#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4x s VAL 302 N 0.00 2.77 -0.05 6.31 1.01 -1.26 -4.73 120.40 124.45 1n4x s VAL 302 Ca 0.00 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.69 1n4x s VAL 302 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.95 1n4x s VAL 302 CO 0.00 0.13 -0.07 -1.10 0.00 0.00 0.00 175.10 174.06 1n4x s GLN 303 N -0.93 1.07 -0.25 2.72 -0.21 -1.05 -5.02 119.66 115.98 1n4x s GLN 303 Ca 0.54 -0.22 0.02 0.00 0.02 0.00 0.00 55.36 55.73 1n4x s GLN 303 Cb -0.40 -0.98 0.06 0.00 1.00 0.00 0.00 33.01 32.69 1n4x s GLN 303 CO 0.47 -0.02 -0.08 -0.51 -2.12 0.00 0.00 175.29 173.03 1n4x s LEU 304 N 0.71 3.09 -0.25 2.90 1.43 -1.26 -1.44 118.68 123.86 1n4x s LEU 304 Ca -0.11 -1.33 -0.08 0.00 -1.03 0.00 0.00 54.13 51.58 1n4x s LEU 304 Cb -0.14 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.67 1n4x s LEU 304 CO 0.01 -0.22 0.09 -1.58 0.23 0.00 0.00 176.35 174.88 1n4x s GLN 305 N 1.23 3.72 0.30 1.70 2.00 0.09 -3.82 119.66 124.87 1n4x s GLN 305 Ca -0.07 -0.45 0.06 0.00 -2.00 0.00 0.00 55.36 52.91 1n4x s GLN 305 Cb -0.19 -3.37 -0.02 0.00 0.80 0.00 0.00 33.01 30.22 1n4x s GLN 305 CO -0.06 -0.16 0.36 -0.65 -0.50 0.00 0.00 175.29 174.28 1n4x s GLN 306 N 1.57 3.09 0.92 1.67 -0.21 -1.26 0.35 119.66 125.79 1n4x s GLN 306 Ca 0.06 -1.01 -0.12 0.00 0.02 0.00 0.00 55.36 54.31 1n4x s GLN 306 Cb -0.15 -2.72 0.14 0.00 1.00 0.00 0.00 33.01 31.28 1n4x s GLN 306 CO 0.05 0.22 1.10 -1.54 -2.12 0.00 0.00 175.29 173.00 1n4x s SER 307 N -4.03 3.35 1.01 5.90 1.04 -0.78 -4.98 113.70 115.21 1n4x s SER 307 Ca 0.39 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 57.94 1n4x s SER 307 Cb -0.08 -1.91 0.19 0.00 0.10 0.00 0.00 66.02 64.32 1n4x s SER 307 CO 0.29 -2.68 1.10 -0.83 0.98 0.00 0.00 173.24 172.09 1n4x s GLY 308 N -3.64 1.56 0.67 7.32 0.00 -1.26 -4.65 107.32 107.32 1n4x s GLY 308 Ca 0.64 -0.41 -0.17 0.00 0.00 0.00 0.00 44.72 44.77 1n4x s GLY 308 CO 0.56 0.21 1.26 -1.55 0.00 0.00 0.00 173.10 173.58 1n4x n PRO 309 N -4.19 0.94 -4.80 2.90 -0.04 -1.26 -4.77 135.00 123.79 1n4x n PRO 309 Ca 0.05 0.38 -0.26 0.00 -0.04 0.00 0.00 63.50 63.64 1n4x n PRO 309 Cb 0.58 -2.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.38 1n4x n PRO 309 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1n4x s GLU 310 N -3.46 1.72 -0.31 0.54 0.41 -0.12 -4.98 118.70 112.50 1n4x s GLU 310 Ca 0.81 -0.58 0.00 0.00 -0.41 0.00 0.00 54.97 54.79 1n4x s GLU 310 Cb -0.37 -1.50 0.07 0.00 -1.78 0.00 0.00 34.13 30.55 1n4x s GLU 310 CO 0.42 0.23 -0.00 -1.17 -0.49 0.00 0.00 175.26 174.25 1n4x s LEU 311 N 0.05 4.03 0.20 1.80 0.20 -1.26 -0.84 118.68 122.87 1n4x s LEU 311 Ca -0.04 -1.50 0.11 0.00 0.69 0.00 0.00 54.13 53.39 1n4x s LEU 311 Cb -0.11 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.93 1n4x s LEU 311 CO 0.02 -0.29 -0.23 -0.54 -0.29 0.00 0.00 176.35 175.02 1n4x s LYS 312 N 1.15 1.53 0.21 1.98 -0.14 -0.08 -4.99 119.74 119.40 1n4x s LYS 312 Ca -0.03 -1.55 -0.09 0.00 -1.36 0.00 0.00 55.97 52.94 1n4x s LYS 312 Cb -0.20 -1.81 -0.07 0.00 -1.68 0.00 0.00 37.83 34.07 1n4x s LYS 312 CO -0.03 0.38 0.52 0.21 -0.76 0.00 0.00 175.35 175.67 1n4x s LYS 313 N -2.79 3.77 0.46 1.68 2.20 -1.26 -1.88 119.74 121.92 1n4x s LYS 313 Ca 0.22 0.20 -0.24 0.00 -0.36 0.00 0.00 55.97 55.79 1n4x s LYS 313 Cb -0.07 -2.68 -0.09 0.00 -1.51 0.00 0.00 37.83 33.47 1n4x s LYS 313 CO 0.10 0.34 1.14 -2.30 -0.36 0.00 0.00 175.35 174.27 1n4x n PRO 314 N -0.11 1.54 0.00 4.03 -0.02 -1.26 -2.23 135.00 136.95 1n4x n PRO 314 Ca -0.00 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1n4x n PRO 314 Cb 0.52 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1n4x n PRO 314 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n4x n GLY 315 N 1.02 2.64 3.91 -1.23 0.00 0.28 -4.90 105.19 106.91 1n4x n GLY 315 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1n4x n GLY 315 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n4x s GLU 316 N -0.34 1.00 0.06 1.61 2.02 -0.95 -4.01 118.70 118.09 1n4x s GLU 316 Ca 0.00 -0.23 0.07 0.00 0.02 0.00 0.00 54.97 54.83 1n4x s GLU 316 Cb 0.00 -1.87 -0.04 0.00 0.10 0.00 0.00 34.13 32.32 1n4x s GLU 316 CO 0.00 -2.20 -0.13 0.99 0.02 0.00 0.00 175.26 173.94 1n4x s THR 317 N -3.76 3.16 -0.00 3.63 2.01 -1.26 -1.06 115.64 118.35 1n4x s THR 317 Ca 0.70 -1.17 0.03 0.00 0.31 0.00 0.00 61.69 61.55 1n4x s THR 317 Cb -0.06 -2.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 1n4x s THR 317 CO 0.52 0.24 -0.09 0.54 -0.69 0.00 0.00 174.62 175.14 1n4x s VAL 318 N -1.06 0.70 -0.19 3.82 0.11 -0.53 -4.99 120.40 118.25 1n4x s VAL 318 Ca 0.18 -0.41 -0.00 0.00 -2.93 0.00 0.00 61.98 58.82 1n4x s VAL 318 Cb -0.11 -0.59 0.05 0.00 -1.53 0.00 0.00 36.38 34.20 1n4x s VAL 318 CO 0.09 0.18 -0.05 -0.75 -3.33 0.00 0.00 175.10 171.24 1n4x s LYS 319 N -0.27 1.47 -0.08 1.54 2.20 -1.26 -0.49 119.74 122.85 1n4x s LYS 319 Ca 0.03 -0.65 -0.11 0.00 -0.36 0.00 0.00 55.97 54.88 1n4x s LYS 319 Cb -0.04 -2.20 -0.05 0.00 -1.51 0.00 0.00 37.83 34.04 1n4x s LYS 319 CO -0.00 -0.49 0.27 0.42 -0.36 0.00 0.00 175.35 175.19 1n4x s ILE 320 N 1.57 5.28 0.19 5.43 1.01 0.29 -4.94 121.20 130.04 1n4x s ILE 320 Ca -0.01 0.51 0.09 0.00 0.00 0.00 0.00 60.65 61.24 1n4x s ILE 320 Cb -0.16 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 1n4x s ILE 320 CO -0.07 0.57 -0.09 -0.94 0.00 0.00 0.00 174.94 174.41 1n4x s SER 321 N -0.82 4.27 -0.23 3.58 1.04 -1.26 -0.91 113.70 119.37 1n4x s SER 321 Ca 0.19 -0.59 -0.05 0.00 0.48 0.00 0.00 55.95 55.98 1n4x s SER 321 Cb -0.14 -0.73 0.08 0.00 0.10 0.00 0.00 66.02 65.33 1n4x s SER 321 CO 0.08 0.09 0.11 0.00 0.98 0.00 0.00 173.24 174.50 1n4x s LYS 323 N 2.12 4.10 -0.10 0.00 2.47 0.15 -0.82 119.74 127.67 1n4x s LYS 323 Ca 0.05 0.54 -0.08 0.00 -1.56 0.00 0.00 55.97 54.93 1n4x s LYS 323 Cb -0.16 -3.65 -0.04 0.00 -1.46 0.00 0.00 37.83 32.51 1n4x s LYS 323 CO -0.22 -0.42 0.18 0.00 0.16 0.00 0.00 175.35 175.04 1n4x s ALA 324 N 2.52 3.86 0.02 3.13 0.00 0.15 -0.73 121.76 130.71 1n4x s ALA 324 Ca 0.26 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.62 1n4x s ALA 324 Cb -0.15 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 20.92 1n4x s ALA 324 CO 0.09 0.61 -0.01 0.99 0.00 0.00 0.00 175.76 177.43 1n4x s THR 325 N -1.06 0.12 -0.45 0.00 2.01 -0.52 -4.81 115.64 110.93 1n4x s THR 325 Ca 0.17 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.20 1n4x s THR 325 Cb -0.13 -0.40 0.00 0.00 0.01 0.00 0.00 72.50 71.98 1n4x s THR 325 CO 0.06 -0.53 0.00 0.59 -0.69 0.00 0.00 174.62 174.05 1n4x n ASN 326 N 1.44 -2.26 -3.58 3.53 4.13 -1.26 -2.53 115.26 114.73 1n4x n ASN 326 Ca -0.23 -0.00 -0.06 0.00 1.68 0.00 0.00 54.58 55.97 1n4x n ASN 326 Cb 0.56 -1.61 -0.03 0.00 -1.54 0.00 0.00 39.78 37.16 1n4x n ASN 326 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 1n4x s TYR 327 N -2.26 -0.22 -0.44 3.10 -0.85 -1.26 -4.70 117.35 110.73 1n4x s TYR 327 Ca 0.00 0.26 -0.28 0.00 -0.52 0.00 0.00 57.07 56.52 1n4x s TYR 327 Cb 0.00 0.50 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1n4x s TYR 327 CO 0.00 -0.27 1.50 0.00 -1.52 0.00 0.00 175.55 175.27 1n4x s ALA 328 N -1.89 2.92 0.29 9.51 0.00 -1.26 -4.89 121.76 126.44 1n4x s ALA 328 Ca 0.05 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 51.82 1n4x s ALA 328 Cb -0.01 -4.01 0.71 0.00 0.00 0.00 0.00 23.12 19.82 1n4x s ALA 328 CO -0.04 -2.62 1.64 0.35 0.00 0.00 0.00 175.76 175.09 1n4x h PHE 329 N 11.37 0.34 0.00 0.00 3.57 -1.93 -0.01 116.94 130.28 1n4x h PHE 329 Ca -0.28 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1n4x h PHE 329 Cb 1.12 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.85 1n4x h PHE 329 CO 0.98 -0.22 0.00 0.25 -2.23 0.00 0.00 178.31 177.10 1n4x n THR 330 N -5.23 0.00 0.42 4.41 -2.24 -1.26 -3.26 114.28 107.12 1n4x n THR 330 Ca 0.21 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.11 1n4x n THR 330 Cb 0.68 -0.50 0.06 0.00 -2.10 0.00 0.00 70.33 68.47 1n4x n THR 330 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1n4x n ASP 331 N -0.95 0.67 -4.08 3.42 8.00 -0.02 -4.09 116.55 119.50 1n4x n ASP 331 Ca 0.19 0.05 -0.19 0.00 0.71 0.00 0.00 54.79 55.55 1n4x n ASP 331 Cb 0.09 0.55 -0.14 0.00 -0.02 0.00 0.00 41.12 41.60 1n4x n ASP 331 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1n4x s TYR 332 N -3.25 1.02 0.65 1.24 1.51 -1.20 -4.88 117.35 112.44 1n4x s TYR 332 Ca 0.03 -0.27 -0.14 0.00 -1.01 0.00 0.00 57.07 55.68 1n4x s TYR 332 Cb 0.13 -0.63 -0.01 0.00 -0.11 0.00 0.00 41.96 41.34 1n4x s TYR 332 CO 0.78 -0.00 1.08 -1.12 -1.11 0.00 0.00 175.55 175.18 1n4x s SER 333 N -0.69 5.33 -0.17 2.29 0.01 -1.26 -4.41 113.70 114.80 1n4x s SER 333 Ca 0.02 1.86 -0.03 0.00 1.31 0.00 0.00 55.95 59.11 1n4x s SER 333 Cb -0.06 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 1n4x s SER 333 CO 0.00 -1.48 -0.06 -0.32 0.41 0.00 0.00 173.24 171.80 1n4x s MET 334 N -4.30 3.52 0.22 12.44 1.75 -0.83 -4.56 119.30 127.54 1n4x s MET 334 Ca 0.64 -0.59 0.05 0.00 -1.25 0.00 0.00 55.69 54.54 1n4x s MET 334 Cb -0.18 -2.88 -0.03 0.00 2.84 0.00 0.00 34.83 34.58 1n4x s MET 334 CO 0.43 0.10 0.25 -1.01 -0.65 0.00 0.00 175.02 174.14 1n4x s HIS 335 N 0.71 3.28 -0.03 4.11 3.76 0.32 -1.39 115.29 126.05 1n4x s HIS 335 Ca -0.03 -0.03 0.02 0.00 -0.15 0.00 0.00 55.06 54.87 1n4x s HIS 335 Cb -0.15 -1.51 0.01 0.00 1.11 0.00 0.00 32.58 32.04 1n4x s HIS 335 CO 0.02 0.49 -0.09 -1.58 -0.85 0.00 0.00 174.74 172.73 1n4x s TRP 336 N -1.97 0.98 0.02 1.40 0.52 -0.55 -0.26 118.94 119.08 1n4x s TRP 336 Ca 0.33 -0.26 0.06 0.00 0.02 0.00 0.00 56.10 56.26 1n4x s TRP 336 Cb -0.09 -0.71 -0.02 0.00 -1.15 0.00 0.00 33.47 31.50 1n4x s TRP 336 CO 0.27 -0.12 -0.19 0.08 0.02 0.00 0.00 176.95 177.01 1n4x s VAL 337 N 0.29 1.50 -0.21 4.03 1.01 0.16 -1.06 120.40 126.12 1n4x s VAL 337 Ca -0.05 -1.01 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 1n4x s VAL 337 Cb -0.10 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 1n4x s VAL 337 CO 0.01 0.26 0.02 -0.75 0.00 0.00 0.00 175.10 174.64 1n4x s LYS 338 N -0.88 3.66 -0.34 2.72 2.20 0.70 -0.72 119.74 127.08 1n4x s LYS 338 Ca 0.06 -0.49 -0.06 0.00 -0.36 0.00 0.00 55.97 55.12 1n4x s LYS 338 Cb -0.08 -3.15 0.04 0.00 -1.51 0.00 0.00 37.83 33.13 1n4x s LYS 338 CO 0.01 -0.02 0.11 -1.14 -0.36 0.00 0.00 175.35 173.96 1n4x s GLN 339 N 1.10 2.60 0.60 4.03 0.74 0.26 -0.46 119.66 128.53 1n4x s GLN 339 Ca 0.03 -1.22 -0.10 0.00 0.05 0.00 0.00 55.36 54.12 1n4x s GLN 339 Cb -0.14 -3.48 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 1n4x s GLN 339 CO 0.02 -0.69 0.99 0.00 -0.55 0.00 0.00 175.29 175.06 1n4x s ALA 340 N 1.39 3.15 0.26 1.58 0.00 -0.40 -1.00 121.76 126.74 1n4x s ALA 340 Ca -0.01 -0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.46 1n4x s ALA 340 Cb -0.20 -2.98 -0.13 0.00 0.00 0.00 0.00 23.12 19.81 1n4x s ALA 340 CO 0.02 -0.66 1.35 -2.30 0.00 0.00 0.00 175.76 174.17 1n4x n PRO 341 N -2.68 1.95 0.00 0.00 -0.02 -1.26 -0.57 135.00 132.43 1n4x n PRO 341 Ca 0.05 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1n4x n PRO 341 Cb 0.54 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1n4x n PRO 341 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n4x n GLY 342 N 1.84 2.32 0.00 -1.23 0.00 -1.26 -4.60 105.19 102.26 1n4x n GLY 342 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1n4x n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n4x n GLY 343 N -0.49 0.47 3.77 -0.02 0.00 0.27 -5.08 105.19 104.11 1n4x n GLY 343 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1n4x n GLY 343 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n4x s ASP 344 N -2.00 6.41 -0.15 1.61 2.15 -1.24 -4.74 116.67 118.71 1n4x s ASP 344 Ca 0.00 2.97 -0.03 0.00 0.43 0.00 0.00 52.55 55.92 1n4x s ASP 344 Cb 0.00 -2.66 -0.02 0.00 -0.30 0.00 0.00 42.92 39.94 1n4x s ASP 344 CO 0.00 -0.84 -0.05 -0.76 -0.17 0.00 0.00 175.17 173.35 1n4x s LEU 345 N -1.59 3.16 -0.07 -1.34 1.43 -1.26 -1.27 118.68 117.74 1n4x s LEU 345 Ca 0.55 -0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.51 1n4x s LEU 345 Cb -0.46 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.01 1n4x s LEU 345 CO 0.57 0.16 -0.15 -0.54 0.23 0.00 0.00 176.35 176.63 1n4x s LYS 346 N 0.40 1.93 0.06 1.70 -0.14 0.39 -4.96 119.74 119.12 1n4x s LYS 346 Ca -0.05 -0.53 -0.31 0.00 -1.36 0.00 0.00 55.97 53.73 1n4x s LYS 346 Cb -0.14 -1.58 -0.06 0.00 -1.68 0.00 0.00 37.83 34.37 1n4x s LYS 346 CO 0.03 0.10 1.21 -0.47 -0.76 0.00 0.00 175.35 175.46 1n4x s TYR 347 N 0.48 3.42 -0.21 3.18 5.04 -1.26 -0.22 117.35 127.79 1n4x s TYR 347 Ca -0.13 1.28 -0.18 0.00 -2.44 0.00 0.00 57.07 55.60 1n4x s TYR 347 Cb -0.15 -3.44 -0.19 0.00 0.35 0.00 0.00 41.96 38.53 1n4x s TYR 347 CO 0.04 -1.35 0.15 0.28 -1.34 0.00 0.00 175.55 173.34 1n4x n VAL 348 N 3.95 1.57 -3.28 3.14 0.31 -0.23 -4.63 118.33 119.16 1n4x n VAL 348 Ca 0.09 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1n4x n VAL 348 Cb 0.46 -1.96 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 1n4x n VAL 348 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n4x n GLY 349 N 1.52 -0.62 3.17 2.92 0.00 -1.20 -0.33 105.19 110.65 1n4x n GLY 349 Ca -0.35 -1.31 -0.08 0.00 0.00 0.00 0.00 46.02 44.27 1n4x n GLY 349 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1n4x s TRP 350 N -2.90 0.24 -0.07 1.61 1.48 0.04 -1.49 118.94 117.86 1n4x s TRP 350 Ca 0.00 -0.70 0.05 0.00 -1.06 0.00 0.00 56.10 54.39 1n4x s TRP 350 Cb 0.00 -0.14 -0.00 0.00 -1.16 0.00 0.00 33.47 32.16 1n4x s TRP 350 CO 0.00 -0.50 -0.22 -1.50 -4.06 0.00 0.00 176.95 170.68 1n4x s ILE 351 N -3.81 1.84 -0.30 0.66 2.07 -0.49 -0.91 121.20 120.25 1n4x s ILE 351 Ca 0.05 -0.93 -0.29 0.00 -1.41 0.00 0.00 60.65 58.07 1n4x s ILE 351 Cb 0.05 -1.58 0.01 0.00 0.13 0.00 0.00 42.46 41.08 1n4x s ILE 351 CO -0.10 0.51 1.14 0.21 -1.91 0.00 0.00 174.94 174.79 1n4x s ASN 352 N 0.09 6.88 0.12 4.50 3.84 -0.00 -1.97 114.94 128.39 1n4x s ASN 352 Ca -0.09 1.15 0.26 0.00 0.21 0.00 0.00 52.86 54.39 1n4x s ASN 352 Cb -0.15 -2.54 0.96 0.00 -0.55 0.00 0.00 41.25 38.97 1n4x s ASN 352 CO 0.05 -0.91 1.79 0.35 -2.79 0.00 0.00 177.10 175.59 1n4x n THR 353 N 5.89 0.46 -0.02 -5.21 -2.24 -1.26 0.49 114.28 112.39 1n4x n THR 353 Ca 0.13 -0.06 -0.15 0.00 -2.27 0.00 0.00 64.05 61.70 1n4x n THR 353 Cb 0.47 -0.68 -0.14 0.00 -2.10 0.00 0.00 70.33 67.88 1n4x n THR 353 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1n4x n GLU 354 N -1.91 0.70 -0.00 -0.78 4.07 -1.26 -4.42 120.64 117.03 1n4x n GLU 354 Ca 0.05 0.26 0.07 0.00 -0.06 0.00 0.00 57.16 57.48 1n4x n GLU 354 Cb 0.34 -1.73 -0.08 0.00 -0.06 0.00 0.00 31.44 29.91 1n4x n GLU 354 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1n4x n THR 355 N -3.25 0.00 -3.10 6.31 -2.24 -1.21 -5.01 114.28 105.79 1n4x n THR 355 Ca -0.26 -0.19 -0.21 0.00 -2.27 0.00 0.00 64.05 61.12 1n4x n THR 355 Cb 1.05 0.89 0.04 0.00 -2.10 0.00 0.00 70.33 70.21 1n4x n THR 355 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1n4x n ASP 356 N -1.42 -5.86 -4.48 3.42 2.03 0.18 -5.00 116.55 105.42 1n4x n ASP 356 Ca 0.02 -0.32 -0.34 0.00 0.52 0.00 0.00 54.79 54.67 1n4x n ASP 356 Cb 0.24 -4.63 -0.12 0.00 -0.72 0.00 0.00 41.12 35.88 1n4x n ASP 356 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1n4x s GLU 357 N -5.76 3.63 0.24 -0.67 0.41 -1.18 -4.89 118.70 110.47 1n4x s GLU 357 Ca 0.35 -0.54 -0.05 0.00 -0.41 0.00 0.00 54.97 54.31 1n4x s GLU 357 Cb -0.15 -2.87 -0.05 0.00 -1.78 0.00 0.00 34.13 29.27 1n4x s GLU 357 CO 0.43 0.23 0.49 -1.25 -0.49 0.00 0.00 175.26 174.67 1n4x s PRO 358 N 0.37 3.64 -0.04 0.39 0.04 -1.26 -0.82 135.00 137.32 1n4x s PRO 358 Ca -0.05 -0.03 -0.01 0.00 0.04 0.00 0.00 61.00 60.95 1n4x s PRO 358 Cb -0.14 -2.72 0.03 0.00 0.04 0.00 0.00 34.50 31.71 1n4x s PRO 358 CO 0.03 0.31 0.06 0.99 0.04 0.00 0.00 177.00 178.43 1n4x s THR 359 N -1.92 -0.10 0.23 1.26 2.01 -0.09 -4.99 115.64 112.03 1n4x s THR 359 Ca 0.43 0.35 0.08 0.00 0.31 0.00 0.00 61.69 62.86 1n4x s THR 359 Cb -0.11 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.22 1n4x s THR 359 CO 0.27 0.15 0.06 -0.36 -0.69 0.00 0.00 174.62 174.05 1n4x s PHE 360 N 1.80 2.88 0.29 4.92 0.08 -1.26 -0.78 117.98 125.90 1n4x s PHE 360 Ca 0.00 -0.15 0.07 0.00 0.12 0.00 0.00 56.93 56.96 1n4x s PHE 360 Cb -0.12 -1.32 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 1n4x s PHE 360 CO -0.03 0.56 0.31 0.00 -0.10 0.00 0.00 175.22 175.95 1n4x s ALA 361 N -2.05 3.85 0.00 5.36 0.00 0.56 -4.92 121.76 124.55 1n4x s ALA 361 Ca 0.30 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1n4x s ALA 361 Cb -0.08 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.61 1n4x s ALA 361 CO 0.21 0.13 0.00 -3.47 0.00 0.00 0.00 175.76 172.63 1n4x n ASP 362 N -1.36 0.00 0.00 0.00 4.64 -1.26 -1.42 116.55 117.15 1n4x n ASP 362 Ca -0.05 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.36 1n4x n ASP 362 Cb 0.58 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.66 1n4x n ASP 362 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 1n4x n ASP 363 N 0.00 0.00 0.27 1.67 8.00 -1.26 -4.77 116.55 120.45 1n4x n ASP 363 Ca 0.00 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.64 1n4x n ASP 363 Cb 0.00 -1.46 0.74 0.00 -0.02 0.00 0.00 41.12 40.38 1n4x n ASP 363 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1n4x h PHE 364 N 0.00 0.00 -0.83 1.24 0.04 -1.56 -3.06 116.94 112.77 1n4x h PHE 364 Ca 0.00 0.00 0.22 0.00 2.80 0.00 0.00 57.97 60.99 1n4x h PHE 364 Cb 0.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 1n4x h PHE 364 CO 0.00 0.11 0.58 -0.22 -0.60 0.00 0.00 178.31 178.18 1n4x h LYS 365 N 0.00 0.13 0.00 1.51 1.63 -1.86 -3.02 116.57 114.95 1n4x h LYS 365 Ca -0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1n4x h LYS 365 Cb 0.38 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.98 1n4x h LYS 365 CO 0.01 0.09 0.00 0.41 -3.45 0.00 0.00 179.45 176.51 1n4x n GLY 366 N -1.64 -3.38 0.73 5.01 0.00 -1.16 -4.26 105.19 100.50 1n4x n GLY 366 Ca 0.17 0.47 0.10 0.00 0.00 0.00 0.00 46.02 46.76 1n4x n GLY 366 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n4x n ARG 367 N -0.88 1.68 -3.72 1.61 1.74 -1.25 -4.97 116.66 110.87 1n4x n ARG 367 Ca 0.00 -1.56 -0.35 0.00 -0.77 0.00 0.00 57.85 55.17 1n4x n ARG 367 Cb 0.00 -1.37 -0.05 0.00 -1.02 0.00 0.00 32.46 30.02 1n4x n ARG 367 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1n4x s PHE 368 N -1.68 3.60 -0.06 -1.55 0.40 -1.14 -1.78 117.98 115.77 1n4x s PHE 368 Ca 0.22 0.64 -0.03 0.00 -0.60 0.00 0.00 56.93 57.16 1n4x s PHE 368 Cb 0.16 -2.04 0.03 0.00 0.51 0.00 0.00 43.02 41.69 1n4x s PHE 368 CO 0.27 0.62 0.15 0.00 0.70 0.00 0.00 175.22 176.96 1n4x s ALA 369 N -1.25 -0.29 0.00 5.36 0.00 -0.37 -4.77 121.76 120.45 1n4x s ALA 369 Ca 0.26 0.65 -0.06 0.00 0.00 0.00 0.00 51.96 52.80 1n4x s ALA 369 Cb -0.14 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 1n4x s ALA 369 CO 0.14 -0.14 0.26 -0.06 0.00 0.00 0.00 175.76 175.96 1n4x s PHE 370 N 1.00 3.58 0.23 0.00 0.08 -1.26 -0.75 117.98 120.86 1n4x s PHE 370 Ca -0.08 0.57 -0.09 0.00 0.12 0.00 0.00 56.93 57.44 1n4x s PHE 370 Cb -0.10 -1.98 -0.01 0.00 -0.57 0.00 0.00 43.02 40.35 1n4x s PHE 370 CO -0.05 0.62 0.38 -1.54 -0.10 0.00 0.00 175.22 174.52 1n4x s SER 371 N -1.69 -0.02 0.09 1.36 1.04 -0.79 -4.94 113.70 108.75 1n4x s SER 371 Ca 0.27 -1.05 -0.03 0.00 0.48 0.00 0.00 55.95 55.62 1n4x s SER 371 Cb -0.13 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.48 1n4x s SER 371 CO 0.16 -1.05 0.05 -0.76 0.98 0.00 0.00 173.24 172.62 1n4x s LEU 372 N -3.06 1.99 -0.38 2.42 1.43 -1.26 -0.65 118.68 119.17 1n4x s LEU 372 Ca 0.27 -1.00 0.02 0.00 -1.03 0.00 0.00 54.13 52.38 1n4x s LEU 372 Cb 0.02 0.44 0.15 0.00 0.03 0.00 0.00 46.19 46.82 1n4x s LEU 372 CO 0.10 -0.68 0.27 -0.62 0.23 0.00 0.00 176.35 175.64 1n4x s ASP 373 N -2.95 2.29 0.44 2.29 -1.08 -0.12 -4.98 116.67 112.56 1n4x s ASP 373 Ca 0.13 -2.57 0.10 0.00 -0.52 0.00 0.00 52.55 49.69 1n4x s ASP 373 Cb 0.07 -0.42 0.98 0.00 -1.46 0.00 0.00 42.92 42.09 1n4x s ASP 373 CO -0.06 -0.25 2.07 0.71 0.52 0.00 0.00 175.17 178.17 1n4x h THR 374 N 4.85 1.08 0.00 1.71 1.35 -1.95 -0.84 112.91 119.11 1n4x h THR 374 Ca 0.15 -0.20 -0.04 0.00 -0.55 0.00 0.00 66.41 65.77 1n4x h THR 374 Cb 0.94 0.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.09 1n4x h THR 374 CO 0.31 0.09 -0.20 0.77 -0.25 0.00 0.00 175.52 176.23 1n4x h SER 375 N 0.35 0.00 -0.32 5.36 4.64 -1.95 -2.44 113.55 119.18 1n4x h SER 375 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1n4x h SER 375 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1n4x h SER 375 CO -0.02 0.20 0.00 0.35 -0.87 0.00 0.00 176.83 176.50 1n4x n THR 376 N -3.87 1.35 -4.09 2.95 -2.24 -0.75 -4.98 114.28 102.65 1n4x n THR 376 Ca -0.02 -1.24 -0.27 0.00 -2.27 0.00 0.00 64.05 60.25 1n4x n THR 376 Cb 0.30 0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 1n4x n THR 376 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1n4x n SER 377 N 0.24 0.19 -4.16 3.42 7.64 -0.40 -4.71 113.62 115.83 1n4x n SER 377 Ca 0.14 -1.11 -0.25 0.00 1.01 0.00 0.00 58.87 58.65 1n4x n SER 377 Cb 0.55 -2.49 -0.16 0.00 -1.01 0.00 0.00 64.21 61.11 1n4x n SER 377 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1n4x s THR 378 N -4.13 1.42 0.09 0.44 2.01 -0.71 -0.68 115.64 114.08 1n4x s THR 378 Ca 0.00 -0.75 0.06 0.00 0.31 0.00 0.00 61.69 61.31 1n4x s THR 378 Cb -0.00 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 1n4x s THR 378 CO 0.93 0.40 -0.06 0.00 -0.69 0.00 0.00 174.62 175.21 1n4x s ALA 379 N -0.29 3.09 0.07 7.40 0.00 0.00 -0.94 121.76 131.09 1n4x s ALA 379 Ca 0.04 -1.18 0.06 0.00 0.00 0.00 0.00 51.96 50.87 1n4x s ALA 379 Cb -0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 1n4x s ALA 379 CO 0.00 0.66 -0.15 -0.06 0.00 0.00 0.00 175.76 176.21 1n4x s PHE 380 N -1.24 1.32 -0.15 0.00 0.08 0.17 -0.33 117.98 117.84 1n4x s PHE 380 Ca 0.23 -0.44 -0.00 0.00 0.12 0.00 0.00 56.93 56.84 1n4x s PHE 380 Cb -0.11 -0.75 0.03 0.00 -0.57 0.00 0.00 43.02 41.62 1n4x s PHE 380 CO 0.15 0.08 -0.09 -1.17 -0.10 0.00 0.00 175.22 174.09 1n4x s LEU 381 N -1.69 1.55 -0.11 -0.37 2.96 -0.09 -1.88 118.68 119.05 1n4x s LEU 381 Ca -0.00 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.40 1n4x s LEU 381 Cb -0.10 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.58 1n4x s LEU 381 CO 0.02 -0.12 -0.11 -1.58 -1.32 0.00 0.00 176.35 173.24 1n4x s GLN 382 N 1.60 3.14 -0.21 1.98 0.74 0.07 -0.55 119.66 126.43 1n4x s GLN 382 Ca 0.03 -0.65 -0.01 0.00 0.05 0.00 0.00 55.36 54.78 1n4x s GLN 382 Cb -0.14 -2.61 0.01 0.00 1.10 0.00 0.00 33.01 31.38 1n4x s GLN 382 CO -0.09 0.37 -0.11 0.42 -0.55 0.00 0.00 175.29 175.33 1n4x s ILE 383 N -0.05 2.70 0.32 -2.34 1.01 0.35 -1.24 121.20 121.95 1n4x s ILE 383 Ca -0.02 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.83 1n4x s ILE 383 Cb -0.14 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 1n4x s ILE 383 CO 0.04 0.40 0.47 0.20 0.00 0.00 0.00 174.94 176.05 1n4x s ASN 384 N 1.35 6.13 -1.33 3.58 -0.87 -0.73 -1.45 114.94 121.63 1n4x s ASN 384 Ca 0.04 0.08 -0.13 0.00 -1.57 0.00 0.00 52.86 51.27 1n4x s ASN 384 Cb -0.15 -1.63 0.01 0.00 -0.02 0.00 0.00 41.25 39.46 1n4x s ASN 384 CO -0.07 -0.32 0.48 -3.20 -2.57 0.00 0.00 177.10 171.42 1n4x n ASN 385 N -1.65 -2.11 -4.57 -1.22 5.15 -1.19 -4.76 115.26 104.91 1n4x n ASN 385 Ca -0.04 -1.14 -0.52 0.00 -0.60 0.00 0.00 54.58 52.28 1n4x n ASN 385 Cb 0.57 -2.49 -0.06 0.00 -0.53 0.00 0.00 39.78 37.27 1n4x n ASN 385 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1n4x n LEU 386 N -4.55 1.30 -4.49 1.20 4.77 -0.23 -4.55 117.00 110.45 1n4x n LEU 386 Ca -0.22 1.13 -0.24 0.00 -0.03 0.00 0.00 56.01 56.65 1n4x n LEU 386 Cb 0.64 -1.15 -0.10 0.00 -2.33 0.00 0.00 43.42 40.47 1n4x n LEU 386 CO 0.75 -1.29 -0.46 -0.54 -1.33 0.00 0.00 177.39 174.52 1n4x s LYS 387 N 0.12 1.73 0.42 3.23 1.02 -1.26 -0.55 119.74 124.45 1n4x s LYS 387 Ca 0.81 -1.78 0.14 0.00 0.02 0.00 0.00 55.97 55.16 1n4x s LYS 387 Cb -0.97 -1.78 1.01 0.00 -0.52 0.00 0.00 37.83 35.57 1n4x s LYS 387 CO 0.50 0.30 1.95 -0.91 -0.92 0.00 0.00 175.35 176.27 1n4x h ASN 388 N 2.21 0.41 0.27 2.83 -0.26 -1.94 -0.61 115.58 118.50 1n4x h ASN 388 Ca -0.41 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.35 1n4x h ASN 388 Cb 1.26 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 38.45 1n4x h ASN 388 CO 0.62 0.23 0.00 1.05 -1.06 0.00 0.00 177.43 178.27 1n4x h GLU 389 N 0.45 0.00 0.00 0.81 4.11 -1.97 -2.25 114.58 115.73 1n4x h GLU 389 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.76 1n4x h GLU 389 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1n4x h GLU 389 CO -0.10 0.00 -0.03 -0.25 0.07 0.00 0.00 179.01 178.70 1n4x n ASP 390 N -2.70 0.14 -4.64 3.06 8.00 -0.24 -4.83 116.55 115.34 1n4x n ASP 390 Ca -0.01 0.48 -0.46 0.00 0.71 0.00 0.00 54.79 55.50 1n4x n ASP 390 Cb 0.12 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 1n4x n ASP 390 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1n4x n THR 391 N -1.61 0.54 0.00 -3.53 -1.04 -0.85 -4.83 114.28 102.96 1n4x n THR 391 Ca 0.07 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1n4x n THR 391 Cb 0.35 -2.08 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 1n4x n THR 391 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1n4x n ALA 392 N 8.15 0.00 -3.20 2.41 0.00 -0.82 -4.45 120.51 122.60 1n4x n ALA 392 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.35 1n4x n ALA 392 Cb 0.34 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.66 1n4x n ALA 392 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n4x s THR 393 N -2.00 3.71 -0.15 0.00 2.01 -0.17 -0.26 115.64 118.78 1n4x s THR 393 Ca 0.00 -0.39 -0.07 0.00 0.31 0.00 0.00 61.69 61.53 1n4x s THR 393 Cb 0.00 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 1n4x s THR 393 CO 0.00 0.44 0.10 -0.31 -0.69 0.00 0.00 174.62 174.16 1n4x s TYR 394 N 1.05 3.41 -0.01 4.92 1.51 0.09 -0.57 117.35 127.75 1n4x s TYR 394 Ca 0.01 0.32 0.06 0.00 -1.01 0.00 0.00 57.07 56.45 1n4x s TYR 394 Cb -0.14 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.66 1n4x s TYR 394 CO 0.01 0.43 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.64 1n4x s PHE 395 N -0.27 2.57 -0.06 2.71 0.08 0.11 -0.59 117.98 122.53 1n4x s PHE 395 Ca 0.10 -0.25 -0.04 0.00 0.12 0.00 0.00 56.93 56.85 1n4x s PHE 395 Cb -0.12 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 1n4x s PHE 395 CO 0.01 0.17 0.14 0.00 -0.10 0.00 0.00 175.22 175.44 1n4x s VAL 397 N -1.15 0.03 -0.02 0.00 1.01 0.64 -1.23 120.40 119.69 1n4x s VAL 397 Ca 0.20 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1n4x s VAL 397 Cb -0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 1n4x s VAL 397 CO 0.11 -0.14 -0.16 -0.60 0.00 0.00 0.00 175.10 174.31 1n4x s ARG 398 N -0.42 2.34 0.74 2.72 3.52 0.45 -0.52 118.95 127.78 1n4x s ARG 398 Ca -0.05 -0.80 -0.01 0.00 -0.13 0.00 0.00 55.73 54.74 1n4x s ARG 398 Cb -0.03 -2.30 0.14 0.00 -1.56 0.00 0.00 34.95 31.20 1n4x s ARG 398 CO 0.00 0.59 1.01 0.16 -0.81 0.00 0.00 175.30 176.26 1n4x s ASP 399 N -0.97 4.25 -0.05 -2.12 1.47 -1.26 -1.63 116.67 116.36 1n4x s ASP 399 Ca 0.13 -0.39 -0.24 0.00 1.18 0.00 0.00 52.55 53.23 1n4x s ASP 399 Cb -0.11 0.06 -0.18 0.00 -0.34 0.00 0.00 42.92 42.35 1n4x s ASP 399 CO 0.02 -1.93 1.00 -0.09 0.68 0.00 0.00 175.17 174.85 1n4x h ARG 400 N -0.59 -0.12 0.00 2.11 2.43 -1.53 -3.40 114.38 113.28 1n4x h ARG 400 Ca -0.36 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.81 1n4x h ARG 400 Cb 1.26 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.81 1n4x h ARG 400 CO 0.39 0.38 -0.29 0.72 -1.51 0.00 0.00 179.97 179.67 1n4x n HIS 401 N -4.87 0.00 -3.31 2.20 8.25 -1.26 -5.00 115.22 111.23 1n4x n HIS 401 Ca -0.08 -0.84 -0.18 0.00 -0.26 0.00 0.00 57.72 56.36 1n4x n HIS 401 Cb 0.28 -0.15 0.06 0.00 1.12 0.00 0.00 29.99 31.30 1n4x n HIS 401 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1n4x n ASP 402 N -0.91 -5.17 0.00 0.41 2.03 -1.26 -4.91 116.55 106.74 1n4x n ASP 402 Ca 0.12 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 55.03 1n4x n ASP 402 Cb 0.70 -3.86 0.00 0.00 -0.72 0.00 0.00 41.12 37.25 1n4x n ASP 402 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1n4x n TYR 403 N -4.33 0.00 -2.05 -0.67 4.01 -1.26 -4.90 117.16 107.96 1n4x n TYR 403 Ca 0.00 -0.06 -0.21 0.00 -0.16 0.00 0.00 57.90 57.48 1n4x n TYR 403 Cb 0.55 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.53 1n4x n TYR 403 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n4x n GLY 404 N -0.06 0.60 0.10 2.72 0.00 -1.26 -4.86 105.19 102.44 1n4x n GLY 404 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1n4x n GLY 404 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n4x n GLU 405 N -2.73 0.68 -3.66 1.61 1.02 -1.26 -4.88 120.64 111.41 1n4x n GLU 405 Ca -0.23 0.07 -0.27 0.00 -0.02 0.00 0.00 57.16 56.70 1n4x n GLU 405 Cb 0.69 -1.58 -0.16 0.00 -0.02 0.00 0.00 31.44 30.37 1n4x n GLU 405 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n4x s ILE 406 N -2.52 0.24 -0.44 -3.67 1.01 -1.26 -5.07 121.20 109.49 1n4x s ILE 406 Ca -0.11 -0.53 -0.29 0.00 0.00 0.00 0.00 60.65 59.72 1n4x s ILE 406 Cb 0.07 -0.92 0.03 0.00 0.01 0.00 0.00 42.46 41.64 1n4x s ILE 406 CO 0.81 -0.37 1.12 -0.36 0.00 0.00 0.00 174.94 176.14 1n4x s PHE 407 N 1.98 2.89 -0.21 3.97 0.08 -1.26 -1.20 117.98 124.23 1n4x s PHE 407 Ca 0.03 0.82 -0.16 0.00 0.12 0.00 0.00 56.93 57.73 1n4x s PHE 407 Cb -0.17 -4.26 -0.08 0.00 -0.57 0.00 0.00 43.02 37.94 1n4x s PHE 407 CO -0.15 -1.16 -0.33 2.41 -0.10 0.00 0.00 175.22 175.89 1n4x n THR 408 N 6.62 1.51 -3.79 0.64 -1.04 -0.65 -4.96 114.28 112.61 1n4x n THR 408 Ca 0.12 -0.02 -0.35 0.00 -2.04 0.00 0.00 64.05 61.76 1n4x n THR 408 Cb 0.49 -2.20 -0.08 0.00 -1.82 0.00 0.00 70.33 66.71 1n4x n THR 408 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1n4x s TYR 409 N -2.74 3.40 0.05 -1.42 2.02 -0.89 -4.97 117.35 112.79 1n4x s TYR 409 Ca -0.31 0.31 0.09 0.00 -0.37 0.00 0.00 57.07 56.78 1n4x s TYR 409 Cb 0.07 -2.13 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 1n4x s TYR 409 CO 0.44 0.31 -0.25 -1.58 -1.57 0.00 0.00 175.55 172.90 1n4x s TRP 410 N 0.23 2.16 1.00 2.71 0.52 -1.26 -0.41 118.94 123.89 1n4x s TRP 410 Ca 0.08 -0.40 -0.16 0.00 0.02 0.00 0.00 56.10 55.64 1n4x s TRP 410 Cb -0.11 -1.29 0.20 0.00 -1.15 0.00 0.00 33.47 31.12 1n4x s TRP 410 CO -0.01 0.12 1.23 0.20 0.02 0.00 0.00 176.95 178.52 1n4x s GLY 411 N -1.25 1.69 0.00 0.98 0.00 -0.36 -4.65 107.32 103.73 1n4x s GLY 411 Ca 0.10 -1.00 0.27 0.00 0.00 0.00 0.00 44.72 44.09 1n4x s GLY 411 CO 0.02 -0.26 1.91 0.61 0.00 0.00 0.00 173.10 175.38 1n4x n GLN 412 N -3.97 0.32 0.00 2.90 0.00 -1.25 -4.81 117.38 110.57 1n4x n GLN 412 Ca 0.13 0.03 0.00 0.00 0.00 0.00 0.00 57.00 57.16 1n4x n GLN 412 Cb 0.60 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.34 1n4x n GLN 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n4x n GLY 413 N 1.04 -0.71 2.93 2.61 0.00 -1.26 -5.00 105.19 104.79 1n4x n GLY 413 Ca 0.12 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.37 1n4x n GLY 413 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n4x s THR 414 N -3.09 1.34 -0.11 2.61 2.01 0.24 -4.89 115.64 113.75 1n4x s THR 414 Ca 0.00 -0.89 -0.27 0.00 0.31 0.00 0.00 61.69 60.84 1n4x s THR 414 Cb 0.00 -1.53 -0.02 0.00 0.01 0.00 0.00 72.50 70.96 1n4x s THR 414 CO 0.00 0.07 0.91 -0.89 -0.69 0.00 0.00 174.62 174.01 1n4x s THR 415 N 1.52 4.86 -0.19 -0.82 2.01 -1.26 -0.73 115.64 121.03 1n4x s THR 415 Ca -0.02 1.84 -0.02 0.00 0.31 0.00 0.00 61.69 63.80 1n4x s THR 415 Cb -0.17 -4.22 -0.01 0.00 0.01 0.00 0.00 72.50 68.12 1n4x s THR 415 CO -0.07 0.07 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.14 1n4x s VAL 416 N 1.75 3.05 -0.16 3.82 1.01 0.64 -0.94 120.40 129.57 1n4x s VAL 416 Ca 0.44 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1n4x s VAL 416 Cb -0.18 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.87 1n4x s VAL 416 CO 0.18 0.47 -0.18 -0.89 0.00 0.00 0.00 175.10 174.68 1n4x s THR 417 N 1.11 2.33 -0.35 3.92 2.01 -0.02 -1.94 115.64 122.69 1n4x s THR 417 Ca 0.01 -0.88 -0.13 0.00 0.31 0.00 0.00 61.69 61.01 1n4x s THR 417 Cb -0.14 -1.97 -0.00 0.00 0.01 0.00 0.00 72.50 70.39 1n4x s THR 417 CO -0.02 0.53 0.23 -0.69 -0.69 0.00 0.00 174.62 173.98 1n4x s VAL 418 N 0.99 5.08 0.00 3.82 1.01 -1.26 -0.91 120.40 129.13 1n4x s VAL 418 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1n4x s VAL 418 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1n4x s VAL 418 CO -0.04 -0.08 0.00 -1.20 0.00 0.00 0.00 175.10 173.77 1n4x n SER 419 N 5.08 0.00 -0.36 3.32 7.64 -0.79 -4.90 113.62 123.62 1n4x n SER 419 Ca -0.12 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.90 1n4x n SER 419 Cb 0.49 0.00 0.63 0.00 -1.01 0.00 0.00 64.21 64.32 1n4x n SER 419 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03