0.00 0.00 34.13 32.13 1xkz s GLU 427 CO 0.03 -1.06 -0.11 -0.65 -0.54 0.00 0.00 175.26 172.94 1xkz s GLN 428 N -2.96 0.92 0.47 4.30 -1.52 -0.57 -4.94 119.66 115.37 1xkz s GLN 428 Ca 0.71 -1.23 0.02 0.00 -1.95 0.00 0.00 55.36 52.92 1xkz s GLN 428 Cb -0.35 -0.63 -0.01 0.00 -0.22 0.00 0.00 33.01 31.80 1xkz s GLN 428 CO 0.41 0.10 0.07 0.16 -0.25 0.00 0.00 175.29 175.78 1xkz s ASP 429 N -2.58 3.55 0.21 5.90 1.47 -1.26 -0.69 116.67 123.26 1xkz s ASP 429 Ca 0.08 -1.69 -0.09 0.00 1.18 0.00 0.00 52.55 52.03 1xkz s ASP 429 Cb -0.02 0.58 0.28 0.00 -0.34 0.00 0.00 42.92 43.42 1xkz s ASP 429 CO 0.01 -0.92 1.77 0.25 0.68 0.00 0.00 175.17 176.96 1xkz h LEU 430 N 1.52 0.39 -0.64 2.11 5.85 -1.97 -0.73 115.31 121.84 1xkz h LEU 430 Ca -0.40 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 1xkz h LEU 430 Cb 1.30 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 1xkz h LEU 430 CO 0.65 0.23 0.26 0.78 -0.34 0.00 0.00 178.44 180.02 1xkz h ASN 431 N 0.54 0.89 0.11 1.25 4.21 -1.93 -0.61 115.58 120.03 1xkz h ASN 431 Ca 0.32 -0.17 -0.17 0.00 1.21 0.00 0.00 56.30 57.49 1xkz h ASN 431 Cb 0.32 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 1xkz h ASN 431 CO -0.26 0.82 -0.62 0.71 -1.29 0.00 0.00 177.43 176.79 1xkz h THR 432 N 0.90 1.34 -0.57 2.81 1.35 -1.86 -1.69 112.91 115.19 1xkz h THR 432 Ca 0.21 -1.91 -0.06 0.00 -0.55 0.00 0.00 66.41 64.10 1xkz h THR 432 Cb 0.21 1.89 -0.02 0.00 -1.73 0.00 0.00 68.15 68.50 1xkz h THR 432 CO -0.02 0.59 0.14 0.00 -0.25 0.00 0.00 175.52 175.98 1xkz h ALA 433 N 0.96 0.75 -0.22 6.62 0.00 -0.96 -1.44 119.26 124.97 1xkz h ALA 433 Ca -0.01 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1xkz h ALA 433 Cb 1.17 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1xkz h ALA 433 CO 0.11 0.45 -0.38 1.98 0.00 0.00 0.00 179.25 181.42 1xkz h MET 434 N 0.82 0.64 -0.73 0.00 -1.53 -1.08 -0.49 114.93 112.57 1xkz h MET 434 Ca 0.18 -0.40 -0.05 0.00 -3.44 0.00 0.00 59.70 55.99 1xkz h MET 434 Cb 0.34 0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.40 1xkz h MET 434 CO 0.00 1.01 0.27 0.37 0.14 0.00 0.00 176.91 178.70 1xkz h GLN 435 N 0.34 1.10 -0.60 0.39 4.15 -1.21 -2.73 115.11 116.55 1xkz h GLN 435 Ca 0.01 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.22 1xkz h GLN 435 Cb 0.97 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.49 1xkz h GLN 435 CO 0.09 0.92 0.00 0.09 -1.93 0.00 0.00 178.83 178.00 1xkz n ASN 436 N -4.32 4.99 -3.97 -0.69 3.02 -0.55 -4.97 115.26 108.78 1xkz n ASN 436 Ca 0.06 -2.62 -0.38 0.00 -0.03 0.00 0.00 54.58 51.61 1xkz n ASN 436 Cb 0.20 -0.60 0.01 0.00 -0.61 0.00 0.00 39.78 38.78 1xkz n ASN 436 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1xkz n SER 437 N 0.88 -3.72 -4.52 6.41 2.88 -0.57 -4.84 113.62 110.13 1xkz n SER 437 Ca 0.26 -1.10 -0.42 0.00 -1.33 0.00 0.00 58.87 56.29 1xkz n SER 437 Cb 0.98 -1.39 -0.03 0.00 -0.75 0.00 0.00 64.21 63.02 1xkz n SER 437 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1xkz s VAL 438 N -3.53 3.95 0.28 2.46 1.01 -0.30 -4.88 120.40 119.39 1xkz s VAL 438 Ca 0.35 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.27 1xkz s VAL 438 Cb -0.19 -4.88 0.28 0.00 0.00 0.00 0.00 36.38 31.58 1xkz s VAL 438 CO 0.85 -1.76 1.82 0.78 0.00 0.00 0.00 175.10 176.78 1xkz h ASN 439 N 9.82 0.86 0.35 3.32 2.35 -1.89 -2.59 115.58 127.80 1xkz h ASN 439 Ca -0.18 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 1xkz h ASN 439 Cb 1.05 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 1xkz h ASN 439 CO 1.27 0.43 -0.21 4.11 -1.65 0.00 0.00 177.43 181.38 1xkz h TRP 440 N 0.91 0.00 -0.09 1.19 5.08 -1.98 -1.29 115.95 119.77 1xkz h TRP 440 Ca 0.51 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.47 1xkz h TRP 440 Cb 0.57 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.73 1xkz h TRP 440 CO -0.01 0.21 0.02 -0.92 -1.28 0.00 0.00 178.44 176.45 1xkz h TYR 441 N 0.00 0.16 0.00 0.12 5.03 -1.88 -0.81 116.97 119.59 1xkz h TYR 441 Ca -0.00 -0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.17 1xkz h TYR 441 Cb 0.44 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.66 1xkz h TYR 441 CO 0.00 0.34 -0.54 0.74 -1.32 0.00 0.00 178.16 177.37 1xkz h PHE 442 N -0.07 0.00 -0.25 -3.82 -1.00 -1.50 -2.60 116.94 107.70 1xkz h PHE 442 Ca 0.03 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.68 1xkz h PHE 442 Cb 0.26 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.81 1xkz h PHE 442 CO 0.01 0.54 -0.37 0.93 -1.61 0.00 0.00 178.31 177.81 1xkz h GLU 443 N 0.00 0.57 -0.55 1.51 5.08 -1.16 -0.47 114.58 119.57 1xkz h GLU 443 Ca -0.01 -0.28 -0.10 0.00 -1.00 0.00 0.00 59.36 57.98 1xkz h GLU 443 Cb 1.06 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1xkz h GLU 443 CO 0.07 0.86 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.81 1xkz h ARG 444 N 0.48 0.96 -0.23 2.33 2.43 -0.88 -1.44 114.38 118.03 1xkz h ARG 444 Ca 0.05 -0.31 -0.03 0.00 -0.81 0.00 0.00 59.98 58.88 1xkz h ARG 444 Cb 0.86 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 1xkz h ARG 444 CO 0.07 0.97 0.03 0.82 -1.51 0.00 0.00 179.97 180.35 1xkz h ILE 445 N 0.88 1.24 -0.92 1.20 2.04 -1.17 -3.12 117.51 117.66 1xkz h ILE 445 Ca 0.15 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.23 1xkz h ILE 445 Cb 0.57 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.91 1xkz h ILE 445 CO 0.03 0.25 0.61 -1.28 0.00 0.00 0.00 178.15 177.76 1xkz h SER 446 N 0.18 1.05 0.24 1.72 0.87 -0.80 -1.18 113.55 115.64 1xkz h SER 446 Ca 0.07 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1xkz h SER 446 Cb 0.35 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1xkz h SER 446 CO 0.01 0.76 0.00 0.47 -0.53 0.00 0.00 176.83 177.54 1xkz n ASP 447 N -4.40 0.51 -0.62 6.23 8.00 -0.57 -1.61 116.55 124.10 1xkz n ASP 447 Ca 0.11 0.70 0.10 0.00 0.71 0.00 0.00 54.79 56.40 1xkz n ASP 447 Cb 0.02 -0.78 0.04 0.00 -0.02 0.00 0.00 41.12 40.38 1xkz n ASP 447 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xkz n GLN 448 N -2.14 1.64 -3.58 -1.24 6.02 -0.45 -4.95 117.38 112.68 1xkz n GLN 448 Ca 0.00 -1.29 -0.37 0.00 -0.01 0.00 0.00 57.00 55.33 1xkz n GLN 448 Cb 0.10 -1.40 -0.10 0.00 1.02 0.00 0.00 30.24 29.86 1xkz n GLN 448 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1xkz s ILE 449 N -2.02 5.31 0.33 5.09 -1.09 -0.63 -5.06 121.20 123.12 1xkz s ILE 449 Ca 0.20 0.27 -0.28 0.00 -2.23 0.00 0.00 60.65 58.61 1xkz s ILE 449 Cb 0.17 -3.55 -0.10 0.00 -1.58 0.00 0.00 42.46 37.39 1xkz s ILE 449 CO 0.40 0.29 1.23 -2.84 -1.23 0.00 0.00 174.94 172.78 1xkz s PRO 450 N 1.41 4.38 0.25 2.79 0.02 -1.26 -4.89 135.00 137.70 1xkz s PRO 450 Ca 0.09 2.05 -0.03 0.00 0.02 0.00 0.00 61.00 63.14 1xkz s PRO 450 Cb -0.15 -3.04 0.51 0.00 0.02 0.00 0.00 34.50 31.85 1xkz s PRO 450 CO 0.07 -0.11 1.70 -0.22 -0.33 0.00 0.00 177.00 178.12 1xkz h LYS 451 N 3.38 0.34 -0.16 5.54 3.64 -1.97 -1.41 116.57 125.93 1xkz h LYS 451 Ca -0.48 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 58.85 1xkz h LYS 451 Cb 1.22 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 1xkz h LYS 451 CO 0.65 0.23 -0.01 -0.91 -2.27 0.00 0.00 179.45 177.14 1xkz h ASN 452 N 0.35 0.21 -0.06 4.20 2.35 -2.00 -0.06 115.58 120.57 1xkz h ASN 452 Ca 0.44 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.16 1xkz h ASN 452 Cb 0.75 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.06 1xkz h ASN 452 CO -0.48 0.27 0.00 0.22 -1.65 0.00 0.00 177.43 175.80 1xkz h TYR 453 N 0.23 0.12 -0.70 1.19 3.20 -1.64 -2.04 116.97 117.33 1xkz h TYR 453 Ca 0.06 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1xkz h TYR 453 Cb 0.19 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 1xkz h TYR 453 CO 0.00 0.37 0.46 1.15 -1.64 0.00 0.00 178.16 178.50 1xkz h THR 454 N -0.16 1.18 -0.76 1.81 2.02 -0.99 -0.87 112.91 115.13 1xkz h THR 454 Ca 0.02 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 1xkz h THR 454 Cb 0.32 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 66.84 1xkz h THR 454 CO 0.00 0.17 0.36 0.00 0.37 0.00 0.00 175.52 176.43 1xkz h ALA 455 N 1.26 1.22 -0.52 6.16 0.00 -0.97 -0.09 119.26 126.31 1xkz h ALA 455 Ca 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1xkz h ALA 455 Cb -0.11 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 1xkz h ALA 455 CO -0.06 0.60 0.19 1.15 0.00 0.00 0.00 179.25 181.13 1xkz h THR 456 N 1.07 1.22 -0.31 0.00 2.02 -0.95 -2.02 112.91 113.94 1xkz h THR 456 Ca 0.26 -0.72 -0.14 0.00 0.77 0.00 0.00 66.41 66.58 1xkz h THR 456 Cb 0.11 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1xkz h THR 456 CO -0.03 0.27 -0.38 1.56 0.37 0.00 0.00 175.52 177.30 1xkz h GLN 457 N 0.71 0.73 -0.02 6.66 1.08 -0.39 -1.57 115.11 122.31 1xkz h GLN 457 Ca 0.17 -0.37 -0.09 0.00 -1.45 0.00 0.00 58.65 56.91 1xkz h GLN 457 Cb 0.23 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1xkz h GLN 457 CO -0.01 0.99 -0.43 -0.07 -0.95 0.00 0.00 178.83 178.36 1xkz h LEU 458 N 0.60 0.04 -0.20 1.46 3.38 -0.95 0.41 115.31 120.06 1xkz h LEU 458 Ca 0.05 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 1xkz h LEU 458 Cb 0.92 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1xkz h LEU 458 CO 0.08 0.46 -0.36 0.11 0.09 0.00 0.00 178.44 178.83 1xkz h LYS 459 N 0.03 0.59 -0.04 1.13 1.79 -1.26 0.42 116.57 119.24 1xkz h LYS 459 Ca -0.00 -0.37 -0.12 0.00 -2.18 0.00 0.00 60.65 57.98 1xkz h LYS 459 Cb 0.77 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.45 1xkz h LYS 459 CO 0.06 0.99 -0.53 -0.56 -1.08 0.00 0.00 179.45 178.33 1xkz h GLN 460 N 0.26 0.10 0.00 3.15 -0.00 -0.77 -2.80 115.11 115.06 1xkz h GLN 460 Ca 0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1xkz h GLN 460 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.44 1xkz h GLN 460 CO 0.08 0.60 -0.42 1.28 -0.00 0.00 0.00 178.83 180.37 1xkz n LEU 461 N -3.92 0.51 -3.71 0.06 4.77 0.09 -4.94 117.00 109.86 1xkz n LEU 461 Ca -0.02 0.21 -0.23 0.00 -0.03 0.00 0.00 56.01 55.95 1xkz n LEU 461 Cb 0.55 -0.27 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1xkz n LEU 461 CO 0.42 0.02 0.02 0.59 -1.33 0.00 0.00 177.39 177.10 1xkz n ASN 462 N -1.77 -2.47 -4.56 -1.43 4.13 -0.05 -4.77 115.26 104.34 1xkz n ASN 462 Ca 0.05 -0.77 -0.37 0.00 1.68 0.00 0.00 54.58 55.18 1xkz n ASN 462 Cb 0.38 -4.21 -0.04 0.00 -1.54 0.00 0.00 39.78 34.37 1xkz n ASN 462 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1xkz s TYR 463 N -3.53 2.25 0.00 3.10 5.04 -0.10 -4.93 117.35 119.19 1xkz s TYR 463 Ca 0.20 -0.26 0.00 0.00 -2.44 0.00 0.00 57.07 54.57 1xkz s TYR 463 Cb -0.10 -4.47 0.00 0.00 0.35 0.00 0.00 41.96 37.74 1xkz s TYR 463 CO 0.80 -1.92 0.00 0.41 -1.34 0.00 0.00 175.55 173.50 1xkz n GLY 464 N 6.67 3.10 0.04 8.97 0.00 -1.26 -1.42 105.19 121.29 1xkz n GLY 464 Ca 0.31 -0.10 0.15 0.00 0.00 0.00 0.00 46.02 46.38 1xkz n GLY 464 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xkz n ASN 465 N 2.97 0.17 -1.73 1.61 0.23 -0.32 -4.91 115.26 113.27 1xkz n ASN 465 Ca 0.00 -0.41 -0.11 0.00 -0.53 0.00 0.00 54.58 53.53 1xkz n ASN 465 Cb 0.00 -0.17 -0.03 0.00 -2.08 0.00 0.00 39.78 37.49 1xkz n ASN 465 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1xkz n LYS 466 N -1.13 -1.62 -2.94 -3.83 5.02 -0.51 -4.90 118.16 108.25 1xkz n LYS 466 Ca 0.16 0.63 -0.43 0.00 -2.02 0.00 0.00 58.31 56.65 1xkz n LYS 466 Cb 0.24 -4.98 -0.05 0.00 -0.02 0.00 0.00 35.03 30.22 1xkz n LYS 466 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1xkz s ASN 467 N -1.99 6.30 0.13 4.39 3.04 -1.26 -4.92 114.94 120.63 1xkz s ASN 467 Ca 0.00 -0.54 0.27 0.00 0.04 0.00 0.00 52.86 52.62 1xkz s ASN 467 Cb 0.00 -2.39 0.83 0.00 -1.54 0.00 0.00 41.25 38.15 1xkz s ASN 467 CO 0.00 -1.13 1.73 0.18 -3.04 0.00 0.00 177.10 174.83 1xkz n LEU 468 N 7.08 0.57 0.00 3.21 4.77 -1.26 -2.07 117.00 129.29 1xkz n LEU 468 Ca -0.01 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1xkz n LEU 468 Cb 0.47 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1xkz n LEU 468 CO 0.61 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1xkz n GLY 469 N 1.37 3.34 0.00 -0.72 0.00 -1.26 -0.52 105.19 107.40 1xkz n GLY 469 Ca 0.06 -0.08 0.15 0.00 0.00 0.00 0.00 46.02 46.14 1xkz n GLY 469 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xkz n SER 470 N 3.92 0.00 -2.23 1.61 3.41 -1.26 -4.89 113.62 114.19 1xkz n SER 470 Ca 0.00 -0.35 -0.17 0.00 -0.26 0.00 0.00 58.87 58.08 1xkz n SER 470 Cb 0.00 -0.21 0.01 0.00 -0.26 0.00 0.00 64.21 63.75 1xkz n SER 470 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xkz n TYR 471 N -1.21 -1.25 -3.87 7.33 9.36 0.32 -5.00 117.16 122.84 1xkz n TYR 471 Ca 0.16 0.24 -0.30 0.00 3.32 0.00 0.00 57.90 61.33 1xkz n TYR 471 Cb 0.20 -3.64 -0.16 0.00 -0.63 0.00 0.00 39.34 35.12 1xkz n TYR 471 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1xkz s LYS 472 N -5.20 1.25 -1.63 2.98 1.02 -1.26 -4.79 119.74 112.11 1xkz s LYS 472 Ca 0.14 -0.89 -0.14 0.00 0.02 0.00 0.00 55.97 55.09 1xkz s LYS 472 Cb -0.06 -2.42 0.12 0.00 -0.52 0.00 0.00 37.83 34.94 1xkz s LYS 472 CO 0.17 -0.67 0.73 0.43 -0.92 0.00 0.00 175.35 175.09 1xkz n SER 473 N 4.77 -2.85 0.14 2.83 7.64 -1.26 -4.81 113.62 120.09 1xkz n SER 473 Ca -0.09 -0.99 0.12 0.00 1.01 0.00 0.00 58.87 58.91 1xkz n SER 473 Cb 0.44 -2.92 0.53 0.00 -1.01 0.00 0.00 64.21 61.25 1xkz n SER 473 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xkz n TYR 474 N -4.42 0.80 1.10 1.43 0.18 -1.26 -2.14 117.16 112.84 1xkz n TYR 474 Ca -0.01 0.34 0.12 0.00 1.88 0.00 0.00 57.90 60.24 1xkz n TYR 474 Cb 0.53 -1.05 0.27 0.00 -0.38 0.00 0.00 39.34 38.71 1xkz n TYR 474 CO 0.00 0.00 0.00 -2.67 -2.08 0.00 0.00 176.86 172.11 1xkz n TRP 475 N -2.26 0.00 -3.19 -3.48 2.14 -1.26 -2.51 117.44 106.88 1xkz n TRP 475 Ca 0.01 0.00 -0.45 0.00 2.07 0.00 0.00 57.50 59.13 1xkz n TRP 475 Cb 0.17 -0.18 -0.01 0.00 -0.81 0.00 0.00 31.31 30.48 1xkz n TRP 475 CO 0.00 0.00 0.00 -1.64 2.07 0.00 0.00 177.69 178.12 1xkz s MET 476 N -2.79 4.02 -1.34 -2.67 -1.94 -0.91 -2.11 119.30 111.56 1xkz s MET 476 Ca 0.16 -2.79 -0.02 0.00 -1.71 0.00 0.00 55.69 51.33 1xkz s MET 476 Cb 0.18 -4.71 -0.00 0.00 2.01 0.00 0.00 34.83 32.31 1xkz s MET 476 CO 0.63 -1.44 0.55 -0.85 -0.01 0.00 0.00 175.02 173.90 1xkz n GLU 477 N 4.06 -3.65 0.00 2.03 0.00 -1.26 -4.93 120.64 116.89 1xkz n GLU 477 Ca 0.26 0.49 0.00 0.00 0.00 0.00 0.00 57.16 57.90 1xkz n GLU 477 Cb 0.42 -4.72 0.00 0.00 0.00 0.00 0.00 31.44 27.15 1xkz n GLU 477 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1xkz n ASP 478 N -2.98 0.00 -0.02 -1.84 2.03 -1.26 -5.06 116.55 107.41 1xkz n ASP 478 Ca -0.29 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 54.90 1xkz n ASP 478 Cb 0.68 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.09 1xkz n ASP 478 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1xkz h SER 479 N 0.00 0.76 -3.23 1.67 4.64 -1.81 -3.45 113.55 112.12 1xkz h SER 479 Ca 0.00 -0.42 -0.54 0.00 -0.47 0.00 0.00 61.79 60.37 1xkz h SER 479 Cb 0.00 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 1xkz h SER 479 CO 0.00 1.17 0.53 -0.22 -0.87 0.00 0.00 176.83 177.44 1xkz s LEU 480 N -8.45 4.35 0.01 5.97 2.96 -0.88 -4.65 118.68 118.00 1xkz s LEU 480 Ca -0.09 1.88 -0.02 0.00 -0.22 0.00 0.00 54.13 55.69 1xkz s LEU 480 Cb 0.11 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.21 1xkz s LEU 480 CO 0.86 -0.43 0.03 -0.54 -1.32 0.00 0.00 176.35 174.95 1xkz s LYS 481 N 1.23 0.31 -0.01 1.98 1.02 -1.26 -4.08 119.74 118.93 1xkz s LYS 481 Ca 0.56 -0.44 -0.15 0.00 0.02 0.00 0.00 55.97 55.96 1xkz s LYS 481 Cb -0.26 0.12 0.02 0.00 -0.52 0.00 0.00 37.83 37.19 1xkz s LYS 481 CO 0.28 -0.06 0.31 -1.50 -0.92 0.00 0.00 175.35 173.45 1xkz s ILE 482 N -1.19 0.06 0.59 2.17 2.07 0.15 -1.18 121.20 123.88 1xkz s ILE 482 Ca -0.13 -0.48 -0.04 0.00 -1.41 0.00 0.00 60.65 58.58 1xkz s ILE 482 Cb -0.08 -0.62 0.02 0.00 0.13 0.00 0.00 42.46 41.91 1xkz s ILE 482 CO -0.00 -0.27 0.88 -0.94 -1.91 0.00 0.00 174.94 172.70 1xkz s SER 483 N -1.35 5.41 0.19 4.50 1.04 -1.26 -1.07 113.70 121.16 1xkz s SER 483 Ca -0.13 0.51 -0.08 0.00 0.48 0.00 0.00 55.95 56.72 1xkz s SER 483 Cb -0.05 -1.44 0.10 0.00 0.10 0.00 0.00 66.02 64.73 1xkz s SER 483 CO 0.04 -1.15 1.68 -1.13 0.98 0.00 0.00 173.24 173.66 1xkz h ASN 484 N -0.17 1.06 -0.65 7.02 -1.24 -1.62 -0.41 115.58 119.58 1xkz h ASN 484 Ca -0.45 -0.27 -0.02 0.00 0.71 0.00 0.00 56.30 56.27 1xkz h ASN 484 Cb 1.27 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 40.01 1xkz h ASN 484 CO 0.59 1.07 0.32 0.25 -1.29 0.00 0.00 177.43 178.37 1xkz h LEU 485 N 1.03 0.85 -1.23 0.34 5.85 -1.36 -2.39 115.31 118.39 1xkz h LEU 485 Ca 0.20 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1xkz h LEU 485 Cb 0.47 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1xkz h LEU 485 CO 0.02 0.73 -0.31 -0.33 -0.34 0.00 0.00 178.44 178.21 1xkz h GLU 486 N 0.90 0.12 -0.55 1.25 5.08 -1.69 -0.79 114.58 118.91 1xkz h GLU 486 Ca 0.23 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1xkz h GLU 486 Cb 0.10 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1xkz h GLU 486 CO -0.03 0.42 0.25 1.96 -1.00 0.00 0.00 179.01 180.62 1xkz h GLN 487 N 0.11 0.77 -0.01 2.33 1.08 -0.56 0.21 115.11 119.05 1xkz h GLN 487 Ca 0.01 -0.10 -0.06 0.00 -1.45 0.00 0.00 58.65 57.05 1xkz h GLN 487 Cb 0.61 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1xkz h GLN 487 CO 0.04 0.61 -0.25 0.28 -0.95 0.00 0.00 178.83 178.56 1xkz h VAL 488 N 0.77 1.53 -0.27 -0.54 2.07 -1.22 -2.63 116.25 115.96 1xkz h VAL 488 Ca 0.19 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.80 1xkz h VAL 488 Cb 0.10 2.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 1xkz h VAL 488 CO -0.02 0.53 0.18 0.40 0.02 0.00 0.00 177.57 178.67 1xkz h ILE 489 N -0.48 1.07 -0.51 4.57 2.04 -0.68 -1.24 117.51 122.29 1xkz h ILE 489 Ca -0.03 -0.13 -0.13 0.00 1.00 0.00 0.00 64.86 65.57 1xkz h ILE 489 Cb 0.99 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1xkz h ILE 489 CO 0.05 0.07 -0.19 0.58 0.00 0.00 0.00 178.15 178.66 1xkz h VAL 490 N 0.37 1.27 -0.27 1.67 2.07 -0.69 -0.75 116.25 119.91 1xkz h VAL 490 Ca 0.10 -1.35 -0.13 0.00 0.82 0.00 0.00 66.70 66.14 1xkz h VAL 490 Cb -0.04 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1xkz h VAL 490 CO -0.02 0.47 -0.35 0.15 0.02 0.00 0.00 177.57 177.84 1xkz h PHE 491 N 0.89 0.86 -0.23 1.57 3.57 -1.43 -0.62 116.94 121.55 1xkz h PHE 491 Ca 0.12 -0.28 -0.01 0.00 3.53 0.00 0.00 57.97 61.33 1xkz h PHE 491 Cb 0.77 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1xkz h PHE 491 CO 0.05 1.04 0.12 -0.22 -2.23 0.00 0.00 178.31 177.07 1xkz h LYS 492 N 0.44 0.32 -0.70 1.11 3.11 -1.13 -1.33 116.57 118.39 1xkz h LYS 492 Ca 0.03 -0.04 -0.04 0.00 -2.81 0.00 0.00 60.65 57.79 1xkz h LYS 492 Cb 0.93 -0.06 -0.03 0.00 -1.00 0.00 0.00 32.23 32.07 1xkz h LYS 492 CO 0.08 0.31 0.28 -0.91 -2.81 0.00 0.00 179.45 176.40 1xkz h ASN 493 N 0.25 0.97 -0.55 4.20 2.35 -1.02 0.57 115.58 122.35 1xkz h ASN 493 Ca 0.08 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1xkz h ASN 493 Cb 0.09 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1xkz h ASN 493 CO -0.01 0.88 0.32 -0.03 -1.65 0.00 0.00 177.43 176.94 1xkz h MET 494 N 1.01 0.75 0.11 0.81 4.05 -0.82 -1.14 114.93 119.71 1xkz h MET 494 Ca 0.23 -0.08 -0.27 0.00 -0.28 0.00 0.00 59.70 59.31 1xkz h MET 494 Cb 0.21 -0.15 0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1xkz h MET 494 CO -0.02 0.56 -1.20 0.52 0.23 0.00 0.00 176.91 177.00 1xkz h MET 495 N 0.74 0.34 0.00 0.39 2.86 -1.04 -3.38 114.93 114.83 1xkz h MET 495 Ca 0.20 -0.51 -0.21 0.00 -2.06 0.00 0.00 59.70 57.11 1xkz h MET 495 Cb 0.01 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 1xkz h MET 495 CO -0.03 1.22 -1.92 0.39 1.06 0.00 0.00 176.91 177.63 1xkz n GLU 496 N -3.60 0.66 0.00 1.72 -0.58 0.17 -5.05 120.64 113.96 1xkz n GLU 496 Ca -0.09 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 1xkz n GLU 496 Cb 0.99 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 1xkz n GLU 496 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xkz n GLN 497 N -2.71 0.00 0.00 3.49 6.02 -0.43 -5.06 117.38 118.69 1xkz n GLN 497 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 1xkz n GLN 497 Cb 0.91 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.17 1xkz n GLN 497 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1xkz n ASN 499 N 0.00 0.00 0.04 1.08 4.13 -1.26 -4.92 115.26 114.34 1xkz n ASN 499 Ca 0.00 0.00 0.13 0.00 1.68 0.00 0.00 54.58 56.39 1xkz n ASN 499 Cb 0.00 0.00 0.51 0.00 -1.54 0.00 0.00 39.78 38.75 1xkz n ASN 499 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xkz n HIS 500 N -0.81 0.37 -2.62 3.10 -0.00 -1.26 -4.77 115.22 109.23 1xkz n HIS 500 Ca 0.00 0.11 -0.41 0.00 -0.00 0.00 0.00 57.72 57.42 1xkz n HIS 500 Cb 0.00 -0.68 -0.04 0.00 -0.00 0.00 0.00 29.99 29.26 1xkz n HIS 500 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1xkz s PHE 501 N -3.06 3.72 0.75 -1.40 0.40 -1.26 -5.03 117.98 112.11 1xkz s PHE 501 Ca 0.11 1.72 -0.11 0.00 -0.60 0.00 0.00 56.93 58.05 1xkz s PHE 501 Cb 0.15 -3.16 0.04 0.00 0.51 0.00 0.00 43.02 40.57 1xkz s PHE 501 CO 0.51 -0.17 1.08 -1.54 0.70 0.00 0.00 175.22 175.80 1xkz s SER 502 N -0.22 4.84 0.23 1.36 1.04 -1.26 -4.90 113.70 114.79 1xkz s SER 502 Ca 0.47 1.58 -0.05 0.00 0.48 0.00 0.00 55.95 58.43 1xkz s SER 502 Cb -0.27 -2.37 0.22 0.00 0.10 0.00 0.00 66.02 63.70 1xkz s SER 502 CO 0.33 -1.78 1.71 0.07 0.98 0.00 0.00 173.24 174.55 1xkz h LYS 503 N -0.96 0.93 -0.49 4.02 -0.00 -1.96 -2.07 116.57 116.04 1xkz h LYS 503 Ca -0.45 -0.26 -0.04 0.00 -0.00 0.00 0.00 60.65 59.90 1xkz h LYS 503 Cb 1.23 -0.10 -0.02 0.00 -0.00 0.00 0.00 32.23 33.34 1xkz h LYS 503 CO 0.56 0.91 0.16 1.57 -0.00 0.00 0.00 179.45 182.65 1xkz h LYS 504 N 0.87 0.73 -0.10 0.07 5.09 -1.99 0.19 116.57 121.43 1xkz h LYS 504 Ca 0.16 -0.12 -0.04 0.00 0.09 0.00 0.00 60.65 60.74 1xkz h LYS 504 Cb 0.48 -0.12 -0.00 0.00 0.10 0.00 0.00 32.23 32.69 1xkz h LYS 504 CO 0.02 0.63 -0.10 0.00 -2.09 0.00 0.00 179.45 177.91 1xkz h ALA 505 N 1.46 0.15 -0.92 0.07 0.00 -1.88 -1.92 119.26 116.22 1xkz h ALA 505 Ca 0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xkz h ALA 505 Cb 0.21 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1xkz h ALA 505 CO -0.01 -0.01 0.57 0.87 0.00 0.00 0.00 179.25 180.67 1xkz h LYS 506 N -0.17 1.24 -0.33 0.00 1.57 -1.01 -0.70 116.57 117.17 1xkz h LYS 506 Ca 0.02 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 1xkz h LYS 506 Cb 0.63 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1xkz h LYS 506 CO 0.03 0.86 -0.21 -0.91 -0.57 0.00 0.00 179.45 178.64 1xkz h ASN 507 N 1.26 0.63 -0.17 0.86 2.35 -0.58 0.16 115.58 120.10 1xkz h ASN 507 Ca 0.33 -0.21 -0.18 0.00 -0.55 0.00 0.00 56.30 55.69 1xkz h ASN 507 Cb -0.08 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.12 1xkz h ASN 507 CO -0.06 0.84 -0.58 -0.61 -1.65 0.00 0.00 177.43 175.37 1xkz h GLN 508 N 0.56 0.77 -0.01 0.81 4.15 -0.98 -0.71 115.11 119.69 1xkz h GLN 508 Ca 0.08 -0.50 -0.00 0.00 0.77 0.00 0.00 58.65 59.00 1xkz h GLN 508 Cb 0.67 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.42 1xkz h GLN 508 CO 0.05 1.13 0.00 1.25 -1.93 0.00 0.00 178.83 179.33 1xkz h LEU 509 N 0.58 0.01 -0.84 -2.39 5.85 -0.92 -1.89 115.31 115.71 1xkz h LEU 509 Ca 0.00 -0.12 0.09 0.00 0.84 0.00 0.00 57.88 58.69 1xkz h LEU 509 Cb 1.17 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 1xkz h LEU 509 CO 0.12 0.13 0.49 0.28 -0.34 0.00 0.00 178.44 179.13 1xkz h SER 510 N -0.11 0.73 -0.76 1.25 0.02 -0.70 -1.14 113.55 112.84 1xkz h SER 510 Ca 0.00 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 1xkz h SER 510 Cb 0.12 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 1xkz h SER 510 CO -0.00 0.43 0.50 -1.28 -1.14 0.00 0.00 176.83 175.34 1xkz h SER 511 N 0.85 0.82 1.10 3.07 0.87 -0.77 -1.49 113.55 118.00 1xkz h SER 511 Ca 0.39 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.90 1xkz h SER 511 Cb 0.31 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1xkz h SER 511 CO -0.23 0.57 -0.19 0.77 -0.53 0.00 0.00 176.83 177.23 1xkz h SER 512 N 0.96 0.00 0.19 6.23 4.64 -0.42 -3.04 113.55 122.11 1xkz h SER 512 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1xkz h SER 512 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1xkz h SER 512 CO -0.08 0.19 -0.48 0.18 -0.87 0.00 0.00 176.83 175.76 1xkz n LEU 513 N -3.29 1.16 -4.71 5.97 4.77 -0.64 -4.53 117.00 115.74 1xkz n LEU 513 Ca 0.01 -0.37 -0.42 0.00 -0.03 0.00 0.00 56.01 55.20 1xkz n LEU 513 Cb 0.44 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 1xkz n LEU 513 CO 0.33 0.23 1.32 -0.22 -1.33 0.00 0.00 177.39 177.72 1xkz s LEU 514 N -2.68 4.37 -0.09 2.23 2.96 -0.75 -1.24 118.68 123.48 1xkz s LEU 514 Ca 0.17 2.64 -0.01 0.00 -0.22 0.00 0.00 54.13 56.72 1xkz s LEU 514 Cb 0.18 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.23 1xkz s LEU 514 CO 0.63 -0.90 -0.09 -0.38 -1.32 0.00 0.00 176.35 174.29 1xkz n ILE 515 N 4.32 0.53 -3.87 6.68 2.08 0.09 -4.93 119.36 124.27 1xkz n ILE 515 Ca 0.15 -0.19 -0.11 0.00 0.56 0.00 0.00 62.75 63.16 1xkz n ILE 515 Cb 0.38 -1.02 -0.12 0.00 -0.75 0.00 0.00 39.64 38.14 1xkz n ILE 515 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1xkz s LYS 516 N -2.18 0.28 -0.09 0.38 2.20 -1.01 -5.00 119.74 114.32 1xkz s LYS 516 Ca -0.13 -0.14 -0.04 0.00 -0.36 0.00 0.00 55.97 55.31 1xkz s LYS 516 Cb 0.04 0.12 0.05 0.00 -1.51 0.00 0.00 37.83 36.52 1xkz s LYS 516 CO 0.20 -0.06 0.18 0.21 -0.36 0.00 0.00 175.35 175.53 1xkz s LYS 517 N -0.65 0.11 0.00 4.03 2.20 -1.26 -0.42 119.74 123.75 1xkz s LYS 517 Ca -0.07 0.50 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 1xkz s LYS 517 Cb -0.04 -0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.10 1xkz s LYS 517 CO 0.00 -0.21 0.00 0.27 -0.36 0.00 0.00 175.35 175.05 1xkz n ASN 518 N 4.61 0.41 0.29 1.43 2.04 -0.35 -5.02 115.26 118.66 1xkz n ASN 518 Ca -0.19 -0.82 0.17 0.00 -0.44 0.00 0.00 54.58 53.31 1xkz n ASN 518 Cb 0.51 0.00 0.81 0.00 -2.53 0.00 0.00 39.78 38.57 1xkz n ASN 518 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 1xkz h GLU 519 N 0.00 0.00 0.04 -3.83 4.11 -2.03 -3.26 114.58 109.61 1xkz h GLU 519 Ca 0.00 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.07 1xkz h GLU 519 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1xkz h GLU 519 CO 0.00 0.04 -2.18 0.36 0.07 0.00 0.00 179.01 177.30 1xkz n LYS 520 N -3.21 0.69 -3.90 1.06 2.85 -1.26 -4.95 118.16 109.43 1xkz n LYS 520 Ca -0.01 0.17 -0.09 0.00 -1.05 0.00 0.00 58.31 57.34 1xkz n LYS 520 Cb 0.25 -1.62 -0.02 0.00 -0.65 0.00 0.00 35.03 32.99 1xkz n LYS 520 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1xkz s TYR 521 N -2.54 0.18 -0.12 5.58 1.13 -1.23 -3.51 117.35 116.84 1xkz s TYR 521 Ca -0.20 -0.66 0.00 0.00 -1.41 0.00 0.00 57.07 54.81 1xkz s TYR 521 Cb 0.07 0.54 0.02 0.00 -1.10 0.00 0.00 41.96 41.49 1xkz s TYR 521 CO 0.74 -1.27 -0.12 -1.21 -2.51 0.00 0.00 175.55 171.18 1xkz s GLU 522 N -3.35 1.96 -0.15 -3.49 2.02 -0.31 -1.21 118.70 114.17 1xkz s GLU 522 Ca 0.17 -0.44 -0.03 0.00 0.02 0.00 0.00 54.97 54.69 1xkz s GLU 522 Cb -0.04 -1.83 -0.03 0.00 0.10 0.00 0.00 34.13 32.34 1xkz s GLU 522 CO 0.10 -0.20 -0.04 -1.17 0.02 0.00 0.00 175.26 173.98 1xkz s LEU 523 N 1.42 3.26 0.06 1.80 2.96 0.44 -0.88 118.68 127.74 1xkz s LEU 523 Ca 0.01 -0.11 0.07 0.00 -0.22 0.00 0.00 54.13 53.89 1xkz s LEU 523 Cb -0.13 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1xkz s LEU 523 CO -0.07 0.19 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.64 1xkz s TYR 524 N 0.25 1.74 0.00 5.38 1.51 0.20 -0.73 117.35 125.70 1xkz s TYR 524 Ca -0.03 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 1xkz s TYR 524 Cb -0.14 -1.01 0.00 0.00 -0.11 0.00 0.00 41.96 40.70 1xkz s TYR 524 CO 0.03 0.12 0.00 0.41 -1.11 0.00 0.00 175.55 175.00 1xkz n GLY 525 N 1.62 0.10 2.83 0.71 0.00 -0.37 -1.23 105.19 108.86 1xkz n GLY 525 Ca -0.18 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 1xkz n GLY 525 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xkz s LYS 526 N -2.00 -0.02 0.40 1.61 2.47 0.51 -4.79 119.74 117.93 1xkz s LYS 526 Ca 0.00 0.08 -0.00 0.00 -1.56 0.00 0.00 55.97 54.49 1xkz s LYS 526 Cb 0.00 -0.11 -0.02 0.00 -1.46 0.00 0.00 37.83 36.24 1xkz s LYS 526 CO 0.00 -0.07 0.63 0.95 0.16 0.00 0.00 175.35 177.01 1xkz s THR 527 N 0.46 4.67 -0.10 3.43 -4.23 -1.26 -1.72 115.64 116.89 1xkz s THR 527 Ca -0.04 -0.38 -0.08 0.00 -1.18 0.00 0.00 61.69 60.01 1xkz s THR 527 Cb -0.06 -3.72 0.03 0.00 1.34 0.00 0.00 72.50 70.10 1xkz s THR 527 CO -0.01 -0.52 0.25 -0.83 -0.54 0.00 0.00 174.62 172.97 1xkz s GLY 528 N -4.11 -0.17 -0.04 3.99 0.00 -0.47 -4.08 107.32 102.44 1xkz s GLY 528 Ca 0.44 0.81 -0.01 0.00 0.00 0.00 0.00 44.72 45.96 1xkz s GLY 528 CO 0.38 0.84 0.07 -1.59 0.00 0.00 0.00 173.10 172.79 1xkz s THR 529 N 0.52 -0.09 0.02 0.90 2.01 -1.26 -0.55 115.64 117.18 1xkz s THR 529 Ca -0.03 0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.31 1xkz s THR 529 Cb -0.05 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.29 1xkz s THR 529 CO -0.03 0.12 -0.09 -0.83 -0.69 0.00 0.00 174.62 173.10 1xkz s GLY 530 N 1.56 1.71 -0.08 4.40 0.00 -0.24 -4.79 107.32 109.88 1xkz s GLY 530 Ca -0.03 -1.07 0.01 0.00 0.00 0.00 0.00 44.72 43.63 1xkz s GLY 530 CO -0.04 -0.94 -0.10 -1.50 0.00 0.00 0.00 173.10 170.52 1xkz s ILE 531 N -0.99 1.02 -0.05 0.90 2.07 -1.26 -1.61 121.20 121.28 1xkz s ILE 531 Ca 0.17 -0.37 -0.00 0.00 -1.41 0.00 0.00 60.65 59.04 1xkz s ILE 531 Cb -0.11 -0.98 0.03 0.00 0.13 0.00 0.00 42.46 41.53 1xkz s ILE 531 CO 0.07 0.34 -0.01 0.54 -1.91 0.00 0.00 174.94 173.98 1xkz s VAL 532 N 1.03 0.35 -1.72 4.00 0.11 -0.51 -4.82 120.40 118.83 1xkz s VAL 532 Ca -0.08 0.06 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 1xkz s VAL 532 Cb -0.15 -0.46 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 1xkz s VAL 532 CO -0.01 0.22 0.11 -0.46 -3.33 0.00 0.00 175.10 171.63 1xkz n ASN 533 N 4.61 -5.90 0.00 3.54 6.94 -1.26 -2.57 115.26 120.62 1xkz n ASN 533 Ca -0.16 -0.07 0.00 0.00 -0.02 0.00 0.00 54.58 54.33 1xkz n ASN 533 Cb 0.50 -4.88 0.00 0.00 -2.36 0.00 0.00 39.78 33.05 1xkz n ASN 533 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xkz n GLY 534 N -1.11 1.41 3.34 4.83 0.00 -1.26 -5.05 105.19 107.35 1xkz n GLY 534 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1xkz n GLY 534 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xkz s LYS 535 N -0.39 1.89 0.45 1.61 0.00 -1.06 -5.11 119.74 117.12 1xkz s LYS 535 Ca 0.00 -1.06 -0.25 0.00 0.00 0.00 0.00 55.97 54.66 1xkz s LYS 535 Cb 0.00 -2.00 -0.08 0.00 0.00 0.00 0.00 37.83 35.74 1xkz s LYS 535 CO 0.00 0.53 1.40 0.71 0.00 0.00 0.00 175.35 177.99 1xkz s TYR 536 N -0.77 2.50 0.00 1.78 4.12 -1.26 -1.43 117.35 122.29 1xkz s TYR 536 Ca 0.11 1.29 0.00 0.00 0.02 0.00 0.00 57.07 58.50 1xkz s TYR 536 Cb -0.10 -3.88 0.00 0.00 -1.52 0.00 0.00 41.96 36.46 1xkz s TYR 536 CO 0.01 -2.81 0.00 0.27 0.02 0.00 0.00 175.55 173.04 1xkz n ASN 537 N -0.21 0.00 -3.15 2.29 6.94 -0.63 -4.55 115.26 115.95 1xkz n ASN 537 Ca 0.05 -0.95 0.04 0.00 -0.02 0.00 0.00 54.58 53.70 1xkz n ASN 537 Cb 0.42 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.84 1xkz n ASN 537 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1xkz s ASN 538 N 0.00 -1.41 0.05 0.53 3.04 -1.22 -4.70 114.94 111.22 1xkz s ASN 538 Ca 0.00 0.26 0.08 0.00 0.04 0.00 0.00 52.86 53.24 1xkz s ASN 538 Cb 0.00 1.93 -0.03 0.00 -1.54 0.00 0.00 41.25 41.61 1xkz s ASN 538 CO 0.00 -0.26 -0.23 -0.83 -3.04 0.00 0.00 177.10 172.74 1xkz s GLY 539 N 2.85 1.48 0.02 1.21 0.00 -0.29 -1.08 107.32 111.51 1xkz s GLY 539 Ca 0.13 -1.25 -0.01 0.00 0.00 0.00 0.00 44.72 43.60 1xkz s GLY 539 CO -0.25 -1.14 -0.01 -0.98 0.00 0.00 0.00 173.10 170.73 1xkz s TRP 540 N -0.86 0.23 -0.12 1.90 0.52 0.29 -0.17 118.94 120.73 1xkz s TRP 540 Ca 0.13 -0.48 -0.04 0.00 0.02 0.00 0.00 56.10 55.73 1xkz s TRP 540 Cb -0.10 -0.17 0.06 0.00 -1.15 0.00 0.00 33.47 32.10 1xkz s TRP 540 CO 0.03 -0.20 0.15 0.12 0.02 0.00 0.00 176.95 177.08 1xkz s PHE 541 N -1.44 -0.12 -0.09 -1.98 5.36 -0.41 -1.36 117.98 117.94 1xkz s PHE 541 Ca -0.16 0.33 0.04 0.00 -0.96 0.00 0.00 56.93 56.19 1xkz s PHE 541 Cb -0.10 -0.38 -0.00 0.00 -0.34 0.00 0.00 43.02 42.20 1xkz s PHE 541 CO -0.01 -0.38 -0.24 0.08 -1.46 0.00 0.00 175.22 173.21 1xkz s VAL 542 N 2.26 2.04 0.00 3.12 1.01 -0.70 -0.76 120.40 127.38 1xkz s VAL 542 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1xkz s VAL 542 Cb -0.14 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.48 1xkz s VAL 542 CO -0.08 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1xkz n GLY 543 N 3.45 1.77 3.28 4.51 0.00 -0.03 -0.36 105.19 117.81 1xkz n GLY 543 Ca -0.19 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.05 1xkz n GLY 543 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xkz s TYR 544 N -2.44 -0.14 -0.02 1.61 -0.85 -0.36 -1.02 117.35 114.13 1xkz s TYR 544 Ca 0.00 -0.04 0.04 0.00 -0.52 0.00 0.00 57.07 56.55 1xkz s TYR 544 Cb 0.00 0.15 -0.01 0.00 0.38 0.00 0.00 41.96 42.48 1xkz s TYR 544 CO 0.00 -0.57 -0.13 0.08 -1.52 0.00 0.00 175.55 173.41 1xkz s VAL 545 N -2.95 1.04 -0.21 -3.49 1.01 0.98 -0.62 120.40 116.15 1xkz s VAL 545 Ca -0.02 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1xkz s VAL 545 Cb 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 1xkz s VAL 545 CO -0.06 0.30 -0.05 -0.63 0.00 0.00 0.00 175.10 174.66 1xkz s ILE 546 N -0.14 3.38 0.51 2.22 1.01 -0.06 -0.76 121.20 127.36 1xkz s ILE 546 Ca 0.02 -0.49 0.04 0.00 0.00 0.00 0.00 60.65 60.21 1xkz s ILE 546 Cb -0.07 -2.53 0.04 0.00 0.01 0.00 0.00 42.46 39.91 1xkz s ILE 546 CO 0.00 0.43 0.32 0.35 0.00 0.00 0.00 174.94 176.04 1xkz n THR 547 N 4.66 0.00 0.67 2.92 -2.24 -0.43 -1.16 114.28 118.71 1xkz n THR 547 Ca -0.18 -2.07 0.10 0.00 -2.27 0.00 0.00 64.05 59.63 1xkz n THR 547 Cb 0.51 0.03 0.44 0.00 -2.10 0.00 0.00 70.33 69.21 1xkz n THR 547 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xkz n ASN 548 N -1.75 0.13 -0.01 3.42 3.02 -1.23 -3.83 115.26 115.01 1xkz n ASN 548 Ca -0.05 0.52 0.01 0.00 -0.03 0.00 0.00 54.58 55.03 1xkz n ASN 548 Cb 0.59 -0.55 -0.04 0.00 -0.61 0.00 0.00 39.78 39.17 1xkz n ASN 548 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1xkz n HIS 549 N -1.64 0.00 -3.78 3.10 8.25 -1.26 -5.11 115.22 114.78 1xkz n HIS 549 Ca 0.05 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.44 1xkz n HIS 549 Cb 0.25 -0.16 0.03 0.00 1.12 0.00 0.00 29.99 31.23 1xkz n HIS 549 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1xkz n ASP 550 N -1.88 -2.03 -3.95 0.41 4.64 -1.25 -4.97 116.55 107.52 1xkz n ASP 550 Ca -0.04 -2.32 -0.21 0.00 -1.38 0.00 0.00 54.79 50.84 1xkz n ASP 550 Cb 0.34 3.36 -0.16 0.00 -1.04 0.00 0.00 41.12 43.62 1xkz n ASP 550 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 1xkz s LYS 551 N -2.07 1.00 -0.06 -0.67 2.20 -1.26 -1.32 119.74 117.56 1xkz s LYS 551 Ca 0.17 -0.22 0.04 0.00 -0.36 0.00 0.00 55.97 55.60 1xkz s LYS 551 Cb -0.04 -0.93 -0.00 0.00 -1.51 0.00 0.00 37.83 35.35 1xkz s LYS 551 CO 0.10 0.00 -0.19 0.71 -0.36 0.00 0.00 175.35 175.60 1xkz s TYR 552 N 0.62 2.00 -0.01 4.03 1.51 0.06 -1.73 117.35 123.83 1xkz s TYR 552 Ca -0.09 -0.68 -0.02 0.00 -1.01 0.00 0.00 57.07 55.26 1xkz s TYR 552 Cb -0.13 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1xkz s TYR 552 CO 0.01 -0.26 0.14 0.71 -1.11 0.00 0.00 175.55 175.03 1xkz s TYR 553 N 0.21 3.44 0.18 2.71 2.02 -0.35 -0.01 117.35 125.56 1xkz s TYR 553 Ca -0.10 0.30 -0.18 0.00 -0.37 0.00 0.00 57.07 56.72 1xkz s TYR 553 Cb -0.14 -1.80 0.03 0.00 -0.40 0.00 0.00 41.96 39.65 1xkz s TYR 553 CO 0.05 0.61 0.52 -0.59 -1.57 0.00 0.00 175.55 174.57 1xkz s PHE 554 N -1.26 -0.20 -0.26 2.71 -0.12 -0.19 -0.04 117.98 118.63 1xkz s PHE 554 Ca 0.25 -0.13 -0.23 0.00 -0.05 0.00 0.00 56.93 56.77 1xkz s PHE 554 Cb -0.12 0.41 0.07 0.00 -0.63 0.00 0.00 43.02 42.74 1xkz s PHE 554 CO 0.16 -0.88 0.68 0.00 -0.05 0.00 0.00 175.22 175.12 1xkz s ALA 555 N -3.85 -1.69 -0.06 1.99 0.00 0.00 -0.85 121.76 117.31 1xkz s ALA 555 Ca 0.07 1.94 0.05 0.00 0.00 0.00 0.00 51.96 54.02 1xkz s ALA 555 Cb -0.01 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 1xkz s ALA 555 CO -0.05 -0.32 -0.21 0.99 0.00 0.00 0.00 175.76 176.16 1xkz s THR 556 N 0.42 2.41 -0.07 0.00 2.01 0.06 -1.03 115.64 119.44 1xkz s THR 556 Ca -0.00 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.09 1xkz s THR 556 Cb -0.05 -1.90 0.00 0.00 0.01 0.00 0.00 72.50 70.56 1xkz s THR 556 CO 0.00 0.57 -0.20 -2.28 -0.69 0.00 0.00 174.62 172.02 1xkz s HIS 557 N -0.31 2.13 -0.08 4.92 2.46 -0.65 -1.29 115.29 122.48 1xkz s HIS 557 Ca 0.01 -0.76 0.02 0.00 0.47 0.00 0.00 55.06 54.79 1xkz s HIS 557 Cb -0.13 -1.44 -0.02 0.00 -0.13 0.00 0.00 32.58 30.86 1xkz s HIS 557 CO 0.02 -0.30 -0.12 -0.51 -2.47 0.00 0.00 174.74 171.37 1xkz s LEU 558 N 0.25 2.84 -0.00 8.88 1.43 0.76 -1.46 118.68 131.37 1xkz s LEU 558 Ca -0.12 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 1xkz s LEU 558 Cb -0.15 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 1xkz s LEU 558 CO 0.05 0.29 0.04 -1.54 0.23 0.00 0.00 176.35 175.43 1xkz n SER 559 N 2.70 4.54 -3.93 2.29 3.41 0.03 -1.14 113.62 121.52 1xkz n SER 559 Ca -0.18 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.34 1xkz n SER 559 Cb 0.52 1.08 -0.06 0.00 -0.26 0.00 0.00 64.21 65.49 1xkz n SER 559 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1xkz s ASP 560 N -2.25 -0.01 0.03 4.04 1.11 -1.19 -4.74 116.67 113.65 1xkz s ASP 560 Ca -0.01 -0.82 0.00 0.00 0.18 0.00 0.00 52.55 51.90 1xkz s ASP 560 Cb 0.01 0.47 0.00 0.00 1.07 0.00 0.00 42.92 44.47 1xkz s ASP 560 CO 0.08 -0.94 0.00 0.61 1.18 0.00 0.00 175.17 176.11 1xkz n GLY 561 N -0.25 0.94 2.69 0.21 0.00 -1.26 -1.61 105.19 105.91 1xkz n GLY 561 Ca -0.07 -0.98 -0.27 0.00 0.00 0.00 0.00 46.02 44.69 1xkz n GLY 561 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1xkz n LYS 562 N 0.11 1.77 -1.61 1.61 -0.00 -1.26 -4.99 118.16 113.78 1xkz n LYS 562 Ca 0.00 -4.33 -0.41 0.00 -0.00 0.00 0.00 58.31 53.57 1xkz n LYS 562 Cb 0.00 -2.16 -0.01 0.00 -0.00 0.00 0.00 35.03 32.86 1xkz n LYS 562 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1xkz n PRO 563 N 1.75 3.01 -3.24 -1.58 -0.04 -1.26 -4.75 135.00 128.90 1xkz n PRO 563 Ca 0.24 -2.47 -0.18 0.00 -0.04 0.00 0.00 63.50 61.04 1xkz n PRO 563 Cb 0.39 -3.16 0.00 0.00 -0.04 0.00 0.00 33.50 30.70 1xkz n PRO 563 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1xkz s SER 564 N 3.00 5.82 0.33 3.54 1.04 -1.26 -2.11 113.70 124.06 1xkz s SER 564 Ca 0.53 -0.28 0.09 0.00 0.48 0.00 0.00 55.95 56.77 1xkz s SER 564 Cb 0.15 -0.98 0.56 0.00 0.10 0.00 0.00 66.02 65.85 1xkz s SER 564 CO -0.08 -0.59 1.75 1.23 0.98 0.00 0.00 173.24 176.53 1xkz h GLY 565 N 0.76 0.13 0.98 7.32 0.00 -1.74 -1.07 103.07 109.45 1xkz h GLY 565 Ca -0.43 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 1xkz h GLY 565 CO 0.49 0.11 0.27 0.07 0.00 0.00 0.00 176.54 177.48 1xkz h LYS 566 N 0.10 0.81 -0.00 4.80 5.09 -1.86 0.17 116.57 125.68 1xkz h LYS 566 Ca 0.01 -0.12 -0.20 0.00 0.09 0.00 0.00 60.65 60.43 1xkz h LYS 566 Cb 0.77 -0.14 -0.01 0.00 0.10 0.00 0.00 32.23 32.95 1xkz h LYS 566 CO 0.06 0.66 -0.88 -0.91 -2.09 0.00 0.00 179.45 176.29 1xkz h ASN 567 N 0.76 0.33 -0.05 7.07 2.35 -1.79 -2.17 115.58 122.08 1xkz h ASN 567 Ca 0.19 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1xkz h ASN 567 Cb 0.12 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1xkz h ASN 567 CO -0.02 1.05 -0.14 0.00 -1.65 0.00 0.00 177.43 176.67 1xkz h ALA 568 N 0.92 1.34 -0.28 -0.83 0.00 -0.68 -1.32 119.26 118.41 1xkz h ALA 568 Ca -0.05 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1xkz h ALA 568 Cb 1.50 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1xkz h ALA 568 CO 0.14 0.44 -0.24 1.49 0.00 0.00 0.00 179.25 181.08 1xkz h GLU 569 N 0.35 0.66 -0.49 0.00 4.81 -0.78 -1.05 114.58 118.09 1xkz h GLU 569 Ca 0.07 -0.34 -0.03 0.00 -0.13 0.00 0.00 59.36 58.93 1xkz h GLU 569 Cb 0.46 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1xkz h GLU 569 CO 0.03 0.94 0.17 -0.07 -0.73 0.00 0.00 179.01 179.35 1xkz h LEU 570 N 0.40 0.70 -0.53 1.64 3.38 -1.15 -0.92 115.31 118.83 1xkz h LEU 570 Ca 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1xkz h LEU 570 Cb 0.80 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1xkz h LEU 570 CO 0.06 0.71 0.25 0.40 0.09 0.00 0.00 178.44 179.95 1xkz h ILE 571 N 0.66 1.20 -0.16 1.22 2.04 -1.23 -0.40 117.51 120.84 1xkz h ILE 571 Ca 0.16 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1xkz h ILE 571 Cb 0.24 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1xkz h ILE 571 CO -0.01 0.23 0.09 0.28 0.00 0.00 0.00 178.15 178.74 1xkz h SER 572 N 0.72 0.15 -0.50 1.72 0.02 -0.94 -0.39 113.55 114.33 1xkz h SER 572 Ca 0.18 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1xkz h SER 572 Cb 0.13 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1xkz h SER 572 CO -0.02 0.11 0.23 -0.33 -1.14 0.00 0.00 176.83 175.68 1xkz h GLU 573 N 0.19 0.77 -0.30 3.45 5.08 -0.83 -0.20 114.58 122.75 1xkz h GLU 573 Ca 0.06 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1xkz h GLU 573 Cb -0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1xkz h GLU 573 CO -0.03 0.62 -0.10 0.87 -1.00 0.00 0.00 179.01 179.37 1xkz h LYS 574 N 0.77 0.59 -0.33 2.33 1.57 -0.71 -1.62 116.57 119.17 1xkz h LYS 574 Ca 0.19 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1xkz h LYS 574 Cb 0.13 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1xkz h LYS 574 CO -0.02 0.80 0.07 0.82 -0.57 0.00 0.00 179.45 180.55 1xkz h ILE 575 N 0.35 1.23 -0.51 1.86 2.04 -0.82 -1.29 117.51 120.38 1xkz h ILE 575 Ca 0.07 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 1xkz h ILE 575 Cb 0.60 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1xkz h ILE 575 CO 0.03 0.26 0.18 -0.07 0.00 0.00 0.00 178.15 178.56 1xkz h LEU 576 N 0.38 0.68 -0.14 1.44 3.38 -0.98 0.10 115.31 120.17 1xkz h LEU 576 Ca 0.10 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1xkz h LEU 576 Cb 0.32 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1xkz h LEU 576 CO 0.00 0.63 -0.06 0.11 0.09 0.00 0.00 178.44 179.21 1xkz h LYS 577 N 0.73 0.29 -0.38 1.13 1.57 -1.23 0.13 116.57 118.81 1xkz h LYS 577 Ca 0.17 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1xkz h LYS 577 Cb 0.18 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1xkz h LYS 577 CO -0.01 0.61 0.09 1.49 -0.57 0.00 0.00 179.45 181.05 1xkz h GLU 578 N -0.04 0.56 -0.00 3.15 4.81 -0.76 -2.15 114.58 120.15 1xkz h GLU 578 Ca 0.03 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1xkz h GLU 578 Cb 0.51 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1xkz h GLU 578 CO 0.02 0.52 -0.01 -1.33 -0.73 0.00 0.00 179.01 177.48 1xkz n MET 579 N -4.33 0.76 -0.79 1.92 2.81 -0.02 -4.90 117.12 112.58 1xkz n MET 579 Ca 0.02 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1xkz n MET 579 Cb 0.19 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1xkz n MET 579 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xkz n GLY 580 N 1.15 0.57 0.14 3.03 0.00 -0.81 -4.97 105.19 104.30 1xkz n GLY 580 Ca 0.19 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 1xkz n GLY 580 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xkz h VAL 581 N 0.00 1.32 -0.03 1.61 2.07 -1.18 -3.49 116.25 116.55 1xkz h VAL 581 Ca 0.00 -2.79 0.00 0.00 0.82 0.00 0.00 66.70 64.73 1xkz h VAL 581 Cb 0.00 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1xkz h VAL 581 CO 0.00 0.84 0.00 0.18 0.02 0.00 0.00 177.57 178.61