#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nkq n TYR 303 N 0.00 0.01 0.25 0.66 4.02 -1.26 -1.87 117.16 118.98 1nkq n TYR 303 Ca 0.00 -0.45 0.16 0.00 -0.01 0.00 0.00 57.90 57.61 1nkq n TYR 303 Cb 0.00 -0.04 0.88 0.00 -0.02 0.00 0.00 39.34 40.16 1nkq n TYR 303 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1nkq h ASN 304 N 0.07 0.00 -0.15 7.72 2.35 -1.85 -2.08 115.58 121.64 1nkq h ASN 304 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1nkq h ASN 304 Cb 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1nkq h ASN 304 CO 0.00 0.00 0.08 0.10 -1.65 0.00 0.00 177.43 175.96 1nkq h TYR 305 N 0.00 0.22 -0.32 1.19 -0.00 -1.88 -1.78 116.97 114.40 1nkq h TYR 305 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 58.73 58.87 1nkq h TYR 305 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 36.73 36.90 1nkq h TYR 305 CO 0.00 0.16 0.25 -0.07 -0.00 0.00 0.00 178.16 178.50 1nkq h LEU 306 N 0.23 0.00 -0.87 0.10 -0.00 -1.66 -0.30 115.31 112.81 1nkq h LEU 306 Ca 0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.85 1nkq h LEU 306 Cb 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.67 1nkq h LEU 306 CO -0.01 0.00 -0.43 0.11 -0.00 0.00 0.00 178.44 178.11 1nkq h LYS 307 N 0.00 0.00 -0.14 1.13 1.57 -1.51 -3.17 116.57 114.45 1nkq h LYS 307 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1nkq h LYS 307 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1nkq h LYS 307 CO -0.00 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 1nkq n ALA 308 N -2.32 2.50 -2.58 3.86 0.00 -0.13 -4.87 120.51 116.97 1nkq n ALA 308 Ca -0.00 -0.62 -0.43 0.00 0.00 0.00 0.00 53.44 52.39 1nkq n ALA 308 Cb 0.54 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 1nkq n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nkq s ALA 309 N -1.83 3.37 -0.49 0.00 0.00 -1.15 -4.47 121.76 117.20 1nkq s ALA 309 Ca 0.34 -0.72 0.24 0.00 0.00 0.00 0.00 51.96 51.82 1nkq s ALA 309 Cb 0.20 -3.45 0.41 0.00 0.00 0.00 0.00 23.12 20.28 1nkq s ALA 309 CO 0.30 -1.68 1.62 0.00 0.00 0.00 0.00 175.76 176.00 1nkq h ARG 310 N 8.68 0.00 -2.86 0.00 -0.00 -1.86 -3.47 114.38 114.87 1nkq h ARG 310 Ca -0.24 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.20 1nkq h ARG 310 Cb 1.09 0.00 -0.14 0.00 0.00 0.00 0.00 29.97 30.92 1nkq h ARG 310 CO 0.95 0.00 0.16 -1.59 0.00 0.00 0.00 179.97 179.49 1nkq s LYS 311 N -3.20 1.19 -0.23 0.04 -2.85 -1.26 -4.99 119.74 108.45 1nkq s LYS 311 Ca 0.07 -0.35 0.01 0.00 -1.00 0.00 0.00 55.97 54.70 1nkq s LYS 311 Cb 0.06 0.55 0.06 0.00 -2.06 0.00 0.00 37.83 36.44 1nkq s LYS 311 CO 0.66 -0.49 -0.06 0.42 0.10 0.00 0.00 175.35 175.98 1nkq s ILE 312 N -3.20 1.60 -0.05 3.79 1.01 -1.25 -1.39 121.20 121.71 1nkq s ILE 312 Ca -0.01 -1.24 0.05 0.00 0.00 0.00 0.00 60.65 59.45 1nkq s ILE 312 Cb -0.01 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.61 1nkq s ILE 312 CO -0.08 -0.07 -0.21 -0.51 0.00 0.00 0.00 174.94 174.07 1nkq s ILE 313 N 1.37 2.40 0.08 2.92 2.07 -0.63 -1.44 121.20 127.96 1nkq s ILE 313 Ca -0.06 -0.95 0.07 0.00 -1.41 0.00 0.00 60.65 58.30 1nkq s ILE 313 Cb -0.19 -1.89 -0.03 0.00 0.13 0.00 0.00 42.46 40.48 1nkq s ILE 313 CO -0.06 0.57 -0.20 0.00 -1.91 0.00 0.00 174.94 173.35 1nkq s ILE 315 N -1.07 5.34 0.34 0.00 2.07 -0.93 -0.59 121.20 126.36 1nkq s ILE 315 Ca 0.05 -0.34 0.09 0.00 -1.41 0.00 0.00 60.65 59.04 1nkq s ILE 315 Cb -0.10 -3.57 -0.05 0.00 0.13 0.00 0.00 42.46 38.87 1nkq s ILE 315 CO 0.03 0.20 0.02 -0.83 -1.91 0.00 0.00 174.94 172.46 1nkq s GLY 316 N -2.31 2.04 -0.85 1.50 0.00 -0.10 -3.92 107.32 103.67 1nkq s GLY 316 Ca 0.32 -1.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.05 1nkq s GLY 316 CO 0.25 -1.88 0.58 0.54 0.00 0.00 0.00 173.10 172.59 1nkq n ARG 317 N -0.97 -1.28 -0.55 2.90 1.74 -1.26 -4.41 116.66 112.84 1nkq n ARG 317 Ca -0.04 0.60 0.06 0.00 -0.77 0.00 0.00 57.85 57.70 1nkq n ARG 317 Cb 0.62 -2.13 0.15 0.00 -1.02 0.00 0.00 32.46 30.08 1nkq n ARG 317 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1nkq n ASN 318 N -2.41 1.67 -3.95 0.55 4.05 -1.26 -4.94 115.26 108.96 1nkq n ASN 318 Ca -0.28 -3.24 -0.20 0.00 0.45 0.00 0.00 54.58 51.31 1nkq n ASN 318 Cb 0.65 -0.44 -0.16 0.00 1.23 0.00 0.00 39.78 41.06 1nkq n ASN 318 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1nkq s TYR 319 N -2.42 0.80 0.29 1.20 1.51 -1.26 -1.61 117.35 115.85 1nkq s TYR 319 Ca 0.32 -0.21 -0.10 0.00 -1.01 0.00 0.00 57.07 56.08 1nkq s TYR 319 Cb 0.31 -0.62 -0.07 0.00 -0.11 0.00 0.00 41.96 41.47 1nkq s TYR 319 CO -0.05 -0.13 0.63 0.00 -1.11 0.00 0.00 175.55 174.90 1nkq s ALA 320 N 0.47 3.48 0.21 3.71 0.00 -0.24 -4.90 121.76 124.49 1nkq s ALA 320 Ca -0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 51.96 51.60 1nkq s ALA 320 Cb -0.10 -2.53 0.18 0.00 0.00 0.00 0.00 23.12 20.66 1nkq s ALA 320 CO 0.00 0.32 1.62 0.00 0.00 0.00 0.00 175.76 177.70 1nkq h ALA 321 N 2.07 0.86 0.00 0.00 0.00 -2.01 -3.46 119.26 116.72 1nkq h ALA 321 Ca -0.47 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1nkq h ALA 321 Cb 1.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1nkq h ALA 321 CO 0.67 0.63 0.00 0.72 0.00 0.00 0.00 179.25 181.27 1nkq n HIS 322 N -4.10 0.00 -1.10 0.00 8.25 -1.26 -5.02 115.22 111.98 1nkq n HIS 322 Ca -0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.25 1nkq n HIS 322 Cb 0.45 0.07 -0.15 0.00 1.12 0.00 0.00 29.99 31.47 1nkq n HIS 322 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nkq n GLN 333 N 0.00 0.00 -1.36 -0.41 -0.00 -1.26 -5.03 117.38 109.32 1nkq n GLN 333 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.00 56.69 1nkq n GLN 333 Cb 0.43 -0.85 0.09 0.00 -0.00 0.00 0.00 30.24 29.91 1nkq n GLN 333 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1nkq s PRO 334 N 5.61 2.14 0.17 2.61 0.04 -1.26 -5.07 135.00 139.23 1nkq s PRO 334 Ca 0.98 0.96 0.11 0.00 0.04 0.00 0.00 61.00 63.09 1nkq s PRO 334 Cb -0.72 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 31.88 1nkq s PRO 334 CO 0.40 -1.66 -0.25 -0.59 0.04 0.00 0.00 177.00 174.94 1nkq s PHE 335 N -2.98 2.27 0.14 0.56 -0.12 -1.26 -5.00 117.98 111.59 1nkq s PHE 335 Ca 0.61 -0.37 0.08 0.00 -0.05 0.00 0.00 56.93 57.19 1nkq s PHE 335 Cb -0.16 -1.16 -0.04 0.00 -0.63 0.00 0.00 43.02 41.03 1nkq s PHE 335 CO 0.56 0.43 -0.18 -0.06 -0.05 0.00 0.00 175.22 175.92 1nkq s PHE 336 N -1.45 1.71 0.08 3.49 0.40 -1.26 -0.92 117.98 120.02 1nkq s PHE 336 Ca 0.18 -0.48 -0.14 0.00 -0.60 0.00 0.00 56.93 55.89 1nkq s PHE 336 Cb -0.09 -0.88 0.02 0.00 0.51 0.00 0.00 43.02 42.59 1nkq s PHE 336 CO 0.08 0.26 0.32 -0.59 0.70 0.00 0.00 175.22 175.99 1nkq s PHE 337 N -1.87 -0.09 0.21 0.36 -0.12 0.24 -4.97 117.98 111.75 1nkq s PHE 337 Ca 0.12 -0.16 0.02 0.00 -0.05 0.00 0.00 56.93 56.86 1nkq s PHE 337 Cb -0.07 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.41 1nkq s PHE 337 CO 0.05 -0.58 0.36 -0.51 -0.05 0.00 0.00 175.22 174.49 1nkq s LEU 338 N -2.48 4.27 -0.02 -1.99 1.43 -1.26 0.41 118.68 119.04 1nkq s LEU 338 Ca -0.00 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 1nkq s LEU 338 Cb 0.01 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.24 1nkq s LEU 338 CO -0.08 -0.05 -0.08 -0.54 0.23 0.00 0.00 176.35 175.83 1nkq s LYS 339 N -3.64 0.79 0.35 1.70 1.02 -0.52 -4.87 119.74 114.57 1nkq s LYS 339 Ca 0.36 -0.27 -0.26 0.00 0.02 0.00 0.00 55.97 55.82 1nkq s LYS 339 Cb -0.10 -0.76 -0.09 0.00 -0.52 0.00 0.00 37.83 36.36 1nkq s LYS 339 CO 0.30 0.11 1.05 -1.25 -0.92 0.00 0.00 175.35 174.64 1nkq s PRO 340 N 0.12 4.38 0.17 -1.68 0.04 -1.26 -3.92 135.00 132.85 1nkq s PRO 340 Ca -0.01 1.58 0.17 0.00 0.04 0.00 0.00 61.00 62.78 1nkq s PRO 340 Cb -0.07 -2.80 0.77 0.00 0.04 0.00 0.00 34.50 32.45 1nkq s PRO 340 CO 0.00 0.04 1.52 0.25 0.04 0.00 0.00 177.00 178.85 1nkq n THR 341 N 0.45 1.12 0.77 1.26 -2.24 -1.26 -0.98 114.28 113.40 1nkq n THR 341 Ca 0.02 0.40 0.12 0.00 -2.27 0.00 0.00 64.05 62.32 1nkq n THR 341 Cb 0.48 -1.31 0.50 0.00 -2.10 0.00 0.00 70.33 67.89 1nkq n THR 341 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1nkq n SER 342 N -1.94 0.13 -0.32 3.42 3.41 -1.26 -2.64 113.62 114.42 1nkq n SER 342 Ca 0.01 0.52 0.14 0.00 -0.26 0.00 0.00 58.87 59.28 1nkq n SER 342 Cb 0.13 -0.55 0.65 0.00 -0.26 0.00 0.00 64.21 64.18 1nkq n SER 342 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1nkq n SER 343 N -1.63 0.99 -4.77 4.04 3.41 -0.15 -4.29 113.62 111.23 1nkq n SER 343 Ca 0.05 -1.36 -0.40 0.00 -0.26 0.00 0.00 58.87 56.91 1nkq n SER 343 Cb 0.29 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1nkq n SER 343 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1nkq s ILE 344 N -1.98 2.68 -0.18 -1.33 1.01 -1.08 -1.50 121.20 118.81 1nkq s ILE 344 Ca 0.40 0.66 -0.14 0.00 0.00 0.00 0.00 60.65 61.57 1nkq s ILE 344 Cb 0.21 -3.41 0.05 0.00 0.01 0.00 0.00 42.46 39.33 1nkq s ILE 344 CO 0.34 0.13 0.47 0.54 0.00 0.00 0.00 174.94 176.42 1nkq s VAL 345 N -1.20 -0.01 0.28 2.92 0.11 -1.26 -4.47 120.40 116.77 1nkq s VAL 345 Ca 0.52 0.04 0.10 0.00 -2.93 0.00 0.00 61.98 59.71 1nkq s VAL 345 Cb -0.39 -0.67 -0.05 0.00 -1.53 0.00 0.00 36.38 33.74 1nkq s VAL 345 CO 0.51 0.02 -0.04 0.42 -3.33 0.00 0.00 175.10 172.68 1nkq s THR 346 N 0.84 3.15 0.46 5.04 -4.23 0.26 -1.27 115.64 119.88 1nkq s THR 346 Ca -0.05 -2.02 -0.23 0.00 -1.18 0.00 0.00 61.69 58.21 1nkq s THR 346 Cb -0.05 -2.73 -0.09 0.00 1.34 0.00 0.00 72.50 70.96 1nkq s THR 346 CO -0.07 -0.36 1.04 -2.65 -0.54 0.00 0.00 174.62 172.05 1nkq n PRO 347 N -0.85 1.34 -0.17 3.99 -0.02 -1.26 -1.99 135.00 136.04 1nkq n PRO 347 Ca -0.06 0.49 0.26 0.00 -2.02 0.00 0.00 63.50 62.17 1nkq n PRO 347 Cb 0.60 -2.12 0.69 0.00 -0.02 0.00 0.00 33.50 32.64 1nkq n PRO 347 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1nkq h LEU 348 N 1.39 0.07 -8.51 2.45 3.38 -1.81 -3.37 115.31 108.92 1nkq h LEU 348 Ca -0.46 0.01 -0.42 0.00 0.09 0.00 0.00 57.88 57.10 1nkq h LEU 348 Cb 1.34 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 1nkq h LEU 348 CO 0.56 0.03 1.30 -0.44 0.09 0.00 0.00 178.44 179.97 1nkq s SER 349 N -5.70 4.75 0.00 -0.43 0.01 -1.26 -4.88 113.70 106.19 1nkq s SER 349 Ca -0.06 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.76 1nkq s SER 349 Cb 0.21 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1nkq s SER 349 CO 0.77 -2.78 0.00 -0.24 0.41 0.00 0.00 173.24 171.40 1nkq n SER 350 N 14.85 0.00 -2.58 2.44 2.88 -1.26 -5.05 113.62 124.90 1nkq n SER 350 Ca 0.32 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.81 1nkq n SER 350 Cb 0.52 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.00 1nkq n SER 350 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1nkq n PRO 358 N 0.00 0.57 -2.25 -1.46 -0.02 -1.26 -4.98 135.00 125.61 1nkq n PRO 358 Ca 0.00 -0.62 -0.43 0.00 -2.02 0.00 0.00 63.50 60.44 1nkq n PRO 358 Cb 0.00 -0.12 -0.02 0.00 -0.02 0.00 0.00 33.50 33.33 1nkq n PRO 358 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nkq s ALA 359 N -2.67 3.49 0.00 3.55 0.00 -1.26 -2.93 121.76 121.94 1nkq s ALA 359 Ca 0.14 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.60 1nkq s ALA 359 Cb -0.01 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1nkq s ALA 359 CO 0.09 -1.54 0.00 -1.71 0.00 0.00 0.00 175.76 172.60 1nkq n ASN 360 N 7.40 -0.59 -4.75 0.00 2.85 -1.26 -5.01 115.26 113.92 1nkq n ASN 360 Ca 0.16 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.23 1nkq n ASN 360 Cb 0.45 -0.48 -0.04 0.00 1.24 0.00 0.00 39.78 40.94 1nkq n ASN 360 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1nkq s SER 361 N -2.70 7.35 0.00 1.20 0.15 -1.15 -4.80 113.70 113.74 1nkq s SER 361 Ca 0.00 2.12 0.11 0.00 0.70 0.00 0.00 55.95 58.88 1nkq s SER 361 Cb 0.00 -2.61 0.12 0.00 -1.71 0.00 0.00 66.02 61.82 1nkq s SER 361 CO 0.00 -0.12 0.91 0.35 1.20 0.00 0.00 173.24 175.58 1nkq n THR 362 N 1.81 0.16 -3.28 6.45 -2.24 -1.26 -4.79 114.28 111.13 1nkq n THR 362 Ca 0.00 -0.58 0.03 0.00 -2.27 0.00 0.00 64.05 61.24 1nkq n THR 362 Cb 0.46 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.77 1nkq n THR 362 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1nkq s PHE 363 N -0.93 -0.54 -0.19 4.78 5.36 -1.26 -4.66 117.98 120.54 1nkq s PHE 363 Ca 0.14 0.81 0.12 0.00 -0.96 0.00 0.00 56.93 57.05 1nkq s PHE 363 Cb 0.10 0.28 0.43 0.00 -0.34 0.00 0.00 43.02 43.48 1nkq s PHE 363 CO 0.14 -0.28 1.21 -1.71 -1.46 0.00 0.00 175.22 173.12 1nkq n ASN 364 N 5.06 1.92 0.00 6.13 4.05 -1.26 -5.06 115.26 126.09 1nkq n ASN 364 Ca -0.08 -3.66 0.00 0.00 0.45 0.00 0.00 54.58 51.29 1nkq n ASN 364 Cb 0.53 -0.49 0.00 0.00 1.23 0.00 0.00 39.78 41.06 1nkq n ASN 364 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1nkq n GLY 365 N -0.90 -1.19 3.85 8.20 0.00 -1.26 -4.97 105.19 108.92 1nkq n GLY 365 Ca 0.20 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.31 1nkq n GLY 365 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nkq s LEU 366 N -3.05 3.65 0.94 0.99 1.43 -1.26 -4.95 118.68 116.43 1nkq s LEU 366 Ca 0.00 1.44 -0.12 0.00 -1.03 0.00 0.00 54.13 54.42 1nkq s LEU 366 Cb 0.00 -4.37 0.16 0.00 0.03 0.00 0.00 46.19 42.00 1nkq s LEU 366 CO 0.00 -0.56 1.12 0.20 0.23 0.00 0.00 176.35 177.34 1nkq s ASN 367 N -3.18 3.19 0.50 2.29 0.01 -0.12 -4.77 114.94 112.87 1nkq s ASN 367 Ca 0.57 1.04 0.28 0.00 -0.71 0.00 0.00 52.86 54.04 1nkq s ASN 367 Cb -0.10 -1.65 1.55 0.00 0.41 0.00 0.00 41.25 41.45 1nkq s ASN 367 CO 0.33 -2.76 1.85 -0.33 -1.51 0.00 0.00 177.10 174.68 1nkq h GLU 368 N -1.64 0.00 0.00 -0.60 4.39 -1.98 0.62 114.58 115.38 1nkq h GLU 368 Ca -0.52 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1nkq h GLU 368 Cb 1.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 1nkq h GLU 368 CO 0.60 0.00 0.00 0.22 -1.16 0.00 0.00 179.01 178.67 1nkq h ASP 369 N 0.00 0.00 0.00 1.42 -0.00 -1.95 -3.46 116.42 112.42 1nkq h ASP 369 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1nkq h ASP 369 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.61 1nkq h ASP 369 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 1nkq n GLY 370 N 0.85 2.50 3.81 -0.78 0.00 0.22 -2.94 105.19 108.85 1nkq n GLY 370 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1nkq n GLY 370 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nkq s THR 371 N -3.19 4.31 -0.44 2.61 -1.32 -1.26 -4.67 115.64 111.68 1nkq s THR 371 Ca 0.00 1.53 0.07 0.00 -1.21 0.00 0.00 61.69 62.08 1nkq s THR 371 Cb 0.00 -3.67 0.23 0.00 -1.51 0.00 0.00 72.50 67.55 1nkq s THR 371 CO 0.00 -0.22 0.64 -3.20 -2.21 0.00 0.00 174.62 169.63 1nkq n ASN 372 N -0.42 -1.41 -4.67 8.08 5.15 -1.26 -0.94 115.26 119.79 1nkq n ASN 372 Ca 0.06 -2.88 -0.45 0.00 -0.60 0.00 0.00 54.58 50.71 1nkq n ASN 372 Cb 0.53 0.50 -0.03 0.00 -0.53 0.00 0.00 39.78 40.25 1nkq n ASN 372 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1nkq n PRO 373 N 1.89 2.08 0.00 1.20 -0.02 -1.26 -0.57 135.00 138.33 1nkq n PRO 373 Ca 0.18 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1nkq n PRO 373 Cb 0.56 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1nkq n PRO 373 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nkq n GLY 374 N 2.76 0.15 4.03 -1.23 0.00 -0.84 -4.85 105.19 105.21 1nkq n GLY 374 Ca 0.14 -0.99 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 1nkq n GLY 374 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nkq s PRO 375 N -2.00 2.02 -0.08 1.61 0.04 -1.26 -4.34 135.00 130.98 1nkq s PRO 375 Ca 0.00 -1.55 -0.21 0.00 0.04 0.00 0.00 61.00 59.28 1nkq s PRO 375 Cb 0.00 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 1nkq s PRO 375 CO 0.00 -1.13 0.59 0.42 0.04 0.00 0.00 177.00 176.92 1nkq s ILE 376 N -2.86 5.09 -0.45 0.56 -1.09 0.12 -4.93 121.20 117.65 1nkq s ILE 376 Ca 0.64 1.21 -0.13 0.00 -2.23 0.00 0.00 60.65 60.14 1nkq s ILE 376 Cb -0.05 -3.93 0.07 0.00 -1.58 0.00 0.00 42.46 36.97 1nkq s ILE 376 CO 0.41 0.30 0.34 -0.36 -1.23 0.00 0.00 174.94 174.41 1nkq s PHE 377 N 0.61 3.28 -0.39 3.97 2.99 -1.26 0.11 117.98 127.29 1nkq s PHE 377 Ca 0.32 -1.13 -0.26 0.00 0.00 0.00 0.00 56.93 55.86 1nkq s PHE 377 Cb -0.17 -3.07 0.02 0.00 0.00 0.00 0.00 43.02 39.80 1nkq s PHE 377 CO 0.15 -0.81 0.96 0.42 -0.00 0.00 0.00 175.22 175.94 1nkq s ILE 378 N 1.57 4.52 0.50 0.64 1.01 0.33 -4.70 121.20 125.07 1nkq s ILE 378 Ca 0.04 1.15 -0.23 0.00 0.00 0.00 0.00 60.65 61.60 1nkq s ILE 378 Cb -0.24 -4.39 -0.07 0.00 0.01 0.00 0.00 42.46 37.78 1nkq s ILE 378 CO 0.05 -0.64 1.35 -0.81 0.00 0.00 0.00 174.94 174.90 1nkq n PRO 379 N 6.96 1.86 -1.93 2.79 -0.04 -1.26 -1.08 135.00 142.31 1nkq n PRO 379 Ca 0.08 0.67 -0.42 0.00 -0.04 0.00 0.00 63.50 63.79 1nkq n PRO 379 Cb 0.48 -2.55 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1nkq n PRO 379 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1nkq s ARG 380 N -2.66 4.22 0.00 0.54 0.52 -1.26 -2.28 118.95 118.03 1nkq s ARG 380 Ca 0.67 2.37 0.00 0.00 -0.52 0.00 0.00 55.73 58.26 1nkq s ARG 380 Cb -0.44 -3.13 0.00 0.00 0.52 0.00 0.00 34.95 31.90 1nkq s ARG 380 CO 0.53 -0.57 0.00 0.41 0.02 0.00 0.00 175.30 175.68 1nkq n GLY 381 N 3.30 0.71 3.57 -3.53 0.00 -1.26 0.12 105.19 108.10 1nkq n GLY 381 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1nkq n GLY 381 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nkq s VAL 382 N -2.68 4.10 -0.26 1.61 1.01 -0.96 -4.63 120.40 118.59 1nkq s VAL 382 Ca 0.00 -0.30 -0.16 0.00 0.00 0.00 0.00 61.98 61.52 1nkq s VAL 382 Cb 0.00 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 1nkq s VAL 382 CO 0.00 0.53 0.45 -0.75 0.00 0.00 0.00 175.10 175.32 1nkq s LYS 383 N -0.04 4.05 -0.20 2.72 2.47 -1.26 -4.79 119.74 122.68 1nkq s LYS 383 Ca 0.02 0.20 -0.07 0.00 -1.56 0.00 0.00 55.97 54.56 1nkq s LYS 383 Cb -0.13 -3.65 -0.04 0.00 -1.46 0.00 0.00 37.83 32.56 1nkq s LYS 383 CO 0.02 -0.30 0.05 0.08 0.16 0.00 0.00 175.35 175.36 1nkq s VAL 384 N 2.16 4.57 -0.05 4.02 1.01 -1.26 -0.74 120.40 130.11 1nkq s VAL 384 Ca 0.18 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 1nkq s VAL 384 Cb -0.16 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1nkq s VAL 384 CO 0.09 0.43 0.09 -1.00 0.00 0.00 0.00 175.10 174.72 1nkq s HIS 385 N 0.69 3.38 0.04 5.22 3.76 -0.39 0.09 115.29 128.08 1nkq s HIS 385 Ca 0.03 0.31 -0.02 0.00 -0.15 0.00 0.00 55.06 55.22 1nkq s HIS 385 Cb -0.13 -1.81 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 1nkq s HIS 385 CO 0.02 0.60 0.23 -3.38 -0.85 0.00 0.00 174.74 171.35 1nkq s HIS 386 N -1.10 3.53 -0.30 1.40 -3.43 -0.45 -2.18 115.29 112.76 1nkq s HIS 386 Ca 0.19 0.36 -0.01 0.00 -0.80 0.00 0.00 55.06 54.80 1nkq s HIS 386 Cb -0.12 -1.84 0.13 0.00 -1.43 0.00 0.00 32.58 29.32 1nkq s HIS 386 CO 0.09 0.59 0.25 -1.21 -2.00 0.00 0.00 174.74 172.46 1nkq s GLU 387 N -2.27 0.31 0.10 -0.38 2.02 -1.25 -4.13 118.70 113.09 1nkq s GLU 387 Ca 0.33 -0.32 -0.31 0.00 0.02 0.00 0.00 54.97 54.69 1nkq s GLU 387 Cb -0.13 -0.82 -0.07 0.00 0.10 0.00 0.00 34.13 33.22 1nkq s GLU 387 CO 0.23 -1.04 1.30 -1.50 0.02 0.00 0.00 175.26 174.27 1nkq s ILE 388 N 2.20 3.62 0.03 -1.63 1.10 -1.26 -0.55 121.20 124.72 1nkq s ILE 388 Ca 0.10 1.17 -0.06 0.00 -0.51 0.00 0.00 60.65 61.35 1nkq s ILE 388 Cb -0.15 -3.75 -0.01 0.00 0.15 0.00 0.00 42.46 38.70 1nkq s ILE 388 CO -0.32 0.10 0.12 -1.61 -2.11 0.00 0.00 174.94 171.12 1nkq s GLU 389 N 0.99 0.58 -0.12 3.50 2.02 0.20 -4.24 118.70 121.63 1nkq s GLU 389 Ca 0.61 -0.67 -0.20 0.00 0.02 0.00 0.00 54.97 54.73 1nkq s GLU 389 Cb -0.34 0.23 -0.04 0.00 0.10 0.00 0.00 34.13 34.09 1nkq s GLU 389 CO 0.30 -0.15 0.58 -1.17 0.02 0.00 0.00 175.26 174.84 1nkq s LEU 390 N -1.97 4.26 -0.11 1.80 2.96 -1.26 -1.66 118.68 122.70 1nkq s LEU 390 Ca -0.07 0.94 -0.02 0.00 -0.22 0.00 0.00 54.13 54.76 1nkq s LEU 390 Cb -0.02 -2.86 -0.03 0.00 0.50 0.00 0.00 46.19 43.77 1nkq s LEU 390 CO -0.03 -0.09 -0.02 0.00 -1.32 0.00 0.00 176.35 174.89 1nkq s ALA 391 N 0.93 3.16 -0.11 5.97 0.00 0.25 -1.84 121.76 130.12 1nkq s ALA 391 Ca 0.30 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 1nkq s ALA 391 Cb -0.16 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 1nkq s ALA 391 CO 0.13 0.45 0.04 -0.51 0.00 0.00 0.00 175.76 175.87 1nkq s LEU 392 N -0.42 3.79 -0.35 0.00 1.43 -0.05 -1.14 118.68 121.94 1nkq s LEU 392 Ca 0.07 0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 53.31 1nkq s LEU 392 Cb -0.12 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 44.25 1nkq s LEU 392 CO 0.02 0.34 0.12 -0.63 0.23 0.00 0.00 176.35 176.43 1nkq s ILE 393 N -0.63 3.69 0.30 -0.59 1.09 -0.92 -1.06 121.20 123.07 1nkq s ILE 393 Ca 0.11 -1.30 -0.29 0.00 -1.10 0.00 0.00 60.65 58.07 1nkq s ILE 393 Cb -0.12 -3.16 -0.10 0.00 -1.06 0.00 0.00 42.46 38.02 1nkq s ILE 393 CO 0.02 -0.27 1.42 -0.69 -0.10 0.00 0.00 174.94 175.33 1nkq s VAL 394 N 1.36 2.53 -0.79 2.92 1.01 -0.43 0.04 120.40 127.03 1nkq s VAL 394 Ca -0.01 0.48 0.08 0.00 0.00 0.00 0.00 61.98 62.53 1nkq s VAL 394 Cb -0.20 -3.31 0.18 0.00 0.00 0.00 0.00 36.38 33.05 1nkq s VAL 394 CO 0.01 0.09 1.06 -1.54 0.00 0.00 0.00 175.10 174.73 1nkq n SER 395 N 1.60 2.40 -3.34 3.32 3.41 0.15 0.56 113.62 121.73 1nkq n SER 395 Ca 0.04 -1.81 -0.09 0.00 -0.26 0.00 0.00 58.87 56.75 1nkq n SER 395 Cb 0.40 -0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1nkq n SER 395 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1nkq s LYS 396 N -0.91 2.01 -0.09 4.33 -2.85 -1.25 -4.72 119.74 116.26 1nkq s LYS 396 Ca 0.15 -1.32 -0.29 0.00 -1.00 0.00 0.00 55.97 53.51 1nkq s LYS 396 Cb 0.08 0.59 -0.02 0.00 -2.06 0.00 0.00 37.83 36.43 1nkq s LYS 396 CO 0.11 -0.92 0.99 -1.01 0.10 0.00 0.00 175.35 174.63 1nkq s HIS 397 N -3.02 3.54 -0.22 1.78 3.76 -1.26 -3.67 115.29 116.20 1nkq s HIS 397 Ca 0.16 1.60 0.01 0.00 -0.15 0.00 0.00 55.06 56.68 1nkq s HIS 397 Cb -0.05 -3.16 0.05 0.00 1.11 0.00 0.00 32.58 30.53 1nkq s HIS 397 CO 0.11 -0.18 -0.08 -0.51 -0.85 0.00 0.00 174.74 173.23 1nkq s LEU 398 N 1.82 2.51 -0.16 0.89 1.02 -0.04 -4.98 118.68 119.73 1nkq s LEU 398 Ca 0.49 -1.07 -0.04 0.00 0.02 0.00 0.00 54.13 53.53 1nkq s LEU 398 Cb -0.19 -1.23 0.07 0.00 0.02 0.00 0.00 46.19 44.86 1nkq s LEU 398 CO 0.20 -0.19 0.14 -0.55 0.02 0.00 0.00 176.35 175.97 1nkq s SER 399 N 1.37 1.70 -1.27 2.29 0.15 -1.26 0.13 113.70 116.81 1nkq s SER 399 Ca -0.04 -0.30 -0.01 0.00 0.70 0.00 0.00 55.95 56.30 1nkq s SER 399 Cb -0.18 0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.20 1nkq s SER 399 CO -0.07 -0.32 0.90 0.59 1.20 0.00 0.00 173.24 175.54 1nkq n ASN 400 N 5.30 -2.20 -4.70 5.45 3.02 0.23 -4.94 115.26 117.43 1nkq n ASN 400 Ca -0.06 -0.70 -0.42 0.00 -0.03 0.00 0.00 54.58 53.37 1nkq n ASN 400 Cb 0.49 -4.65 -0.03 0.00 -0.61 0.00 0.00 39.78 34.99 1nkq n ASN 400 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1nkq s VAL 401 N -3.47 4.49 0.10 2.41 1.01 -1.26 -4.94 120.40 118.73 1nkq s VAL 401 Ca 0.08 1.78 -0.14 0.00 0.00 0.00 0.00 61.98 63.71 1nkq s VAL 401 Cb -0.04 -4.15 -0.11 0.00 0.00 0.00 0.00 36.38 32.08 1nkq s VAL 401 CO 0.77 0.05 1.36 0.71 0.00 0.00 0.00 175.10 177.99 1nkq h THR 402 N 4.90 1.30 -2.14 3.92 1.35 -1.92 -3.45 112.91 116.87 1nkq h THR 402 Ca -0.36 -1.68 -0.01 0.00 -0.55 0.00 0.00 66.41 63.81 1nkq h THR 402 Cb 1.18 1.76 -0.00 0.00 -1.73 0.00 0.00 68.15 69.36 1nkq h THR 402 CO 0.83 0.53 0.02 2.29 -0.25 0.00 0.00 175.52 178.95 1nkq n LYS 403 N -4.13 0.12 -3.76 4.72 2.85 -1.26 -5.03 118.16 111.67 1nkq n LYS 403 Ca -0.05 -0.28 -0.10 0.00 -1.05 0.00 0.00 58.31 56.83 1nkq n LYS 403 Cb 0.58 0.32 -0.07 0.00 -0.65 0.00 0.00 35.03 35.22 1nkq n LYS 403 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1nkq s LYS 405 N -2.03 0.89 0.27 -1.58 1.02 -1.26 -5.07 119.74 111.98 1nkq s LYS 405 Ca 0.02 -0.71 -0.06 0.00 0.02 0.00 0.00 55.97 55.24 1nkq s LYS 405 Cb -0.00 0.38 0.51 0.00 -0.52 0.00 0.00 37.83 38.19 1nkq s LYS 405 CO 0.02 -0.30 1.59 -1.35 -0.92 0.00 0.00 175.35 174.38 1nkq h PRO 406 N 2.83 0.03 0.00 -1.68 0.11 -1.97 -0.31 132.00 131.00 1nkq h PRO 406 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1nkq h PRO 406 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1nkq h PRO 406 CO 0.50 0.02 0.00 0.93 -0.21 0.00 0.00 178.00 179.23 1nkq h GLU 407 N 0.03 0.00 0.00 1.05 3.07 -1.73 -2.89 114.58 114.11 1nkq h GLU 407 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 1nkq h GLU 407 Cb 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 1nkq h GLU 407 CO -0.86 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.14 1nkq n GLU 408 N -2.84 0.17 -0.07 2.33 1.02 -0.13 -3.80 120.64 117.33 1nkq n GLU 408 Ca 0.00 0.15 -0.10 0.00 -0.02 0.00 0.00 57.16 57.19 1nkq n GLU 408 Cb 0.25 -1.70 -0.03 0.00 -0.02 0.00 0.00 31.44 29.94 1nkq n GLU 408 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1nkq h VAL 409 N 0.00 1.15 -0.77 2.62 2.07 -1.58 -2.24 116.25 117.49 1nkq h VAL 409 Ca 0.00 -0.44 0.11 0.00 0.82 0.00 0.00 66.70 67.20 1nkq h VAL 409 Cb 0.64 1.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 1nkq h VAL 409 CO 0.00 0.15 0.38 0.22 0.02 0.00 0.00 177.57 178.34 1nkq h TYR 410 N 0.25 0.68 0.00 1.57 3.20 -1.78 0.19 116.97 121.07 1nkq h TYR 410 Ca 0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1nkq h TYR 410 Cb 0.14 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.22 1nkq h TYR 410 CO -0.02 0.21 0.00 -0.25 -1.64 0.00 0.00 178.16 176.46 1nkq n ASP 411 N -4.87 0.00 -0.51 -2.11 8.00 -1.05 -3.13 116.55 112.89 1nkq n ASP 411 Ca 0.13 0.43 0.10 0.00 0.71 0.00 0.00 54.79 56.16 1nkq n ASP 411 Cb 0.33 -0.47 0.01 0.00 -0.02 0.00 0.00 41.12 40.97 1nkq n ASP 411 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1nkq n SER 412 N -1.47 2.01 -4.43 -2.24 7.64 0.03 -4.88 113.62 110.26 1nkq n SER 412 Ca 0.06 -1.50 -0.22 0.00 1.01 0.00 0.00 58.87 58.22 1nkq n SER 412 Cb 0.25 0.41 -0.10 0.00 -1.01 0.00 0.00 64.21 63.76 1nkq n SER 412 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1nkq s ILE 413 N -2.18 1.83 -0.17 0.44 -4.36 -1.03 -0.67 121.20 115.05 1nkq s ILE 413 Ca 0.18 -2.18 0.22 0.00 -0.26 0.00 0.00 60.65 58.61 1nkq s ILE 413 Cb 0.16 -2.39 -0.23 0.00 1.25 0.00 0.00 42.46 41.25 1nkq s ILE 413 CO 0.47 -0.35 0.68 -1.20 0.24 0.00 0.00 174.94 174.79 1nkq n SER 414 N -0.58 0.31 0.00 4.36 7.64 0.11 -4.59 113.62 120.86 1nkq n SER 414 Ca -0.06 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1nkq n SER 414 Cb 0.62 1.47 0.00 0.00 -1.01 0.00 0.00 64.21 65.29 1nkq n SER 414 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nkq n GLY 415 N 1.26 -0.60 3.43 0.23 0.00 -1.25 -3.48 105.19 104.78 1nkq n GLY 415 Ca -0.02 -1.20 -0.22 0.00 0.00 0.00 0.00 46.02 44.57 1nkq n GLY 415 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nkq s VAL 416 N -2.98 0.51 0.17 1.61 -7.23 -1.05 -2.17 120.40 109.26 1nkq s VAL 416 Ca 0.00 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 57.98 1nkq s VAL 416 Cb 0.00 -2.46 0.04 0.00 0.56 0.00 0.00 36.38 34.53 1nkq s VAL 416 CO 0.00 0.00 0.54 0.00 -0.31 0.00 0.00 175.10 175.33 1nkq s ALA 417 N -3.37 -1.19 -0.18 1.32 0.00 -0.29 -0.19 121.76 117.85 1nkq s ALA 417 Ca 0.30 0.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.25 1nkq s ALA 417 Cb 0.04 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 1nkq s ALA 417 CO 0.17 -0.78 0.06 -1.17 0.00 0.00 0.00 175.76 174.04 1nkq s LEU 418 N -2.82 3.79 0.08 0.00 2.96 -1.26 -0.59 118.68 120.84 1nkq s LEU 418 Ca 0.05 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.05 1nkq s LEU 418 Cb -0.01 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1nkq s LEU 418 CO -0.08 0.17 -0.07 0.00 -1.32 0.00 0.00 176.35 175.06 1nkq s ALA 419 N 0.38 0.82 -0.24 5.97 0.00 -0.66 -1.35 121.76 126.69 1nkq s ALA 419 Ca 0.03 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.82 1nkq s ALA 419 Cb -0.12 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.12 1nkq s ALA 419 CO 0.00 -0.16 -0.03 -0.51 0.00 0.00 0.00 175.76 175.07 1nkq s LEU 420 N -2.50 3.17 -1.22 0.00 1.43 -0.25 -0.63 118.68 118.68 1nkq s LEU 420 Ca 0.04 -0.63 -0.14 0.00 -1.03 0.00 0.00 54.13 52.37 1nkq s LEU 420 Cb -0.00 -1.74 0.16 0.00 0.03 0.00 0.00 46.19 44.64 1nkq s LEU 420 CO -0.03 -0.09 1.48 -0.67 0.23 0.00 0.00 176.35 177.27 1nkq n ASP 421 N 4.76 5.19 -4.77 2.29 2.03 0.29 -3.36 116.55 122.99 1nkq n ASP 421 Ca -0.17 -2.98 -0.41 0.00 0.52 0.00 0.00 54.79 51.76 1nkq n ASP 421 Cb 0.49 -1.58 -0.01 0.00 -0.72 0.00 0.00 41.12 39.29 1nkq n ASP 421 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1nkq s LEU 422 N 1.74 4.39 -0.02 -2.67 1.43 -0.68 -3.87 118.68 118.99 1nkq s LEU 422 Ca 0.44 2.81 0.01 0.00 -1.03 0.00 0.00 54.13 56.36 1nkq s LEU 422 Cb -0.02 -3.66 0.01 0.00 0.03 0.00 0.00 46.19 42.56 1nkq s LEU 422 CO 0.01 -0.65 -0.04 -0.89 0.23 0.00 0.00 176.35 175.01 1nkq s THR 423 N -1.14 0.43 -1.11 5.49 2.01 -0.93 -4.71 115.64 115.68 1nkq s THR 423 Ca 0.50 -0.13 -0.20 0.00 0.31 0.00 0.00 61.69 62.18 1nkq s THR 423 Cb -0.42 -0.43 0.08 0.00 0.01 0.00 0.00 72.50 71.75 1nkq s THR 423 CO 0.56 0.17 1.48 0.00 -0.69 0.00 0.00 174.62 176.14 1nkq s ALA 424 N 0.51 3.15 0.14 7.40 0.00 1.00 -1.26 121.76 132.70 1nkq s ALA 424 Ca -0.06 -2.66 -0.31 0.00 0.00 0.00 0.00 51.96 48.93 1nkq s ALA 424 Cb -0.10 -4.44 -0.07 0.00 0.00 0.00 0.00 23.12 18.52 1nkq s ALA 424 CO -0.00 -3.33 1.56 -0.09 0.00 0.00 0.00 175.76 173.90 1nkq h ARG 425 N 8.68 -0.34 0.00 0.00 9.65 -1.24 0.32 114.38 131.45 1nkq h ARG 425 Ca 0.28 0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 59.16 1nkq h ARG 425 Cb 0.95 0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.61 1nkq h ARG 425 CO 1.37 -0.23 -0.13 -2.95 2.80 0.00 0.00 179.97 180.82 1nkq h ASN 426 N -0.35 0.00 -0.01 -3.80 -1.07 -1.90 0.12 115.58 108.57 1nkq h ASN 426 Ca 0.10 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.25 1nkq h ASN 426 Cb 0.59 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.85 1nkq h ASN 426 CO -0.61 0.13 -0.80 0.58 0.07 0.00 0.00 177.43 176.80 1nkq h VAL 427 N 0.00 1.31 -0.62 6.14 2.07 -1.57 -3.01 116.25 120.57 1nkq h VAL 427 Ca -0.00 -2.06 -0.09 0.00 0.82 0.00 0.00 66.70 65.37 1nkq h VAL 427 Cb 0.24 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1nkq h VAL 427 CO 0.02 0.64 0.05 -0.61 0.02 0.00 0.00 177.57 177.69 1nkq h GLN 428 N 0.45 1.06 -0.44 1.57 4.15 0.52 -2.42 115.11 119.99 1nkq h GLN 428 Ca -0.06 -0.31 0.06 0.00 0.77 0.00 0.00 58.65 59.12 1nkq h GLN 428 Cb 1.42 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.95 1nkq h GLN 428 CO 0.16 1.01 0.13 -0.44 -1.93 0.00 0.00 178.83 177.76 1nkq h ASP 429 N 0.97 0.11 -0.53 -0.69 3.32 -0.76 -0.64 116.42 118.19 1nkq h ASP 429 Ca 0.18 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 1nkq h ASP 429 Cb 0.49 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1nkq h ASP 429 CO 0.02 0.10 0.20 -0.08 -1.72 0.00 0.00 179.24 177.75 1nkq h GLU 430 N 0.29 0.85 -0.21 3.56 4.81 -1.38 -1.51 114.58 120.98 1nkq h GLU 430 Ca 0.21 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1nkq h GLU 430 Cb 0.22 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1nkq h GLU 430 CO -0.23 0.72 0.10 0.00 -0.73 0.00 0.00 179.01 178.87 1nkq h ALA 431 N 1.38 0.27 -0.01 2.92 0.00 -0.80 -1.18 119.26 121.84 1nkq h ALA 431 Ca 0.19 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1nkq h ALA 431 Cb 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1nkq h ALA 431 CO -0.01 -0.15 -0.03 0.87 0.00 0.00 0.00 179.25 179.93 1nkq h LYS 432 N 0.20 -0.04 -0.83 0.00 1.57 -0.79 0.70 116.57 117.39 1nkq h LYS 432 Ca 0.07 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1nkq h LYS 432 Cb 0.14 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 1nkq h LYS 432 CO -0.01 -0.03 0.44 1.57 -0.57 0.00 0.00 179.45 180.86 1nkq h LYS 433 N -0.04 1.16 -0.00 3.15 2.10 -1.20 -1.28 116.57 120.45 1nkq h LYS 433 Ca 0.02 -0.14 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1nkq h LYS 433 Cb 0.06 -0.23 0.00 0.00 -0.90 0.00 0.00 32.23 31.17 1nkq h LYS 433 CO -0.04 0.85 -0.13 1.63 -2.00 0.00 0.00 179.45 179.77 1nkq n LYS 434 N -4.34 0.49 -3.27 0.07 5.02 -0.46 -4.92 118.16 110.76 1nkq n LYS 434 Ca 0.09 -0.15 -0.19 0.00 -2.02 0.00 0.00 58.31 56.03 1nkq n LYS 434 Cb 0.10 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.67 1nkq n LYS 434 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nkq n GLY 435 N 1.33 -0.25 3.92 0.72 0.00 0.19 -5.02 105.19 106.09 1nkq n GLY 435 Ca 0.12 0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 1nkq n GLY 435 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nkq s LEU 436 N -5.89 3.33 0.45 0.99 1.43 0.17 -5.00 118.68 114.17 1nkq s LEU 436 Ca 0.42 -0.75 -0.25 0.00 -1.03 0.00 0.00 54.13 52.52 1nkq s LEU 436 Cb -0.19 -2.02 -0.08 0.00 0.03 0.00 0.00 46.19 43.93 1nkq s LEU 436 CO 0.52 -0.79 1.38 -2.84 0.23 0.00 0.00 176.35 174.85 1nkq s PRO 437 N -4.24 3.72 0.00 1.29 0.02 -1.26 -4.56 135.00 129.97 1nkq s PRO 437 Ca 0.49 2.31 0.26 0.00 0.02 0.00 0.00 61.00 64.08 1nkq s PRO 437 Cb -0.04 -2.64 0.62 0.00 0.02 0.00 0.00 34.50 32.45 1nkq s PRO 437 CO 0.29 -0.75 1.49 0.91 -0.33 0.00 0.00 177.00 178.61 1nkq n TRP 438 N -0.19 0.00 -0.32 6.54 7.02 -1.26 -4.59 117.44 124.65 1nkq n TRP 438 Ca 0.05 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.45 1nkq n TRP 438 Cb 0.43 -0.27 -0.08 0.00 -2.42 0.00 0.00 31.31 28.97 1nkq n TRP 438 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1nkq n THR 439 N -1.44 -0.52 -0.08 -0.99 -1.04 -1.26 -1.43 114.28 107.52 1nkq n THR 439 Ca 0.06 2.06 -0.07 0.00 -2.04 0.00 0.00 64.05 64.06 1nkq n THR 439 Cb 0.34 -2.57 0.00 0.00 -1.82 0.00 0.00 70.33 66.28 1nkq n THR 439 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1nkq h ILE 440 N 0.00 0.88 0.00 12.58 1.08 -1.93 0.88 117.51 131.00 1nkq h ILE 440 Ca 0.12 -0.07 -0.00 0.00 -0.39 0.00 0.00 64.86 64.52 1nkq h ILE 440 Cb 0.31 0.67 -0.00 0.00 -3.07 0.00 0.00 36.82 34.73 1nkq h ILE 440 CO -0.71 0.04 -0.01 0.77 -0.69 0.00 0.00 178.15 177.54 1nkq h SER 441 N 0.20 0.00 -0.01 1.72 4.64 -1.64 -2.24 113.55 116.22 1nkq h SER 441 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1nkq h SER 441 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1nkq h SER 441 CO -0.17 0.01 -0.24 0.29 -0.87 0.00 0.00 176.83 175.85 1nkq n LYS 442 N -3.21 2.22 -0.16 4.77 4.76 -0.51 -0.00 118.16 126.03 1nkq n LYS 442 Ca -0.02 -0.56 0.07 0.00 -2.87 0.00 0.00 58.31 54.93 1nkq n LYS 442 Cb 0.13 -1.09 0.09 0.00 -1.84 0.00 0.00 35.03 32.33 1nkq n LYS 442 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nkq n GLY 443 N 0.95 3.58 3.72 0.72 0.00 0.29 -4.76 105.19 109.69 1nkq n GLY 443 Ca 0.04 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 1nkq n GLY 443 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nkq s PHE 444 N -2.03 2.02 0.46 1.61 0.40 -1.19 -4.69 117.98 114.56 1nkq s PHE 444 Ca 0.22 1.55 -0.23 0.00 -0.60 0.00 0.00 56.93 57.87 1nkq s PHE 444 Cb 0.19 -3.60 -0.10 0.00 0.51 0.00 0.00 43.02 40.03 1nkq s PHE 444 CO 0.02 -2.83 0.93 -0.25 0.70 0.00 0.00 175.22 173.80 1nkq n ASP 445 N -2.37 0.86 -1.08 1.36 8.00 -1.26 -1.45 116.55 120.61 1nkq n ASP 445 Ca 0.15 0.97 -0.14 0.00 0.71 0.00 0.00 54.79 56.48 1nkq n ASP 445 Cb 0.49 -1.33 -0.06 0.00 -0.02 0.00 0.00 41.12 40.20 1nkq n ASP 445 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1nkq n THR 446 N -0.80 0.00 -1.55 -3.53 -2.24 -0.91 -4.58 114.28 100.67 1nkq n THR 446 Ca 0.10 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.57 1nkq n THR 446 Cb 0.41 -1.54 -0.05 0.00 -2.10 0.00 0.00 70.33 67.05 1nkq n THR 446 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1nkq n PHE 447 N -2.48 1.87 -3.64 4.78 3.01 -0.53 -4.69 117.46 115.77 1nkq n PHE 447 Ca -0.14 -2.43 -0.08 0.00 1.01 0.00 0.00 57.45 55.81 1nkq n PHE 447 Cb 0.52 -1.82 -0.07 0.00 -0.01 0.00 0.00 39.48 38.10 1nkq n PHE 447 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1nkq s PRO 449 N -0.23 0.57 0.01 -1.08 0.02 -1.21 -1.69 135.00 131.38 1nkq s PRO 449 Ca 0.61 0.81 -0.08 0.00 0.02 0.00 0.00 61.00 62.35 1nkq s PRO 449 Cb 0.26 0.20 0.00 0.00 0.02 0.00 0.00 34.50 34.98 1nkq s PRO 449 CO -0.11 -0.09 0.15 -1.50 -0.33 0.00 0.00 177.00 175.13 1nkq s ILE 450 N 0.84 0.09 0.32 2.83 2.07 -0.40 -1.09 121.20 125.85 1nkq s ILE 450 Ca -0.03 -0.74 -0.02 0.00 -1.41 0.00 0.00 60.65 58.44 1nkq s ILE 450 Cb -0.05 -0.56 0.07 0.00 0.13 0.00 0.00 42.46 42.05 1nkq s ILE 450 CO -0.10 -0.41 0.43 -1.54 -1.91 0.00 0.00 174.94 171.41 1nkq n SER 451 N 1.26 0.37 -4.87 4.50 3.41 -0.45 -4.47 113.62 113.37 1nkq n SER 451 Ca -0.22 -1.36 -0.31 0.00 -0.26 0.00 0.00 58.87 56.72 1nkq n SER 451 Cb 0.56 -0.30 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1nkq n SER 451 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nkq s ALA 452 N -3.27 3.10 0.37 7.33 0.00 -1.26 -4.80 121.76 123.23 1nkq s ALA 452 Ca 0.27 -0.07 -0.26 0.00 0.00 0.00 0.00 51.96 51.90 1nkq s ALA 452 Cb -0.01 -3.08 -0.09 0.00 0.00 0.00 0.00 23.12 19.94 1nkq s ALA 452 CO 0.18 -0.65 1.14 -1.50 0.00 0.00 0.00 175.76 174.93 1nkq s ILE 453 N -3.13 3.30 -0.38 0.00 2.07 -0.78 -4.63 121.20 117.65 1nkq s ILE 453 Ca 0.55 1.12 -0.12 0.00 -1.41 0.00 0.00 60.65 60.79 1nkq s ILE 453 Cb -0.11 -3.64 0.02 0.00 0.13 0.00 0.00 42.46 38.86 1nkq s ILE 453 CO 0.52 0.13 0.24 -0.69 -1.91 0.00 0.00 174.94 173.23 1nkq s VAL 454 N -1.40 4.82 0.39 4.00 1.01 0.73 -4.75 120.40 125.19 1nkq s VAL 454 Ca 0.54 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.50 1nkq s VAL 454 Cb -0.30 -3.67 -0.11 0.00 0.00 0.00 0.00 36.38 32.30 1nkq s VAL 454 CO 0.38 -0.24 1.21 -0.24 0.00 0.00 0.00 175.10 176.21 1nkq n SER 455 N 5.05 2.32 0.00 3.32 2.88 -1.26 -2.53 113.62 123.40 1nkq n SER 455 Ca -0.12 1.13 0.04 0.00 -1.33 0.00 0.00 58.87 58.59 1nkq n SER 455 Cb 0.47 -1.46 0.16 0.00 -0.75 0.00 0.00 64.21 62.63 1nkq n SER 455 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1nkq n ARG 456 N 0.28 0.03 0.28 -1.46 1.85 -1.23 -1.29 116.66 115.13 1nkq n ARG 456 Ca 0.07 0.33 0.18 0.00 -1.00 0.00 0.00 57.85 57.43 1nkq n ARG 456 Cb 0.38 -1.50 0.97 0.00 -1.05 0.00 0.00 32.46 31.25 1nkq n ARG 456 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 1nkq h GLU 457 N 0.00 0.00 0.00 2.89 4.22 -1.90 -0.25 114.58 119.55 1nkq h GLU 457 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1nkq h GLU 457 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1nkq h GLU 457 CO 0.00 0.00 -0.12 0.87 -2.18 0.00 0.00 179.01 177.58 1nkq h LYS 458 N 0.00 0.00 -0.04 1.92 1.57 -1.54 -3.31 116.57 115.17 1nkq h LYS 458 Ca 0.03 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1nkq h LYS 458 Cb 0.26 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.34 1nkq h LYS 458 CO -0.00 0.00 -0.81 1.97 -0.57 0.00 0.00 179.45 180.03 1nkq n PHE 459 N -2.86 0.12 -0.36 -1.35 1.16 -0.26 -4.86 117.46 109.06 1nkq n PHE 459 Ca 0.04 -1.02 0.04 0.00 -1.87 0.00 0.00 57.45 54.64 1nkq n PHE 459 Cb 0.51 -0.20 0.20 0.00 -1.61 0.00 0.00 39.48 38.38 1nkq n PHE 459 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1nkq h SER 460 N 1.09 1.00 0.07 5.98 0.87 -1.24 -1.53 113.55 119.79 1nkq h SER 460 Ca -0.12 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1nkq h SER 460 Cb 1.50 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1nkq h SER 460 CO 0.08 0.61 0.00 -1.54 -0.53 0.00 0.00 176.83 175.45 1nkq n SER 461 N -4.53 0.00 -0.66 6.23 3.41 -1.26 -2.77 113.62 114.04 1nkq n SER 461 Ca 0.16 -0.40 0.09 0.00 -0.26 0.00 0.00 58.87 58.46 1nkq n SER 461 Cb 0.23 -0.07 0.22 0.00 -0.26 0.00 0.00 64.21 64.33 1nkq n SER 461 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1nkq n TYR 462 N -1.07 0.67 -0.43 7.33 4.02 -0.57 -4.75 117.16 122.37 1nkq n TYR 462 Ca 0.12 -0.89 0.35 0.00 -0.01 0.00 0.00 57.90 57.47 1nkq n TYR 462 Cb 0.07 -0.26 0.65 0.00 -0.02 0.00 0.00 39.34 39.79 1nkq n TYR 462 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1nkq h LYS 463 N 1.34 0.13 -0.18 -0.72 1.57 -1.64 -0.49 116.57 116.58 1nkq h LYS 463 Ca 0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1nkq h LYS 463 Cb 1.29 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.56 1nkq h LYS 463 CO 0.15 0.09 0.10 0.77 -0.57 0.00 0.00 179.45 179.99 1nkq h SER 464 N 0.14 0.21 -0.33 0.86 0.02 -1.86 -3.41 113.55 109.18 1nkq h SER 464 Ca 0.74 -0.01 0.24 0.00 -0.84 0.00 0.00 61.79 61.93 1nkq h SER 464 Cb 2.41 -0.05 -0.22 0.00 0.14 0.00 0.00 62.40 64.67 1nkq h SER 464 CO -0.29 0.17 0.23 0.21 -1.14 0.00 0.00 176.83 176.01 1nkq s ASN 465 N -6.90 -0.35 0.00 3.07 2.47 -0.19 -2.64 114.94 110.41 1nkq s ASN 465 Ca -0.06 0.28 0.25 0.00 0.42 0.00 0.00 52.86 53.75 1nkq s ASN 465 Cb 0.17 1.32 0.45 0.00 -1.45 0.00 0.00 41.25 41.74 1nkq s ASN 465 CO 0.70 -0.07 1.41 0.18 -3.72 0.00 0.00 177.10 175.60 1nkq n LEU 466 N 5.28 2.57 -0.11 3.21 4.77 -1.25 -4.55 117.00 126.91 1nkq n LEU 466 Ca -0.08 -0.87 0.11 0.00 -0.03 0.00 0.00 56.01 55.14 1nkq n LEU 466 Cb 0.54 -0.01 0.47 0.00 -2.33 0.00 0.00 43.42 42.09 1nkq n LEU 466 CO -0.10 0.44 1.20 -0.61 -1.33 0.00 0.00 177.39 176.98 1nkq h GLN 467 N 3.99 0.47 -0.23 3.23 5.75 -1.93 -3.13 115.11 123.26 1nkq h GLN 467 Ca 0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1nkq h GLN 467 Cb 0.85 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1nkq h GLN 467 CO 0.00 0.31 0.00 -0.25 -2.65 0.00 0.00 178.83 176.24 1nkq n ASP 468 N -4.48 3.07 -0.17 -0.69 8.00 -1.26 -3.32 116.55 117.70 1nkq n ASP 468 Ca 0.11 -2.48 0.11 0.00 0.71 0.00 0.00 54.79 53.23 1nkq n ASP 468 Cb 0.36 -0.33 0.01 0.00 -0.02 0.00 0.00 41.12 41.14 1nkq n ASP 468 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1nkq n ILE 469 N -0.21 0.00 -4.25 0.53 -5.35 -1.18 -4.78 119.36 104.11 1nkq n ILE 469 Ca 0.14 -0.09 -0.33 0.00 -0.27 0.00 0.00 62.75 62.20 1nkq n ILE 469 Cb 0.59 0.93 -0.08 0.00 -1.74 0.00 0.00 39.64 39.33 1nkq n ILE 469 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1nkq s PHE 470 N -2.80 3.15 -0.02 4.28 0.40 -1.26 -0.43 117.98 121.30 1nkq s PHE 470 Ca 0.13 0.14 0.03 0.00 -0.60 0.00 0.00 56.93 56.64 1nkq s PHE 470 Cb 0.17 -1.72 -0.00 0.00 0.51 0.00 0.00 43.02 41.98 1nkq s PHE 470 CO 0.73 0.49 -0.12 0.50 0.70 0.00 0.00 175.22 177.51 1nkq s ARG 471 N -1.44 1.17 -0.08 0.44 3.52 -0.10 -0.64 118.95 121.82 1nkq s ARG 471 Ca 0.19 -0.43 0.03 0.00 -0.13 0.00 0.00 55.73 55.38 1nkq s ARG 471 Cb -0.12 -1.08 0.01 0.00 -1.56 0.00 0.00 34.95 32.20 1nkq s ARG 471 CO 0.09 0.21 -0.16 0.54 -0.81 0.00 0.00 175.30 175.17 1nkq s VAL 472 N -0.05 1.47 0.01 7.11 0.11 -0.17 -0.48 120.40 128.41 1nkq s VAL 472 Ca 0.00 -0.67 0.00 0.00 -2.93 0.00 0.00 61.98 58.38 1nkq s VAL 472 Cb -0.08 -1.31 -0.01 0.00 -1.53 0.00 0.00 36.38 33.45 1nkq s VAL 472 CO 0.00 0.43 -0.01 -1.59 -3.33 0.00 0.00 175.10 170.60 1nkq s LYS 473 N 0.61 0.15 -0.01 1.54 -2.85 -0.95 -1.42 119.74 116.81 1nkq s LYS 473 Ca -0.15 -0.29 0.03 0.00 -1.00 0.00 0.00 55.97 54.56 1nkq s LYS 473 Cb -0.16 0.05 -0.01 0.00 -2.06 0.00 0.00 37.83 35.65 1nkq s LYS 473 CO 0.05 -0.02 -0.10 0.00 0.10 0.00 0.00 175.35 175.37 1nkq s SER 475 N -0.27 1.54 -0.17 0.00 0.01 0.84 -1.33 113.70 114.32 1nkq s SER 475 Ca 0.04 -0.55 0.01 0.00 1.31 0.00 0.00 55.95 56.76 1nkq s SER 475 Cb -0.04 -0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.17 1nkq s SER 475 CO -0.00 -0.06 -0.12 -0.69 0.41 0.00 0.00 173.24 172.78 1nkq s VAL 476 N -1.13 1.59 -1.51 3.43 1.01 -0.79 -1.07 120.40 121.94 1nkq s VAL 476 Ca -0.02 -0.81 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 1nkq s VAL 476 Cb -0.09 -1.59 0.08 0.00 0.00 0.00 0.00 36.38 34.78 1nkq s VAL 476 CO 0.02 0.31 0.92 0.59 0.00 0.00 0.00 175.10 176.93 1nkq n ASN 477 N 4.73 -4.88 0.00 3.32 3.02 -0.46 -1.82 115.26 119.17 1nkq n ASN 477 Ca -0.16 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1nkq n ASN 477 Cb 0.48 -3.91 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1nkq n ASN 477 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nkq n GLY 478 N -1.64 0.97 3.46 7.41 0.00 -1.26 -5.03 105.19 109.09 1nkq n GLY 478 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1nkq n GLY 478 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nkq s GLN 479 N -0.30 3.65 0.17 1.61 -0.21 -0.76 -5.06 119.66 118.76 1nkq s GLN 479 Ca 0.00 -0.49 -0.31 0.00 0.02 0.00 0.00 55.36 54.58 1nkq s GLN 479 Cb 0.00 -3.38 -0.09 0.00 1.00 0.00 0.00 33.01 30.54 1nkq s GLN 479 CO 0.00 -0.21 1.47 -1.17 -2.12 0.00 0.00 175.29 173.25 1nkq s LEU 480 N 1.63 4.38 0.00 2.90 2.96 -1.26 -1.89 118.68 127.40 1nkq s LEU 480 Ca 0.06 2.52 0.00 0.00 -0.22 0.00 0.00 54.13 56.50 1nkq s LEU 480 Cb -0.15 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1nkq s LEU 480 CO 0.04 -0.72 0.00 0.54 -1.32 0.00 0.00 176.35 174.89 1nkq n ARG 481 N 3.49 1.63 -4.77 1.98 1.74 -0.44 -4.96 116.66 115.33 1nkq n ARG 481 Ca 0.11 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.94 1nkq n ARG 481 Cb 0.40 -0.96 -0.16 0.00 -1.02 0.00 0.00 32.46 30.72 1nkq n ARG 481 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1nkq s GLN 482 N -1.93 1.46 -0.36 5.56 -0.21 -1.05 -4.37 119.66 118.75 1nkq s GLN 482 Ca 0.00 -0.57 0.07 0.00 0.02 0.00 0.00 55.36 54.88 1nkq s GLN 482 Cb 0.00 -1.35 0.19 0.00 1.00 0.00 0.00 33.01 32.85 1nkq s GLN 482 CO 0.00 0.30 0.61 0.34 -2.12 0.00 0.00 175.29 174.42 1nkq s ASP 483 N -0.19 -1.55 -0.00 5.90 3.68 -1.25 -1.57 116.67 121.69 1nkq s ASP 483 Ca 0.02 -0.39 -0.02 0.00 2.13 0.00 0.00 52.55 54.29 1nkq s ASP 483 Cb -0.08 1.98 -0.00 0.00 -1.45 0.00 0.00 42.92 43.37 1nkq s ASP 483 CO 0.00 -0.22 0.03 -0.83 0.13 0.00 0.00 175.17 174.28 1nkq s GLY 484 N 2.25 0.06 0.31 2.66 0.00 -0.51 -4.97 107.32 107.11 1nkq s GLY 484 Ca 0.14 -0.11 -0.11 0.00 0.00 0.00 0.00 44.72 44.63 1nkq s GLY 484 CO -0.15 -0.16 0.67 -0.32 0.00 0.00 0.00 173.10 173.14 1nkq s GLY 485 N -0.58 2.16 0.10 0.20 0.00 -1.26 -0.99 107.32 106.94 1nkq s GLY 485 Ca -0.06 -0.19 0.16 0.00 0.00 0.00 0.00 44.72 44.62 1nkq s GLY 485 CO -0.00 -0.02 1.48 -1.30 0.00 0.00 0.00 173.10 173.26 1nkq n THR 486 N -0.61 1.11 0.30 0.90 -2.24 0.19 -1.91 114.28 112.02 1nkq n THR 486 Ca 0.02 0.33 0.13 0.00 -2.27 0.00 0.00 64.05 62.25 1nkq n THR 486 Cb 0.53 -1.19 0.59 0.00 -2.10 0.00 0.00 70.33 68.17 1nkq n THR 486 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1nkq h ASN 487 N 0.00 0.00 -2.23 3.42 -1.07 -1.81 -3.45 115.58 110.44 1nkq h ASN 487 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 56.30 55.78 1nkq h ASN 487 Cb 0.22 0.00 -0.11 0.00 -2.07 0.00 0.00 38.32 36.36 1nkq h ASN 487 CO 0.00 0.00 0.97 -0.76 0.07 0.00 0.00 177.43 177.71 1nkq s LEU 488 N -4.78 3.74 0.00 6.14 1.43 -0.80 -5.04 118.68 119.36 1nkq s LEU 488 Ca 0.01 -0.93 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 1nkq s LEU 488 Cb 0.08 -2.51 0.00 0.00 0.03 0.00 0.00 46.19 43.80 1nkq s LEU 488 CO 0.35 -1.60 0.00 0.18 0.23 0.00 0.00 176.35 175.51 1nkq n LEU 490 N 8.56 0.19 -4.21 1.79 4.77 -0.64 -1.07 117.00 126.38 1nkq n LEU 490 Ca 0.08 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.70 1nkq n LEU 490 Cb 0.48 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.45 1nkq n LEU 490 CO 0.66 -0.11 -0.27 -1.00 -1.33 0.00 0.00 177.39 175.34 1nkq s HIS 491 N -1.97 3.31 0.78 -1.77 3.76 -1.26 -5.09 115.29 113.04 1nkq s HIS 491 Ca 0.00 -1.73 -0.14 0.00 -0.15 0.00 0.00 55.06 53.04 1nkq s HIS 491 Cb 0.00 -2.38 0.07 0.00 1.11 0.00 0.00 32.58 31.38 1nkq s HIS 491 CO 0.00 -0.80 1.20 -1.25 -0.85 0.00 0.00 174.74 173.04 1nkq s PRO 492 N 1.31 1.85 0.25 8.40 0.04 -1.26 -4.64 135.00 140.94 1nkq s PRO 492 Ca -0.01 1.72 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 1nkq s PRO 492 Cb -0.20 -1.80 0.33 0.00 0.04 0.00 0.00 34.50 32.86 1nkq s PRO 492 CO 0.00 -2.05 1.51 1.28 0.04 0.00 0.00 177.00 177.79 1nkq n LEU 493 N -3.11 -0.51 -0.06 -3.56 4.32 -1.26 -0.29 117.00 112.53 1nkq n LEU 493 Ca 0.13 1.69 0.01 0.00 -0.02 0.00 0.00 56.01 57.82 1nkq n LEU 493 Cb 0.51 -0.44 0.31 0.00 -1.62 0.00 0.00 43.42 42.18 1nkq n LEU 493 CO 0.48 -1.56 1.08 1.12 -1.22 0.00 0.00 177.39 177.29 1nkq h HIS 494 N 0.00 0.67 -0.18 -1.77 2.07 -1.90 -2.48 115.15 111.56 1nkq h HIS 494 Ca 0.39 -0.02 -0.15 0.00 -2.85 0.00 0.00 60.37 57.75 1nkq h HIS 494 Cb 0.64 -0.21 -0.01 0.00 2.57 0.00 0.00 27.41 30.40 1nkq h HIS 494 CO -0.81 0.51 -0.50 0.87 -3.07 0.00 0.00 177.93 174.92 1nkq h LYS 495 N 0.67 0.49 0.67 5.12 1.57 -0.98 -1.20 116.57 122.92 1nkq h LYS 495 Ca 0.17 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 1nkq h LYS 495 Cb 0.10 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.44 1nkq h LYS 495 CO -0.02 0.88 -0.32 0.82 -0.57 0.00 0.00 179.45 180.24 1nkq h ILE 496 N 0.39 0.23 -0.18 1.86 2.04 -1.01 0.28 117.51 121.12 1nkq h ILE 496 Ca 0.02 -0.22 0.05 0.00 1.00 0.00 0.00 64.86 65.71 1nkq h ILE 496 Cb 1.02 0.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 1nkq h ILE 496 CO 0.09 0.02 -0.24 -0.07 0.00 0.00 0.00 178.15 177.96 1nkq h LEU 497 N -1.08 -0.75 0.47 1.44 3.38 -1.50 -1.45 115.31 115.83 1nkq h LEU 497 Ca -0.09 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1nkq h LEU 497 Cb 0.73 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1nkq h LEU 497 CO 0.15 -0.28 -0.49 -0.61 0.09 0.00 0.00 178.44 177.30 1nkq h GLN 498 N -0.27 -0.93 -0.19 1.13 -0.00 -1.19 -2.67 115.11 110.98 1nkq h GLN 498 Ca 0.12 0.06 0.04 0.00 -0.00 0.00 0.00 58.65 58.87 1nkq h GLN 498 Cb 0.45 0.21 -0.04 0.00 0.00 0.00 0.00 27.48 28.11 1nkq h GLN 498 CO -0.34 -0.62 -0.05 1.25 0.00 0.00 0.00 178.83 179.07 1nkq h HIS 499 N -0.96 -0.10 -0.77 3.99 2.76 -0.82 -2.69 115.15 116.56 1nkq h HIS 499 Ca -0.05 0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.25 1nkq h HIS 499 Cb 0.85 0.08 -0.08 0.00 1.55 0.00 0.00 27.41 29.80 1nkq h HIS 499 CO -0.26 -0.08 0.38 0.82 -1.30 0.00 0.00 177.93 177.49 1nkq h ILE 500 N -0.00 0.79 0.00 6.26 2.04 -1.25 -1.85 117.51 123.49 1nkq h ILE 500 Ca 0.09 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1nkq h ILE 500 Cb 0.14 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1nkq h ILE 500 CO -0.19 0.11 0.13 0.77 0.00 0.00 0.00 178.15 178.97 1nkq h SER 501 N 0.60 0.00 -0.14 1.72 4.64 -1.12 -0.63 113.55 118.63 1nkq h SER 501 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1nkq h SER 501 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1nkq h SER 501 CO -0.31 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.00 1nkq n THR 502 N -2.52 0.32 -1.41 2.95 -2.24 -0.70 0.78 114.28 111.46 1nkq n THR 502 Ca -0.02 -0.23 -0.50 0.00 -2.27 0.00 0.00 64.05 61.03 1nkq n THR 502 Cb 0.17 -0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.23 1nkq n THR 502 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1nkq n ILE 504 N 0.00 0.09 -1.76 2.28 5.41 -0.24 -4.85 119.36 120.29 1nkq n ILE 504 Ca 0.05 -0.20 -0.37 0.00 1.00 0.00 0.00 62.75 63.23 1nkq n ILE 504 Cb 0.23 -1.29 0.06 0.00 -0.71 0.00 0.00 39.64 37.93 1nkq n ILE 504 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1nkq s SER 505 N 7.65 4.76 0.02 4.38 0.01 -1.26 -4.89 113.70 124.36 1nkq s SER 505 Ca 1.15 2.65 0.01 0.00 1.31 0.00 0.00 55.95 61.07 1nkq s SER 505 Cb -1.02 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 62.55 1nkq s SER 505 CO 0.51 -1.91 0.04 -0.76 0.41 0.00 0.00 173.24 171.54 1nkq s LEU 506 N -4.19 3.69 0.14 2.44 1.43 0.12 -4.96 118.68 117.34 1nkq s LEU 506 Ca 0.80 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.96 1nkq s LEU 506 Cb -0.38 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.60 1nkq s LEU 506 CO 0.41 0.25 -0.07 -1.83 0.23 0.00 0.00 176.35 175.34 1nkq s GLU 507 N -1.82 0.99 -0.01 1.70 -1.05 -1.26 -0.86 118.70 116.39 1nkq s GLU 507 Ca 0.23 -1.43 -0.38 0.00 -0.15 0.00 0.00 54.97 53.24 1nkq s GLU 507 Cb -0.12 -0.41 -0.16 0.00 -0.44 0.00 0.00 34.13 33.00 1nkq s GLU 507 CO 0.14 0.00 1.46 -2.30 0.95 0.00 0.00 175.26 175.51 1nkq n PRO 508 N -0.15 1.18 0.00 -4.83 -0.02 -1.24 -2.20 135.00 127.73 1nkq n PRO 508 Ca -0.10 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1nkq n PRO 508 Cb 0.61 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1nkq n PRO 508 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nkq n GLY 509 N 3.01 2.53 3.63 -1.23 0.00 0.19 -4.77 105.19 108.56 1nkq n GLY 509 Ca 0.21 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.77 1nkq n GLY 509 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nkq n ASP 510 N 0.00 2.09 -4.74 1.61 8.00 -0.94 -4.04 116.55 118.54 1nkq n ASP 510 Ca 0.00 1.16 -0.35 0.00 0.71 0.00 0.00 54.79 56.31 1nkq n ASP 510 Cb 0.00 -1.35 -0.08 0.00 -0.02 0.00 0.00 41.12 39.67 1nkq n ASP 510 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1nkq s ILE 511 N -0.47 5.33 -0.17 0.53 1.01 -0.49 -1.32 121.20 125.64 1nkq s ILE 511 Ca 0.65 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.47 1nkq s ILE 511 Cb -0.70 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.39 1nkq s ILE 511 CO 0.54 0.47 -0.10 -0.63 0.00 0.00 0.00 174.94 175.22 1nkq s ILE 512 N 0.18 1.41 -0.23 2.92 1.01 -0.22 -1.61 121.20 124.65 1nkq s ILE 512 Ca 0.08 -0.72 -0.21 0.00 0.00 0.00 0.00 60.65 59.81 1nkq s ILE 512 Cb -0.11 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.88 1nkq s ILE 512 CO -0.01 0.27 0.66 -0.76 0.00 0.00 0.00 174.94 175.10 1nkq s LEU 513 N 1.52 4.09 -0.28 2.97 1.43 -0.87 -0.87 118.68 126.68 1nkq s LEU 513 Ca 0.02 0.80 0.02 0.00 -1.03 0.00 0.00 54.13 53.95 1nkq s LEU 513 Cb -0.15 -2.92 0.41 0.00 0.03 0.00 0.00 46.19 43.57 1nkq s LEU 513 CO -0.09 -0.36 1.57 0.35 0.23 0.00 0.00 176.35 178.05 1nkq n THR 514 N 5.03 2.36 0.00 5.49 -2.24 -0.76 -2.19 114.28 121.96 1nkq n THR 514 Ca 0.00 -1.18 0.00 0.00 -2.27 0.00 0.00 64.05 60.60 1nkq n THR 514 Cb 0.49 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1nkq n THR 514 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nkq n GLY 515 N -0.51 0.45 3.10 3.38 0.00 -1.25 -4.87 105.19 105.49 1nkq n GLY 515 Ca 0.37 -1.77 -0.25 0.00 0.00 0.00 0.00 46.02 44.36 1nkq n GLY 515 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nkq s THR 516 N -2.68 1.31 0.75 2.61 -1.32 -1.26 -4.25 115.64 110.81 1nkq s THR 516 Ca 0.00 -0.64 -0.13 0.00 -1.21 0.00 0.00 61.69 59.72 1nkq s THR 516 Cb 0.00 -1.14 0.19 0.00 -1.51 0.00 0.00 72.50 70.04 1nkq s THR 516 CO 0.00 0.38 0.56 -0.81 -2.21 0.00 0.00 174.62 172.54 1nkq n PRO 517 N 3.29 -2.85 -1.58 7.08 -0.04 -1.26 -4.52 135.00 135.13 1nkq n PRO 517 Ca -0.19 -0.91 -0.31 0.00 -0.04 0.00 0.00 63.50 62.05 1nkq n PRO 517 Cb 0.53 -0.99 0.05 0.00 -0.04 0.00 0.00 33.50 33.05 1nkq n PRO 517 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nkq s ALA 518 N -2.59 2.65 0.00 0.55 0.00 -1.26 -4.56 121.76 116.55 1nkq s ALA 518 Ca 0.39 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1nkq s ALA 518 Cb -0.05 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.88 1nkq s ALA 518 CO 0.31 -1.24 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1nkq n GLY 519 N -1.86 1.80 3.63 0.00 0.00 -1.26 -4.38 105.19 103.11 1nkq n GLY 519 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1nkq n GLY 519 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nkq s VAL 520 N -2.00 3.61 0.53 1.61 1.01 -1.26 -4.40 120.40 119.50 1nkq s VAL 520 Ca 0.00 0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.69 1nkq s VAL 520 Cb 0.00 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1nkq s VAL 520 CO 0.00 -0.29 0.18 -0.83 0.00 0.00 0.00 175.10 174.16 1nkq s GLY 521 N 4.65 2.74 0.40 4.51 0.00 -1.26 -4.92 107.32 113.44 1nkq s GLY 521 Ca 0.74 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 44.66 1nkq s GLY 521 CO 0.31 -2.09 0.69 -0.54 0.00 0.00 0.00 173.10 171.47 1nkq s GLU 522 N -4.06 3.62 -0.05 2.90 2.02 -1.26 -1.34 118.70 120.53 1nkq s GLU 522 Ca 0.18 0.15 0.05 0.00 0.02 0.00 0.00 54.97 55.37 1nkq s GLU 522 Cb -0.00 -2.48 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1nkq s GLU 522 CO 0.11 -0.02 -0.20 -0.51 0.02 0.00 0.00 175.26 174.66 1nkq s LEU 523 N -4.18 1.97 0.16 1.80 1.43 0.11 -4.84 118.68 115.14 1nkq s LEU 523 Ca 0.47 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 53.23 1nkq s LEU 523 Cb -0.10 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 1nkq s LEU 523 CO 0.37 0.19 -0.16 -0.54 0.23 0.00 0.00 176.35 176.43 1nkq s LYS 524 N -0.03 1.21 0.25 1.70 1.02 -1.26 -4.12 119.74 118.52 1nkq s LYS 524 Ca -0.04 -1.39 -0.31 0.00 0.02 0.00 0.00 55.97 54.25 1nkq s LYS 524 Cb -0.12 -1.17 -0.13 0.00 -0.52 0.00 0.00 37.83 35.88 1nkq s LYS 524 CO 0.03 0.23 1.36 -0.35 -0.92 0.00 0.00 175.35 175.69 1nkq n PRO 525 N 0.24 1.97 0.00 -1.68 -0.04 -1.26 -1.39 135.00 132.83 1nkq n PRO 525 Ca -0.13 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 1nkq n PRO 525 Cb 0.58 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1nkq n PRO 525 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nkq n GLY 526 N 1.88 3.29 3.76 0.55 0.00 -0.11 -4.98 105.19 109.58 1nkq n GLY 526 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1nkq n GLY 526 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nkq s ASP 527 N -0.18 6.61 -0.25 1.61 1.01 -0.49 -4.69 116.67 120.30 1nkq s ASP 527 Ca 0.00 2.77 -0.10 0.00 0.71 0.00 0.00 52.55 55.92 1nkq s ASP 527 Cb 0.00 -2.64 -0.05 0.00 1.01 0.00 0.00 42.92 41.24 1nkq s ASP 527 CO 0.00 -0.70 0.16 -0.13 0.21 0.00 0.00 175.17 174.72 1nkq s ARG 528 N -1.16 4.02 -0.18 8.23 0.52 -1.26 -1.84 118.95 127.27 1nkq s ARG 528 Ca 0.55 -0.29 -0.08 0.00 -0.52 0.00 0.00 55.73 55.39 1nkq s ARG 528 Cb -0.43 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.44 1nkq s ARG 528 CO 0.50 -0.01 0.09 0.08 0.02 0.00 0.00 175.30 175.99 1nkq s VAL 529 N 1.26 5.06 -0.15 3.52 1.01 0.17 -1.36 120.40 129.92 1nkq s VAL 529 Ca 0.07 0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 1nkq s VAL 529 Cb -0.14 -3.28 0.03 0.00 0.00 0.00 0.00 36.38 32.98 1nkq s VAL 529 CO 0.06 0.47 -0.09 -2.28 0.00 0.00 0.00 175.10 173.26 1nkq s HIS 530 N 0.23 1.84 0.09 5.22 5.04 -0.23 -0.48 115.29 127.00 1nkq s HIS 530 Ca 0.06 -1.08 0.09 0.00 -1.54 0.00 0.00 55.06 52.59 1nkq s HIS 530 Cb -0.12 -1.40 -0.03 0.00 0.04 0.00 0.00 32.58 31.07 1nkq s HIS 530 CO -0.00 -0.61 -0.23 0.00 -2.34 0.00 0.00 174.74 171.55 1nkq s GLU 532 N -1.69 1.08 -0.04 0.00 2.02 0.65 -4.38 118.70 116.33 1nkq s GLU 532 Ca 0.10 -1.44 -0.02 0.00 0.02 0.00 0.00 54.97 53.63 1nkq s GLU 532 Cb -0.10 -0.69 0.03 0.00 0.10 0.00 0.00 34.13 33.47 1nkq s GLU 532 CO 0.04 0.09 0.05 -1.17 0.02 0.00 0.00 175.26 174.29 1nkq s LEU 533 N -3.11 0.31 0.13 1.80 0.20 -0.65 -2.24 118.68 115.11 1nkq s LEU 533 Ca 0.16 0.05 0.09 0.00 0.69 0.00 0.00 54.13 55.12 1nkq s LEU 533 Cb 0.01 -0.18 -0.04 0.00 -0.43 0.00 0.00 46.19 45.55 1nkq s LEU 533 CO 0.01 -0.23 -0.17 -0.76 -0.29 0.00 0.00 176.35 174.92 1nkq s LEU 534 N 2.02 2.75 -0.24 -0.68 1.02 0.37 -0.25 118.68 123.67 1nkq s LEU 534 Ca 0.03 -0.56 0.02 0.00 0.02 0.00 0.00 54.13 53.64 1nkq s LEU 534 Cb -0.12 -1.57 0.06 0.00 0.02 0.00 0.00 46.19 44.58 1nkq s LEU 534 CO -0.03 0.17 -0.08 -1.58 0.02 0.00 0.00 176.35 174.84 1nkq s GLN 535 N -2.24 1.94 -1.33 1.70 0.74 -0.69 -0.92 119.66 118.86 1nkq s GLN 535 Ca 0.19 -1.11 -0.08 0.00 0.05 0.00 0.00 55.36 54.41 1nkq s GLN 535 Cb -0.10 -2.69 0.01 0.00 1.10 0.00 0.00 33.01 31.33 1nkq s GLN 535 CO 0.11 -0.56 1.16 0.09 -0.55 0.00 0.00 175.29 175.54 1nkq n ASN 536 N 4.58 -6.01 -2.12 6.67 3.02 0.42 -1.99 115.26 119.83 1nkq n ASN 536 Ca -0.13 -0.54 -0.19 0.00 -0.03 0.00 0.00 54.58 53.68 1nkq n ASN 536 Cb 0.44 -4.98 -0.03 0.00 -0.61 0.00 0.00 39.78 34.59 1nkq n ASN 536 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1nkq n ASN 537 N -2.97 -5.44 -4.16 6.41 4.13 -1.26 -4.98 115.26 106.98 1nkq n ASN 537 Ca -0.01 0.17 -0.34 0.00 1.68 0.00 0.00 54.58 56.09 1nkq n ASN 537 Cb 0.57 -4.64 -0.15 0.00 -1.54 0.00 0.00 39.78 34.02 1nkq n ASN 537 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1nkq s ASP 538 N -2.25 3.74 -0.11 6.41 1.11 -0.84 -5.03 116.67 119.70 1nkq s ASP 538 Ca 0.00 -0.75 -0.36 0.00 0.18 0.00 0.00 52.55 51.62 1nkq s ASP 538 Cb 0.00 -1.57 -0.13 0.00 1.07 0.00 0.00 42.92 42.28 1nkq s ASP 538 CO 0.00 -0.06 1.77 -3.20 1.18 0.00 0.00 175.17 174.87 1nkq n ASN 539 N 4.64 2.98 -0.09 0.27 2.85 -1.26 -1.71 115.26 122.93 1nkq n ASN 539 Ca -0.19 1.02 0.02 0.00 -0.11 0.00 0.00 54.58 55.33 1nkq n ASN 539 Cb 0.48 -1.30 0.00 0.00 1.24 0.00 0.00 39.78 40.21 1nkq n ASN 539 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1nkq n ILE 540 N 4.62 0.00 -3.66 -1.44 -5.35 0.65 -4.92 119.36 109.26 1nkq n ILE 540 Ca 0.23 -0.47 -0.07 0.00 -0.27 0.00 0.00 62.75 62.17 1nkq n ILE 540 Cb 0.24 1.05 -0.08 0.00 -1.74 0.00 0.00 39.64 39.11 1nkq n ILE 540 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1nkq s VAL 541 N -0.69 -0.55 -0.00 7.28 1.01 -1.07 -4.98 120.40 121.40 1nkq s VAL 541 Ca 0.03 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1nkq s VAL 541 Cb 0.03 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 1nkq s VAL 541 CO 0.08 0.04 -0.09 -0.62 0.00 0.00 0.00 175.10 174.51 1nkq s ASP 542 N 2.35 1.04 -0.23 3.32 -1.08 -1.26 -1.64 116.67 119.17 1nkq s ASP 542 Ca -0.05 -0.19 -0.30 0.00 -0.52 0.00 0.00 52.55 51.50 1nkq s ASP 542 Cb -0.11 -0.11 0.16 0.00 -1.46 0.00 0.00 42.92 41.41 1nkq s ASP 542 CO -0.15 0.09 1.20 0.20 0.52 0.00 0.00 175.17 177.02 1nkq s ASN 544 N -0.31 -0.19 0.02 -0.34 0.01 -1.26 -5.01 114.94 107.86 1nkq s ASN 544 Ca 0.03 0.21 -0.05 0.00 -0.71 0.00 0.00 52.86 52.34 1nkq s ASN 544 Cb -0.04 0.16 -0.01 0.00 0.41 0.00 0.00 41.25 41.77 1nkq s ASN 544 CO -0.00 -0.17 0.08 -0.36 -1.51 0.00 0.00 177.10 175.13 1nkq s PHE 545 N -1.04 0.16 0.13 2.20 0.40 0.37 -4.57 117.98 115.63 1nkq s PHE 545 Ca 0.04 -0.37 0.07 0.00 -0.60 0.00 0.00 56.93 56.07 1nkq s PHE 545 Cb -0.01 -0.12 -0.04 0.00 0.51 0.00 0.00 43.02 43.36 1nkq s PHE 545 CO -0.04 -0.29 -0.04 -1.21 0.70 0.00 0.00 175.22 174.34 1nkq s GLU 546 N -1.84 2.31 -0.14 0.44 2.02 -1.26 0.41 118.70 120.64 1nkq s GLU 546 Ca -0.12 -1.02 -0.04 0.00 0.02 0.00 0.00 54.97 53.81 1nkq s GLU 546 Cb -0.06 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 1nkq s GLU 546 CO -0.01 0.49 0.01 0.00 0.02 0.00 0.00 175.26 175.77 1nkq s GLU 548 N -0.10 1.07 0.43 0.00 2.02 0.12 -0.93 118.70 121.30 1nkq s GLU 548 Ca 0.04 -1.48 -0.22 0.00 0.02 0.00 0.00 54.97 53.34 1nkq s GLU 548 Cb -0.13 -0.47 -0.10 0.00 0.10 0.00 0.00 34.13 33.53 1nkq s GLU 548 CO 0.02 -0.01 1.00 -0.80 0.02 0.00 0.00 175.26 175.49 1nkq s ASN 549 N -3.17 6.74 -0.15 -0.19 0.01 -1.26 -0.51 114.94 116.41 1nkq s ASN 549 Ca 0.19 1.85 -0.18 0.00 -0.71 0.00 0.00 52.86 54.01 1nkq s ASN 549 Cb 0.04 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 1nkq s ASN 549 CO 0.01 -0.50 0.46 -0.60 -1.51 0.00 0.00 177.10 174.97 1nkq s ARG 550 N -2.97 4.28 0.47 -0.60 3.52 -0.24 -4.64 118.95 118.78 1nkq s ARG 550 Ca 0.62 0.38 -0.08 0.00 -0.13 0.00 0.00 55.73 56.52 1nkq s ARG 550 Cb -0.15 -3.47 0.11 0.00 -1.56 0.00 0.00 34.95 29.88 1nkq s ARG 550 CO 0.19 0.08 0.53 -0.35 -0.81 0.00 0.00 175.30 174.94 1nkq n PRO 551 N 3.99 -1.17 0.00 5.12 -0.04 -1.26 -4.50 135.00 137.13 1nkq n PRO 551 Ca -0.07 -0.83 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 1nkq n PRO 551 Cb 0.51 -0.64 0.00 0.00 -0.04 0.00 0.00 33.50 33.33 1nkq n PRO 551 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nkq n GLY 552 N 0.39 0.47 0.09 0.55 0.00 -1.26 -4.72 105.19 100.71 1nkq n GLY 552 Ca 0.07 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 43.99 1nkq n GLY 552 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1nkq h PRO 553 N 0.00 0.00 -6.65 1.61 0.11 -2.00 -3.47 132.00 121.60 1nkq h PRO 553 Ca 0.00 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.53 1nkq h PRO 553 Cb 0.00 0.00 0.11 0.00 0.11 0.00 0.00 31.00 31.22 1nkq h PRO 553 CO 0.00 0.81 0.41 0.98 -0.21 0.00 0.00 178.00 179.98 1nkq n TYR 554 N -3.37 1.98 -3.30 0.65 9.36 -1.26 -5.00 117.16 116.22 1nkq n TYR 554 Ca 0.00 0.59 -0.06 0.00 3.32 0.00 0.00 57.90 61.75 1nkq n TYR 554 Cb 0.84 -2.37 -0.06 0.00 -0.63 0.00 0.00 39.34 37.11 1nkq n TYR 554 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1nkq s GLU 555 N -1.66 0.41 -0.37 2.98 2.12 -1.26 -4.30 118.70 116.61 1nkq s GLU 555 Ca 0.57 0.64 -0.28 0.00 0.36 0.00 0.00 54.97 56.27 1nkq s GLU 555 Cb -0.61 -0.22 -0.02 0.00 0.26 0.00 0.00 34.13 33.54 1nkq s GLU 555 CO 0.61 -0.65 1.79 0.12 -0.54 0.00 0.00 175.26 176.59 1nkq s PHE 556 N 2.63 1.82 -0.34 5.30 5.36 0.33 -4.92 117.98 128.16 1nkq s PHE 556 Ca 0.15 0.66 0.00 0.00 -0.96 0.00 0.00 56.93 56.78 1nkq s PHE 556 Cb -0.15 -4.13 0.14 0.00 -0.34 0.00 0.00 43.02 38.54 1nkq s PHE 556 CO -0.17 -2.79 0.27 -0.98 -1.46 0.00 0.00 175.22 170.09 1nkq s ARG 557 N 5.83 0.48 0.00 10.12 1.04 -1.26 -4.38 118.95 130.78 1nkq s ARG 557 Ca 0.77 -0.80 0.00 0.00 -1.04 0.00 0.00 55.73 54.66 1nkq s ARG 557 Cb -0.20 -0.94 0.00 0.00 -2.04 0.00 0.00 34.95 31.76 1nkq s ARG 557 CO 0.32 -1.14 0.00 -1.91 -0.04 0.00 0.00 175.30 172.53