#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mah s ILE 298 N -4.28 2.31 -0.11 0.00 1.01 -1.26 -5.12 121.20 113.75 3mah s ILE 298 Ca 0.39 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 60.12 3mah s ILE 298 Cb 0.19 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 3mah s ILE 298 CO -0.12 0.55 -0.15 -0.54 0.00 0.00 0.00 174.94 174.69 3mah s LYS 299 N 0.30 3.22 -0.01 2.79 1.02 -1.26 -4.36 119.74 121.43 3mah s LYS 299 Ca -0.16 -0.71 -0.15 0.00 0.02 0.00 0.00 55.97 54.97 3mah s LYS 299 Cb -0.17 -2.56 0.02 0.00 -0.52 0.00 0.00 37.83 34.61 3mah s LYS 299 CO 0.08 0.27 0.31 0.00 -0.92 0.00 0.00 175.35 175.08 3mah s ALA 300 N 0.20 -0.78 -0.08 5.17 0.00 -0.30 -4.99 121.76 120.97 3mah s ALA 300 Ca -0.09 0.32 0.03 0.00 0.00 0.00 0.00 51.96 52.22 3mah s ALA 300 Cb -0.15 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.05 3mah s ALA 300 CO 0.05 -0.26 -0.16 0.54 0.00 0.00 0.00 175.76 175.93 3mah s VAL 301 N -1.34 1.46 -0.01 0.00 0.11 -1.26 -0.94 120.40 118.42 3mah s VAL 301 Ca -0.14 -0.67 0.04 0.00 -2.93 0.00 0.00 61.98 58.28 3mah s VAL 301 Cb -0.05 -1.30 -0.01 0.00 -1.53 0.00 0.00 36.38 33.49 3mah s VAL 301 CO 0.04 0.43 -0.12 0.00 -3.33 0.00 0.00 175.10 172.12 3mah s ALA 302 N 0.56 1.03 -0.03 1.54 0.00 -0.32 -5.00 121.76 119.54 3mah s ALA 302 Ca -0.16 -0.51 0.07 0.00 0.00 0.00 0.00 51.96 51.36 3mah s ALA 302 Cb -0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 3mah s ALA 302 CO 0.05 0.24 -0.23 0.00 0.00 0.00 0.00 175.76 175.82 3mah s ALA 303 N -0.21 1.93 -0.20 0.00 0.00 -1.26 -0.81 121.76 121.22 3mah s ALA 303 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.03 3mah s ALA 303 Cb -0.06 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.58 3mah s ALA 303 CO -0.00 0.44 -0.11 0.21 0.00 0.00 0.00 175.76 176.30 3mah s LYS 304 N -0.41 2.09 0.74 0.00 2.20 0.10 -4.98 119.74 119.48 3mah s LYS 304 Ca 0.05 -0.87 -0.07 0.00 -0.36 0.00 0.00 55.97 54.72 3mah s LYS 304 Cb -0.10 -2.45 0.09 0.00 -1.51 0.00 0.00 37.83 33.86 3mah s LYS 304 CO 0.00 -0.43 1.05 -0.51 -0.36 0.00 0.00 175.35 175.11 3mah s ASP 305 N 1.37 4.52 -0.71 1.43 1.01 -1.26 -1.24 116.67 121.80 3mah s ASP 305 Ca -0.01 0.32 -0.00 0.00 0.71 0.00 0.00 52.55 53.56 3mah s ASP 305 Cb -0.16 -0.85 0.00 0.00 1.01 0.00 0.00 42.92 42.92 3mah s ASP 305 CO -0.08 -1.79 0.01 0.61 0.21 0.00 0.00 175.17 174.13 3mah n GLY 306 N -3.02 0.03 3.88 0.21 0.00 -1.26 -4.97 105.19 100.06 3mah n GLY 306 Ca 0.10 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 3mah n GLY 306 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mah s ILE 307 N -2.43 5.20 -0.10 -0.61 -1.09 -1.26 -4.23 121.20 116.67 3mah s ILE 307 Ca 0.00 0.31 0.02 0.00 -2.23 0.00 0.00 60.65 58.76 3mah s ILE 307 Cb -0.00 -3.61 -0.01 0.00 -1.58 0.00 0.00 42.46 37.26 3mah s ILE 307 CO 0.01 0.34 -0.18 -0.89 -1.23 0.00 0.00 174.94 172.98 3mah s THR 308 N -1.34 2.60 -0.15 2.92 2.01 -0.49 -3.01 115.64 118.18 3mah s THR 308 Ca 0.30 -0.84 -0.06 0.00 0.31 0.00 0.00 61.69 61.40 3mah s THR 308 Cb -0.14 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 3mah s THR 308 CO 0.17 0.55 0.07 0.54 -0.69 0.00 0.00 174.62 175.26 3mah s VAL 309 N 0.20 4.92 -0.14 3.82 0.11 -0.03 -1.61 120.40 127.67 3mah s VAL 309 Ca -0.11 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 58.95 3mah s VAL 309 Cb -0.16 -3.18 -0.00 0.00 -1.53 0.00 0.00 36.38 31.51 3mah s VAL 309 CO 0.06 0.52 -0.18 -0.63 -3.33 0.00 0.00 175.10 171.55 3mah s ILE 310 N -0.20 2.48 -0.19 7.04 1.01 0.73 -1.16 121.20 130.91 3mah s ILE 310 Ca 0.08 -0.84 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 3mah s ILE 310 Cb -0.12 -2.02 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 3mah s ILE 310 CO 0.01 0.53 -0.05 -0.75 0.00 0.00 0.00 174.94 174.69 3mah s LYS 311 N 0.68 3.48 -0.23 2.79 2.20 -0.09 -0.96 119.74 127.61 3mah s LYS 311 Ca -0.09 -0.59 0.02 0.00 -0.36 0.00 0.00 55.97 54.95 3mah s LYS 311 Cb -0.16 -2.95 0.05 0.00 -1.51 0.00 0.00 37.83 33.26 3mah s LYS 311 CO 0.02 -0.02 -0.12 0.08 -0.36 0.00 0.00 175.35 174.95 3mah s VAL 312 N 1.02 2.00 -0.44 4.02 1.01 -0.05 -0.52 120.40 127.44 3mah s VAL 312 Ca 0.01 -1.34 -0.22 0.00 0.00 0.00 0.00 61.98 60.43 3mah s VAL 312 Cb -0.15 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.21 3mah s VAL 312 CO 0.00 0.13 0.70 -0.54 0.00 0.00 0.00 175.10 175.39 3mah s LYS 313 N 1.22 3.33 0.44 2.72 1.02 0.25 -1.43 119.74 127.28 3mah s LYS 313 Ca -0.04 -0.27 -0.24 0.00 0.02 0.00 0.00 55.97 55.44 3mah s LYS 313 Cb -0.18 -3.95 -0.10 0.00 -0.52 0.00 0.00 37.83 33.09 3mah s LYS 313 CO -0.07 -1.05 1.02 0.45 -0.92 0.00 0.00 175.35 174.77 3mah n SER 314 N 6.43 1.27 -4.76 2.83 2.88 -0.88 -1.44 113.62 119.95 3mah n SER 314 Ca -0.00 1.01 -0.41 0.00 -1.33 0.00 0.00 58.87 58.14 3mah n SER 314 Cb 0.48 -1.36 -0.02 0.00 -0.75 0.00 0.00 64.21 62.56 3mah n SER 314 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3mah s SER 315 N -0.78 6.51 0.55 -3.46 0.15 -0.54 -4.82 113.70 111.31 3mah s SER 315 Ca 0.64 2.84 0.23 0.00 0.70 0.00 0.00 55.95 60.37 3mah s SER 315 Cb -0.54 -2.64 1.46 0.00 -1.71 0.00 0.00 66.02 62.59 3mah s SER 315 CO 0.56 -0.78 2.10 0.78 1.20 0.00 0.00 173.24 177.10 3mah h ASN 316 N 4.33 0.00 -0.49 5.45 4.21 -1.91 -1.91 115.58 125.25 3mah h ASN 316 Ca -0.48 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.04 3mah h ASN 316 Cb 1.22 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.40 3mah h ASN 316 CO 0.74 0.00 0.32 0.11 -1.29 0.00 0.00 177.43 177.31 3mah h LYS 317 N 0.00 0.66 -5.91 0.81 6.56 -1.97 -3.44 116.57 113.27 3mah h LYS 317 Ca 0.09 -0.04 -0.57 0.00 -1.06 0.00 0.00 60.65 59.07 3mah h LYS 317 Cb 0.41 -0.15 -0.06 0.00 -0.57 0.00 0.00 32.23 31.86 3mah h LYS 317 CO -0.00 0.44 0.01 -0.51 -2.06 0.00 0.00 179.45 177.33 3mah s LEU 318 N -9.57 4.30 0.26 2.94 1.43 -0.72 -5.05 118.68 112.25 3mah s LEU 318 Ca -0.09 1.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.75 3mah s LEU 318 Cb 0.17 -2.93 -0.10 0.00 0.03 0.00 0.00 46.19 43.36 3mah s LEU 318 CO 0.75 -0.08 1.34 -0.76 0.23 0.00 0.00 176.35 177.83 3mah s LEU 319 N 0.77 4.42 0.22 1.79 1.43 -1.26 -4.86 118.68 121.19 3mah s LEU 319 Ca 0.33 2.57 -0.08 0.00 -1.03 0.00 0.00 54.13 55.92 3mah s LEU 319 Cb -0.17 -3.63 0.33 0.00 0.03 0.00 0.00 46.19 42.75 3mah s LEU 319 CO 0.15 -0.57 1.76 0.77 0.23 0.00 0.00 176.35 178.69 3mah h SER 320 N 4.58 0.35 -0.21 2.29 4.64 -1.97 -1.50 113.55 121.73 3mah h SER 320 Ca -0.46 0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 60.91 3mah h SER 320 Cb 1.22 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3mah h SER 320 CO 0.73 0.19 0.08 4.11 -0.87 0.00 0.00 176.83 181.08 3mah h TRP 321 N 0.51 0.39 -0.11 4.77 0.09 -2.05 -2.23 115.95 117.31 3mah h TRP 321 Ca 0.34 -0.01 -0.15 0.00 0.09 0.00 0.00 58.89 59.15 3mah h TRP 321 Cb 0.40 -0.12 0.01 0.00 0.08 0.00 0.00 29.16 29.52 3mah h TRP 321 CO -0.14 0.34 -0.53 0.45 0.09 0.00 0.00 178.44 178.66 3mah h HIS 322 N 0.40 0.75 0.00 0.12 3.86 -1.75 -3.12 115.15 115.41 3mah h HIS 322 Ca 0.10 -0.33 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 3mah h HIS 322 Cb 0.14 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.49 3mah h HIS 322 CO 0.00 1.11 0.00 0.34 0.86 0.00 0.00 177.93 180.24 3mah n PHE 323 N -4.20 0.00 0.00 2.45 7.35 -0.64 -1.22 117.46 121.19 3mah n PHE 323 Ca -0.08 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.61 3mah n PHE 323 Cb 0.61 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 40.43 3mah n PHE 323 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 3mah n ARG 325 N 0.44 0.00 -0.12 -4.13 0.00 -1.18 -0.56 116.66 111.12 3mah n ARG 325 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.85 57.80 3mah n ARG 325 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 32.46 32.48 3mah n ARG 325 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 3mah h LYS 326 N 0.00 0.05 0.19 -0.14 1.57 -1.46 -0.48 116.57 116.29 3mah h LYS 326 Ca 0.00 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3mah h LYS 326 Cb 0.00 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 3mah h LYS 326 CO 0.00 0.03 -0.49 1.25 -0.57 0.00 0.00 179.45 179.67 3mah h LEU 327 N 0.05 -1.44 -1.92 2.94 5.85 -1.07 -2.10 115.31 117.61 3mah h LEU 327 Ca 0.20 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3mah h LEU 327 Cb 0.29 0.53 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 3mah h LEU 327 CO -0.37 -0.56 -0.09 -0.26 -0.34 0.00 0.00 178.44 176.82 3mah h PHE 328 N -0.77 0.00 -0.08 1.25 0.04 -1.76 -1.72 116.94 113.91 3mah h PHE 328 Ca -0.01 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 3mah h PHE 328 Cb 0.76 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.89 3mah h PHE 328 CO -0.39 0.09 -0.46 1.49 -0.60 0.00 0.00 178.31 178.44 3mah h GLU 329 N 0.00 0.18 -0.26 1.51 4.81 -0.61 -0.45 114.58 119.76 3mah h GLU 329 Ca -0.00 -0.09 -0.11 0.00 -0.13 0.00 0.00 59.36 59.02 3mah h GLU 329 Cb 0.35 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3mah h GLU 329 CO 0.01 0.61 -0.27 0.82 -0.73 0.00 0.00 179.01 179.45 3mah h ILE 330 N 0.15 1.31 -0.04 2.32 2.04 -0.66 -1.15 117.51 121.47 3mah h ILE 330 Ca 0.01 -1.44 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 3mah h ILE 330 Cb 0.88 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 3mah h ILE 330 CO 0.07 0.45 -0.26 -0.26 0.00 0.00 0.00 178.15 178.16 3mah h PHE 331 N 0.37 0.08 -0.14 1.37 0.04 -1.40 -2.79 116.94 114.48 3mah h PHE 331 Ca 0.04 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.77 3mah h PHE 331 Cb 0.83 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.96 3mah h PHE 331 CO 0.07 0.33 -0.02 1.49 -0.60 0.00 0.00 178.31 179.58 3mah h GLU 332 N 0.07 0.26 -0.72 1.51 4.81 -0.82 0.19 114.58 119.88 3mah h GLU 332 Ca 0.01 -0.09 0.12 0.00 -0.13 0.00 0.00 59.36 59.26 3mah h GLU 332 Cb 0.50 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 3mah h GLU 332 CO 0.04 0.53 0.30 0.35 -0.73 0.00 0.00 179.01 179.50 3mah h PHE 333 N -0.04 0.53 -0.38 0.92 3.57 -1.01 0.97 116.94 121.49 3mah h PHE 333 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3mah h PHE 333 Cb 0.43 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.05 3mah h PHE 333 CO 0.05 0.12 0.00 0.66 -2.23 0.00 0.00 178.31 176.91 3mah n TYR 334 N -4.96 0.51 -3.88 0.41 4.01 -1.07 -4.93 117.16 107.25 3mah n TYR 334 Ca 0.12 -0.26 -0.28 0.00 -0.16 0.00 0.00 57.90 57.33 3mah n TYR 334 Cb 0.35 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.40 3mah n TYR 334 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3mah n GLN 335 N 0.62 -5.15 -3.63 -0.72 6.02 0.34 -4.95 117.38 109.92 3mah n GLN 335 Ca 0.13 0.58 -0.37 0.00 -0.01 0.00 0.00 57.00 57.33 3mah n GLN 335 Cb 0.32 -5.34 -0.11 0.00 1.02 0.00 0.00 30.24 26.13 3mah n GLN 335 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3mah s GLU 336 N -6.48 3.95 0.43 -1.09 0.41 -0.05 -5.03 118.70 110.84 3mah s GLU 336 Ca 0.47 -0.32 -0.23 0.00 -0.41 0.00 0.00 54.97 54.48 3mah s GLU 336 Cb -0.24 -3.60 -0.08 0.00 -1.78 0.00 0.00 34.13 28.43 3mah s GLU 336 CO 0.83 -0.12 1.08 -1.25 -0.49 0.00 0.00 175.26 175.31 3mah s PRO 337 N 1.57 3.97 -0.30 0.39 0.04 -1.26 -4.73 135.00 134.68 3mah s PRO 337 Ca 0.07 1.56 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 3mah s PRO 337 Cb -0.15 -2.41 0.05 0.00 0.04 0.00 0.00 34.50 32.03 3mah s PRO 337 CO 0.09 -0.32 0.00 0.08 0.04 0.00 0.00 177.00 176.89 3mah s VAL 338 N -1.69 2.98 -2.00 -0.36 1.01 -1.26 -4.42 120.40 114.65 3mah s VAL 338 Ca 0.61 -1.40 0.14 0.00 0.00 0.00 0.00 61.98 61.34 3mah s VAL 338 Cb -0.23 -2.72 0.41 0.00 0.00 0.00 0.00 36.38 33.84 3mah s VAL 338 CO 0.28 -0.12 1.40 0.47 0.00 0.00 0.00 175.10 177.14 3mah n ASP 339 N 4.62 0.00 0.00 3.32 8.00 -1.26 -4.97 116.55 126.26 3mah n ASP 339 Ca -0.13 -1.12 0.00 0.00 0.71 0.00 0.00 54.79 54.25 3mah n ASP 339 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3mah n ASP 339 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3mah n VAL 341 N -0.79 0.00 -3.55 2.53 0.31 -1.26 -5.04 118.33 110.53 3mah n VAL 341 Ca 0.11 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.30 3mah n VAL 341 Cb 0.05 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 32.86 3mah n VAL 341 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mah s ALA 342 N -1.31 -0.57 0.34 3.52 0.00 -0.53 -4.93 121.76 118.27 3mah s ALA 342 Ca 0.00 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.70 3mah s ALA 342 Cb 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 3mah s ALA 342 CO 0.00 -0.95 0.51 0.95 0.00 0.00 0.00 175.76 176.27 3mah s THR 343 N 2.42 4.89 0.34 0.00 -4.23 -1.26 -1.59 115.64 116.21 3mah s THR 343 Ca 0.05 -0.64 -0.01 0.00 -1.18 0.00 0.00 61.69 59.91 3mah s THR 343 Cb -0.14 -3.77 -0.00 0.00 1.34 0.00 0.00 72.50 69.93 3mah s THR 343 CO -0.11 -0.44 0.45 -0.94 -0.54 0.00 0.00 174.62 173.04 3mah s SER 344 N -4.06 1.01 0.07 3.99 1.04 -0.70 -4.97 113.70 110.08 3mah s SER 344 Ca 0.40 -1.52 -0.24 0.00 0.48 0.00 0.00 55.95 55.07 3mah s SER 344 Cb -0.09 0.65 -0.16 0.00 0.10 0.00 0.00 66.02 66.51 3mah s SER 344 CO 0.34 -1.26 1.64 -0.08 0.98 0.00 0.00 173.24 174.86 3mah h GLU 345 N 2.12 -0.02 0.45 4.02 4.57 -2.03 -3.31 114.58 120.38 3mah h GLU 345 Ca -0.28 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 57.88 3mah h GLU 345 Cb 1.24 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3mah h GLU 345 CO 0.39 0.09 -0.22 0.28 -1.18 0.00 0.00 179.01 178.37 3mah h VAL 346 N -0.12 0.47 -0.69 0.32 2.07 -1.97 -3.48 116.25 112.84 3mah h VAL 346 Ca -0.00 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.08 3mah h VAL 346 Cb 0.11 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3mah h VAL 346 CO 0.00 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.27 3mah n GLY 347 N -0.55 1.05 3.24 2.17 0.00 -1.25 -2.08 105.19 107.78 3mah n GLY 347 Ca -0.10 -0.73 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 3mah n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mah s VAL 348 N -2.25 1.35 -0.02 1.61 0.11 -0.52 -1.72 120.40 118.96 3mah s VAL 348 Ca 0.00 -1.65 0.07 0.00 -2.93 0.00 0.00 61.98 57.47 3mah s VAL 348 Cb 0.00 -1.48 -0.02 0.00 -1.53 0.00 0.00 36.38 33.36 3mah s VAL 348 CO 0.00 -0.36 -0.24 -0.44 -3.33 0.00 0.00 175.10 170.74 3mah s SER 349 N -2.31 2.79 0.16 3.54 0.01 -0.62 -0.87 113.70 116.40 3mah s SER 349 Ca 0.07 -0.43 -0.09 0.00 1.31 0.00 0.00 55.95 56.81 3mah s SER 349 Cb -0.06 -0.37 -0.01 0.00 0.21 0.00 0.00 66.02 65.79 3mah s SER 349 CO 0.03 0.28 0.28 -1.48 0.41 0.00 0.00 173.24 172.76 3mah s LEU 350 N -0.50 0.98 0.14 2.44 0.05 -0.13 -1.45 118.68 120.20 3mah s LEU 350 Ca 0.08 -0.88 0.08 0.00 0.05 0.00 0.00 54.13 53.46 3mah s LEU 350 Cb -0.10 1.17 -0.04 0.00 -2.05 0.00 0.00 46.19 45.17 3mah s LEU 350 CO -0.00 -0.89 -0.12 0.42 -0.55 0.00 0.00 176.35 175.21 3mah s THR 351 N -3.97 3.17 0.08 5.48 -4.23 -1.26 -0.19 115.64 114.71 3mah s THR 351 Ca 0.17 -1.50 0.05 0.00 -1.18 0.00 0.00 61.69 59.24 3mah s THR 351 Cb 0.03 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.33 3mah s THR 351 CO 0.00 0.01 -0.14 0.27 -0.54 0.00 0.00 174.62 174.22 3mah s ILE 352 N -1.42 1.11 -2.70 2.99 -4.36 -0.64 -4.10 121.20 112.08 3mah s ILE 352 Ca 0.22 -1.37 0.26 0.00 -0.26 0.00 0.00 60.65 59.50 3mah s ILE 352 Cb -0.10 -1.14 0.40 0.00 1.25 0.00 0.00 42.46 42.88 3mah s ILE 352 CO 0.14 -0.28 1.54 -0.90 0.24 0.00 0.00 174.94 175.68 3mah n ASP 353 N 1.14 2.13 -3.87 4.36 3.85 -1.26 -1.40 116.55 121.50 3mah n ASP 353 Ca -0.20 -1.71 -0.09 0.00 -0.71 0.00 0.00 54.79 52.07 3mah n ASP 353 Cb 0.55 -0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.26 3mah n ASP 353 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 3mah s ASN 354 N -1.99 -0.10 -0.10 -1.12 3.84 -1.26 -4.64 114.94 109.57 3mah s ASN 354 Ca 0.34 -0.70 0.13 0.00 0.21 0.00 0.00 52.86 52.84 3mah s ASN 354 Cb 0.21 0.51 0.29 0.00 -0.55 0.00 0.00 41.25 41.70 3mah s ASN 354 CO 0.32 -0.98 1.19 -0.90 -2.79 0.00 0.00 177.10 173.94 3mah n ASP 355 N -0.28 2.70 -0.19 -4.21 3.85 -1.26 -4.75 116.55 112.42 3mah n ASP 355 Ca -0.08 -2.72 -0.00 0.00 -0.71 0.00 0.00 54.79 51.28 3mah n ASP 355 Cb 0.63 -0.34 0.09 0.00 -1.35 0.00 0.00 41.12 40.15 3mah n ASP 355 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.20 176.69 3mah h LYS 356 N 0.65 0.27 -0.24 0.11 3.64 -2.02 -2.37 116.57 116.62 3mah h LYS 356 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3mah h LYS 356 Cb 0.97 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 3mah h LYS 356 CO 0.05 0.18 0.00 0.09 -2.27 0.00 0.00 179.45 177.50 3mah n ASN 357 N -5.10 3.14 -0.23 4.20 3.02 -1.26 -4.68 115.26 114.35 3mah n ASN 357 Ca 0.08 -1.96 0.03 0.00 -0.03 0.00 0.00 54.58 52.69 3mah n ASN 357 Cb 0.29 -0.14 0.13 0.00 -0.61 0.00 0.00 39.78 39.44 3mah n ASN 357 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3mah h LEU 358 N 4.37 -0.30 -0.72 3.41 5.85 -1.72 -1.56 115.31 124.65 3mah h LEU 358 Ca 0.00 0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 3mah h LEU 358 Cb 0.95 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 3mah h LEU 358 CO 0.00 -0.14 0.35 -0.65 -0.34 0.00 0.00 178.44 177.66 3mah h PRO 359 N 0.11 1.03 0.00 5.25 0.11 -1.83 -1.07 132.00 135.60 3mah h PRO 359 Ca 0.36 -0.15 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 3mah h PRO 359 Cb 0.61 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 3mah h PRO 359 CO -0.59 0.81 -0.26 -0.44 -0.21 0.00 0.00 178.00 177.31 3mah h ASP 360 N 1.00 0.00 -0.05 -2.05 3.32 -1.73 -1.07 116.42 115.84 3mah h ASP 360 Ca 0.25 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 3mah h ASP 360 Cb 0.11 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.67 3mah h ASP 360 CO -0.03 0.26 -0.35 0.40 -1.72 0.00 0.00 179.24 177.80 3mah h ILE 361 N 0.00 1.44 -0.46 0.35 2.04 -0.75 -2.15 117.51 117.98 3mah h ILE 361 Ca -0.00 -1.81 -0.01 0.00 1.00 0.00 0.00 64.86 64.04 3mah h ILE 361 Cb 0.54 2.43 -0.02 0.00 -0.74 0.00 0.00 36.82 39.03 3mah h ILE 361 CO 0.03 0.52 0.26 0.58 0.00 0.00 0.00 178.15 179.54 3mah h VAL 362 N -0.20 1.16 0.06 1.67 2.07 -1.06 -0.04 116.25 119.90 3mah h VAL 362 Ca -0.03 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.11 3mah h VAL 362 Cb 1.03 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 3mah h VAL 362 CO 0.07 0.17 -0.38 -0.09 0.02 0.00 0.00 177.57 177.35 3mah h ARG 363 N 0.60 -0.56 -0.46 1.57 2.43 -1.23 0.14 114.38 116.88 3mah h ARG 363 Ca 0.16 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.39 3mah h ARG 363 Cb 0.04 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3mah h ARG 363 CO -0.03 -0.37 0.26 0.00 -1.51 0.00 0.00 179.97 178.33 3mah h ALA 364 N -0.00 0.58 -0.15 2.80 0.00 -1.23 -2.61 119.26 118.65 3mah h ALA 364 Ca 0.04 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3mah h ALA 364 Cb 0.63 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3mah h ALA 364 CO -0.26 -0.06 -0.16 -0.07 0.00 0.00 0.00 179.25 178.70 3mah h LEU 365 N 0.53 0.24 -1.72 0.00 3.38 -0.70 -2.97 115.31 114.06 3mah h LEU 365 Ca 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3mah h LEU 365 Cb 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3mah h LEU 365 CO -0.09 0.42 0.04 0.28 0.09 0.00 0.00 178.44 179.18 3mah h SER 366 N 0.23 0.00 1.23 -0.43 0.02 -0.32 0.12 113.55 114.41 3mah h SER 366 Ca 0.05 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 3mah h SER 366 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 3mah h SER 366 CO 0.03 0.00 -0.47 0.44 -1.14 0.00 0.00 176.83 175.68 3mah h ASP 367 N 0.00 0.00 -0.01 3.07 5.19 -1.62 -3.35 116.42 119.70 3mah h ASP 367 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3mah h ASP 367 Cb 0.09 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.60 3mah h ASP 367 CO 0.00 0.47 -0.17 2.30 -3.12 0.00 0.00 179.24 178.72 3mah n ILE 368 N -3.34 0.00 -3.81 0.35 -5.35 0.38 -5.00 119.36 102.59 3mah n ILE 368 Ca 0.01 -0.41 0.02 0.00 -0.27 0.00 0.00 62.75 62.10 3mah n ILE 368 Cb 0.66 1.14 0.01 0.00 -1.74 0.00 0.00 39.64 39.70 3mah n ILE 368 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3mah s GLY 369 N -1.27 -0.27 -0.08 3.28 0.00 -0.87 -1.47 107.32 106.65 3mah s GLY 369 Ca 0.09 0.36 -0.25 0.00 0.00 0.00 0.00 44.72 44.92 3mah s GLY 369 CO 0.23 3.15 0.76 0.99 0.00 0.00 0.00 173.10 178.22 3mah s ASP 370 N -3.44 7.02 -0.12 1.64 1.01 -0.52 -4.25 116.67 118.02 3mah s ASP 370 Ca 0.23 1.24 0.01 0.00 0.71 0.00 0.00 52.55 54.73 3mah s ASP 370 Cb 0.02 -2.44 -0.01 0.00 1.01 0.00 0.00 42.92 41.50 3mah s ASP 370 CO -0.02 -0.19 -0.15 -0.69 0.21 0.00 0.00 175.17 174.33 3mah s VAL 371 N 1.09 2.92 0.15 -1.27 1.01 -1.26 -0.58 120.40 122.45 3mah s VAL 371 Ca 0.39 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.74 3mah s VAL 371 Cb -0.18 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 3mah s VAL 371 CO 0.18 0.53 -0.18 0.42 0.00 0.00 0.00 175.10 176.05 3mah s THR 372 N 0.28 1.73 0.00 3.92 -4.23 0.32 -4.99 115.64 112.67 3mah s THR 372 Ca -0.11 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.61 3mah s THR 372 Cb -0.16 -1.74 -0.01 0.00 1.34 0.00 0.00 72.50 71.93 3mah s THR 372 CO 0.06 -0.27 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.12 3mah s VAL 373 N -1.87 0.40 -0.09 2.29 1.01 -1.26 -0.91 120.40 119.96 3mah s VAL 373 Ca 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 3mah s VAL 373 Cb -0.07 -0.36 0.03 0.00 0.00 0.00 0.00 36.38 35.98 3mah s VAL 373 CO 0.06 0.05 -0.04 -1.81 0.00 0.00 0.00 175.10 173.36 3mah s ASP 374 N -0.29 1.80 0.71 3.32 1.01 -0.31 -5.01 116.67 117.90 3mah s ASP 374 Ca 0.00 -0.19 0.01 0.00 0.71 0.00 0.00 52.55 53.08 3mah s ASP 374 Cb -0.03 -0.62 0.13 0.00 1.01 0.00 0.00 42.92 43.40 3mah s ASP 374 CO -0.00 -0.15 0.97 -0.54 0.21 0.00 0.00 175.17 175.67 3mah s LYS 375 N 1.75 1.73 -0.19 8.23 1.02 -1.26 -0.85 119.74 130.17 3mah s LYS 375 Ca 0.03 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.77 3mah s LYS 375 Cb -0.13 -2.37 0.02 0.00 -0.52 0.00 0.00 37.83 34.83 3mah s LYS 375 CO -0.06 -1.39 0.09 -0.25 -0.92 0.00 0.00 175.35 172.82 3mah n ASP 376 N -2.77 -5.01 -3.63 2.83 8.00 -1.17 -4.89 116.55 109.91 3mah n ASP 376 Ca 0.15 1.22 -0.03 0.00 0.71 0.00 0.00 54.79 56.85 3mah n ASP 376 Cb 0.61 -4.39 -0.06 0.00 -0.02 0.00 0.00 41.12 37.26 3mah n ASP 376 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mah s VAL 378 N -1.01 -0.04 -0.16 2.53 1.01 0.71 -1.63 120.40 121.80 3mah s VAL 378 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.71 3mah s VAL 378 Cb 0.01 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 3mah s VAL 378 CO 0.60 0.00 0.40 -0.63 0.00 0.00 0.00 175.10 175.47 3mah s ILE 379 N 1.47 5.22 -0.11 2.22 1.01 -0.37 -1.31 121.20 129.33 3mah s ILE 379 Ca -0.09 0.75 0.01 0.00 0.00 0.00 0.00 60.65 61.33 3mah s ILE 379 Cb -0.04 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 3mah s ILE 379 CO -0.16 0.31 -0.14 -0.63 0.00 0.00 0.00 174.94 174.32 3mah s ILE 380 N 0.88 2.96 -0.10 2.92 1.01 -0.12 0.01 121.20 128.77 3mah s ILE 380 Ca 0.21 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.19 3mah s ILE 380 Cb -0.14 -2.22 -0.00 0.00 0.01 0.00 0.00 42.46 40.10 3mah s ILE 380 CO 0.08 0.54 -0.23 0.00 0.00 0.00 0.00 174.94 175.32 3mah s ILE 382 N 0.28 1.99 -0.21 0.00 1.09 -0.12 -1.18 121.20 123.06 3mah s ILE 382 Ca -0.17 -0.91 -0.04 0.00 -1.10 0.00 0.00 60.65 58.43 3mah s ILE 382 Cb -0.17 -1.79 -0.02 0.00 -1.06 0.00 0.00 42.46 39.42 3mah s ILE 382 CO 0.08 0.53 -0.03 -0.69 -0.10 0.00 0.00 174.94 174.73 3mah s VAL 383 N 1.15 3.59 0.00 2.92 1.01 -0.11 -1.03 120.40 127.93 3mah s VAL 383 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.56 3mah s VAL 383 Cb -0.14 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.61 3mah s VAL 383 CO -0.09 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3mah n GLY 384 N 4.54 1.20 4.05 4.51 0.00 -1.26 -1.15 105.19 117.07 3mah n GLY 384 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 3mah n GLY 384 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3mah n VAL 391 N 0.00 -2.46 -0.52 1.61 0.24 -1.26 -4.88 118.33 111.07 3mah n VAL 391 Ca 0.00 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 3mah n VAL 391 Cb 0.00 -2.10 0.00 0.00 -1.47 0.00 0.00 33.84 30.27 3mah n VAL 391 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3mah n GLY 392 N -2.00 0.75 0.30 7.63 0.00 -1.26 -4.98 105.19 105.64 3mah n GLY 392 Ca -0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.96 3mah n GLY 392 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3mah h PHE 393 N 0.00 -0.23 -0.28 1.61 3.57 -2.02 0.01 116.94 119.60 3mah h PHE 393 Ca 0.00 0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 3mah h PHE 393 Cb 0.00 0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 3mah h PHE 393 CO 0.00 -0.33 0.00 1.05 -2.23 0.00 0.00 178.31 176.80 3mah h GLU 394 N 0.04 0.43 -0.49 1.11 9.09 -1.93 -1.79 114.58 121.03 3mah h GLU 394 Ca 0.44 -0.08 -0.04 0.00 0.05 0.00 0.00 59.36 59.73 3mah h GLU 394 Cb 0.77 -0.07 -0.02 0.00 -1.65 0.00 0.00 28.75 27.78 3mah h GLU 394 CO -0.80 0.45 0.15 0.00 0.05 0.00 0.00 179.01 178.85 3mah h ALA 395 N 1.60 0.64 -0.57 1.06 0.00 -1.41 -2.01 119.26 118.57 3mah h ALA 395 Ca 0.09 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3mah h ALA 395 Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3mah h ALA 395 CO 0.01 0.31 0.09 0.00 0.00 0.00 0.00 179.25 179.65 3mah h ARG 396 N 0.66 0.92 -0.32 0.00 3.08 -1.08 -0.87 114.38 116.76 3mah h ARG 396 Ca 0.16 -0.22 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 3mah h ARG 396 Cb 0.28 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3mah h ARG 396 CO -0.00 0.85 -0.07 0.82 -1.07 0.00 0.00 179.97 180.50 3mah h ILE 397 N 0.87 1.28 -0.18 2.04 1.08 -1.28 -3.05 117.51 118.27 3mah h ILE 397 Ca 0.18 -1.11 -0.09 0.00 -0.39 0.00 0.00 64.86 63.45 3mah h ILE 397 Cb 0.39 1.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.47 3mah h ILE 397 CO 0.01 0.36 -0.29 0.40 -0.69 0.00 0.00 178.15 177.94 3mah h ILE 398 N 0.39 1.27 0.00 -0.67 1.08 -1.21 -2.50 117.51 115.86 3mah h ILE 398 Ca 0.08 -1.27 -0.02 0.00 -0.39 0.00 0.00 64.86 63.26 3mah h ILE 398 Cb 0.56 1.45 -0.00 0.00 -3.07 0.00 0.00 36.82 35.75 3mah h ILE 398 CO 0.03 0.39 -0.10 -1.13 -0.69 0.00 0.00 178.15 176.65 3mah h ASN 399 N 0.30 0.00 0.63 1.72 -1.24 -1.08 -1.77 115.58 114.14 3mah h ASN 399 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.05 3mah h ASN 399 Cb 0.67 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.72 3mah h ASN 399 CO 0.05 0.10 0.00 0.00 -1.29 0.00 0.00 177.43 176.29 3mah n ALA 400 N -2.20 1.58 1.00 1.57 0.00 -0.94 -2.43 120.51 119.09 3mah n ALA 400 Ca -0.01 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.65 3mah n ALA 400 Cb 0.27 -1.37 0.21 0.00 0.00 0.00 0.00 19.45 18.56 3mah n ALA 400 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3mah n LEU 401 N -2.22 2.72 -0.21 0.00 4.77 -0.67 -4.55 117.00 116.84 3mah n LEU 401 Ca 0.02 -0.96 0.07 0.00 -0.03 0.00 0.00 56.01 55.11 3mah n LEU 401 Cb 0.20 -0.04 0.15 0.00 -2.33 0.00 0.00 43.42 41.40 3mah n LEU 401 CO 0.18 0.48 0.46 1.17 -1.33 0.00 0.00 177.39 178.36 3mah n LYS 402 N 1.10 -0.05 -0.06 3.23 4.81 -1.02 -0.24 118.16 125.93 3mah n LYS 402 Ca 0.16 0.93 0.11 0.00 -0.87 0.00 0.00 58.31 58.64 3mah n LYS 402 Cb 0.54 -1.45 0.43 0.00 0.02 0.00 0.00 35.03 34.57 3mah n LYS 402 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3mah n GLY 403 N -1.33 0.16 3.34 3.14 0.00 -1.26 -4.92 105.19 104.31 3mah n GLY 403 Ca 0.13 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 3mah n GLY 403 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mah s VAL 404 N -1.85 2.19 0.20 1.61 1.01 0.66 -5.10 120.40 119.11 3mah s VAL 404 Ca 0.34 -1.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 3mah s VAL 404 Cb 0.18 -1.79 -0.08 0.00 0.00 0.00 0.00 36.38 34.69 3mah s VAL 404 CO 0.28 0.52 1.19 -2.84 0.00 0.00 0.00 175.10 174.25 3mah s PRO 405 N -0.81 4.51 -0.10 2.72 0.02 -1.26 -4.98 135.00 135.10 3mah s PRO 405 Ca 0.11 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.02 3mah s PRO 405 Cb -0.10 -3.23 0.01 0.00 0.02 0.00 0.00 34.50 31.19 3mah s PRO 405 CO 0.00 -0.06 -0.18 0.08 -0.33 0.00 0.00 177.00 176.51 3mah s VAL 406 N -0.18 1.65 -1.65 3.83 1.01 -1.26 -4.67 120.40 119.12 3mah s VAL 406 Ca 0.52 -0.76 0.28 0.00 0.00 0.00 0.00 61.98 62.01 3mah s VAL 406 Cb -0.33 -1.47 0.36 0.00 0.00 0.00 0.00 36.38 34.95 3mah s VAL 406 CO 0.37 0.47 1.74 -1.14 0.00 0.00 0.00 175.10 176.54 3mah n ARG 407 N 3.85 0.71 -3.64 2.72 3.00 -0.32 -5.03 116.66 117.94 3mah n ARG 407 Ca -0.20 -0.32 -0.04 0.00 -0.00 0.00 0.00 57.85 57.28 3mah n ARG 407 Cb 0.52 -1.49 -0.07 0.00 0.00 0.00 0.00 32.46 31.42 3mah n ARG 407 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 3mah s ILE 409 N -2.51 0.00 -0.02 5.15 1.01 -1.26 -4.96 121.20 118.60 3mah s ILE 409 Ca 0.26 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.92 3mah s ILE 409 Cb 0.20 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.68 3mah s ILE 409 CO 0.50 0.00 -0.01 -0.55 0.00 0.00 0.00 174.94 174.88 3mah s SER 410 N 0.98 0.38 -0.11 3.58 0.15 -0.22 -4.99 113.70 113.48 3mah s SER 410 Ca -0.05 -0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.51 3mah s SER 410 Cb -0.04 -0.17 0.05 0.00 -1.71 0.00 0.00 66.02 64.15 3mah s SER 410 CO -0.12 -0.06 0.26 -0.47 1.20 0.00 0.00 173.24 174.04 3mah s TYR 411 N 0.70 -0.35 0.00 3.44 5.04 -1.26 -1.28 117.35 123.63 3mah s TYR 411 Ca -0.07 0.82 0.00 0.00 -2.44 0.00 0.00 57.07 55.39 3mah s TYR 411 Cb -0.10 0.06 0.00 0.00 0.35 0.00 0.00 41.96 42.27 3mah s TYR 411 CO -0.01 -0.24 0.00 0.41 -1.34 0.00 0.00 175.55 174.36 3mah n GLY 412 N 4.26 1.15 0.16 8.97 0.00 -1.26 -5.08 105.19 113.39 3mah n GLY 412 Ca -0.25 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 3mah n GLY 412 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3mah h GLY 413 N 0.00 -0.50 0.00 -0.02 0.00 -1.93 -3.45 103.07 97.17 3mah h GLY 413 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3mah h GLY 413 CO 0.00 -0.18 0.00 -1.14 0.00 0.00 0.00 176.54 175.22 3mah n SER 414 N -3.12 0.00 -3.57 0.19 3.41 -1.26 -5.14 113.62 104.13 3mah n SER 414 Ca -0.05 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.39 3mah n SER 414 Cb 0.16 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 3mah n SER 414 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3mah n ASN 415 N 0.00 2.54 -1.51 4.04 5.03 -1.26 -5.04 115.26 119.06 3mah n ASN 415 Ca 0.00 -2.22 0.09 0.00 0.87 0.00 0.00 54.58 53.32 3mah n ASN 415 Cb 0.00 0.13 0.34 0.00 -1.02 0.00 0.00 39.78 39.22 3mah n ASN 415 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3mah n TYR 416 N -0.90 1.39 -2.31 3.10 4.01 -1.26 -4.53 117.16 116.66 3mah n TYR 416 Ca -0.09 -0.55 -0.40 0.00 -0.16 0.00 0.00 57.90 56.70 3mah n TYR 416 Cb 0.37 -0.23 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 3mah n TYR 416 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3mah s ASN 417 N -0.86 7.03 -0.14 7.72 0.01 -1.26 -4.44 114.94 122.99 3mah s ASN 417 Ca 0.48 2.46 -0.03 0.00 -0.71 0.00 0.00 52.86 55.06 3mah s ASN 417 Cb 0.31 -2.64 -0.03 0.00 0.41 0.00 0.00 41.25 39.30 3mah s ASN 417 CO 0.23 -0.33 -0.04 -0.69 -1.51 0.00 0.00 177.10 174.77 3mah s VAL 418 N -1.16 3.92 -0.10 1.60 1.01 -0.20 -4.41 120.40 121.06 3mah s VAL 418 Ca 0.47 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3mah s VAL 418 Cb -0.35 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 3mah s VAL 418 CO 0.46 0.51 -0.09 -0.44 0.00 0.00 0.00 175.10 175.54 3mah s SER 419 N 0.20 4.41 0.01 3.32 0.01 -0.40 -0.94 113.70 120.31 3mah s SER 419 Ca -0.02 -0.15 0.03 0.00 1.31 0.00 0.00 55.95 57.11 3mah s SER 419 Cb -0.14 -1.37 -0.01 0.00 0.21 0.00 0.00 66.02 64.71 3mah s SER 419 CO 0.03 0.26 -0.08 0.68 0.41 0.00 0.00 173.24 174.54 3mah s VAL 420 N -0.23 0.64 -0.14 3.43 -7.23 -0.09 -1.05 120.40 115.73 3mah s VAL 420 Ca 0.02 -0.61 -0.01 0.00 -1.81 0.00 0.00 61.98 59.57 3mah s VAL 420 Cb -0.13 -0.59 -0.02 0.00 0.56 0.00 0.00 36.38 36.20 3mah s VAL 420 CO 0.03 -0.00 -0.10 -0.22 -0.31 0.00 0.00 175.10 174.50 3mah s LEU 421 N -0.67 2.91 0.17 1.32 2.96 -1.26 -0.94 118.68 123.17 3mah s LEU 421 Ca -0.01 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 3mah s LEU 421 Cb -0.05 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 3mah s LEU 421 CO 0.00 0.17 -0.01 0.68 -1.32 0.00 0.00 176.35 175.87 3mah s VAL 422 N 0.35 0.76 0.60 1.68 -7.23 -0.42 -1.17 120.40 114.96 3mah s VAL 422 Ca -0.09 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 57.93 3mah s VAL 422 Cb -0.15 -2.09 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 3mah s VAL 422 CO 0.05 -0.51 1.08 -0.54 -0.31 0.00 0.00 175.10 174.87 3mah s LYS 423 N -3.89 3.18 0.25 4.82 1.02 -1.26 -0.21 119.74 123.64 3mah s LYS 423 Ca 0.23 1.33 -0.04 0.00 0.02 0.00 0.00 55.97 57.51 3mah s LYS 423 Cb 0.06 -2.01 0.45 0.00 -0.52 0.00 0.00 37.83 35.81 3mah s LYS 423 CO 0.04 -0.94 1.76 0.00 -0.92 0.00 0.00 175.35 175.29 3mah h ALA 424 N 0.46 1.14 0.00 5.17 0.00 -1.65 -1.45 119.26 122.92 3mah h ALA 424 Ca -0.47 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3mah h ALA 424 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3mah h ALA 424 CO 0.56 -0.09 0.00 1.05 0.00 0.00 0.00 179.25 180.77 3mah h GLU 425 N 0.59 0.00 -0.18 0.00 4.11 -1.93 -2.35 114.58 114.82 3mah h GLU 425 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.85 3mah h GLU 425 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3mah h GLU 425 CO -0.34 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.49 3mah n ASP 426 N -2.97 2.66 -0.06 3.06 8.00 -0.56 -4.67 116.55 122.01 3mah n ASP 426 Ca -0.03 -1.77 -0.08 0.00 0.71 0.00 0.00 54.79 53.62 3mah n ASP 426 Cb 0.07 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 3mah n ASP 426 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 3mah h LYS 427 N 3.05 0.15 -0.14 -1.24 3.64 -1.25 -1.40 116.57 119.38 3mah h LYS 427 Ca 0.00 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3mah h LYS 427 Cb 0.72 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.50 3mah h LYS 427 CO 0.00 0.10 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.04 3mah h LYS 428 N 0.15 0.26 -0.38 1.90 3.64 -1.83 0.45 116.57 120.76 3mah h LYS 428 Ca 0.11 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 3mah h LYS 428 Cb 0.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 3mah h LYS 428 CO -0.15 0.51 0.17 -0.22 -2.27 0.00 0.00 179.45 177.50 3mah h LYS 429 N -0.03 0.34 -0.41 1.90 3.64 -1.86 -0.39 116.57 119.76 3mah h LYS 429 Ca 0.04 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 3mah h LYS 429 Cb 0.41 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 3mah h LYS 429 CO 0.01 0.23 0.11 0.00 -2.27 0.00 0.00 179.45 177.52 3mah h ALA 430 N 1.22 0.54 -0.51 5.00 0.00 -1.11 -1.84 119.26 122.55 3mah h ALA 430 Ca 0.17 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3mah h ALA 430 Cb 0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3mah h ALA 430 CO -0.14 0.21 0.13 -0.07 0.00 0.00 0.00 179.25 179.38 3mah h LEU 431 N 0.52 0.78 -0.00 0.00 3.38 -0.62 -1.11 115.31 118.26 3mah h LEU 431 Ca 0.13 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3mah h LEU 431 Cb 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3mah h LEU 431 CO 0.00 0.80 -0.02 0.40 0.09 0.00 0.00 178.44 179.71 3mah h ILE 432 N 0.71 0.94 -0.56 1.22 1.08 -0.94 0.98 117.51 120.94 3mah h ILE 432 Ca 0.16 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.66 3mah h ILE 432 Cb 0.33 0.94 -0.04 0.00 -3.07 0.00 0.00 36.82 34.98 3mah h ILE 432 CO 0.00 0.00 0.33 0.00 -0.69 0.00 0.00 178.15 177.79 3mah h ALA 433 N 0.96 0.73 -0.29 1.87 0.00 -1.15 -1.50 119.26 119.87 3mah h ALA 433 Ca 0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3mah h ALA 433 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3mah h ALA 433 CO -0.02 0.04 -0.10 -0.07 0.00 0.00 0.00 179.25 179.09 3mah h LEU 434 N 0.65 0.59 -0.28 0.00 3.38 -1.04 -2.27 115.31 116.34 3mah h LEU 434 Ca 0.23 -0.39 0.01 0.00 0.09 0.00 0.00 57.88 57.83 3mah h LEU 434 Cb 0.05 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3mah h LEU 434 CO -0.11 0.85 0.17 0.28 0.09 0.00 0.00 178.44 179.71 3mah h SER 435 N 0.33 0.27 -0.52 -0.43 0.02 -0.65 0.22 113.55 112.79 3mah h SER 435 Ca 0.07 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.06 3mah h SER 435 Cb 0.60 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.05 3mah h SER 435 CO 0.04 0.20 0.29 0.78 -1.14 0.00 0.00 176.83 176.99 3mah h ASN 436 N 0.34 0.44 0.13 3.07 2.35 -1.29 -0.26 115.58 120.37 3mah h ASN 436 Ca 0.11 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 3mah h ASN 436 Cb -0.00 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.30 3mah h ASN 436 CO -0.05 0.30 -0.06 0.50 -1.65 0.00 0.00 177.43 176.47 3mah h LYS 437 N 0.56 -0.17 -0.93 0.81 1.63 -1.21 -2.24 116.57 115.02 3mah h LYS 437 Ca 0.22 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.05 3mah h LYS 437 Cb 0.09 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.71 3mah h LYS 437 CO -0.13 0.28 0.62 1.25 -3.45 0.00 0.00 179.45 178.02 3mah h LEU 438 N -0.73 1.06 -2.48 5.20 5.85 -0.55 -3.15 115.31 120.51 3mah h LEU 438 Ca -0.02 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3mah h LEU 438 Cb 0.53 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3mah h LEU 438 CO 0.03 0.76 0.00 0.49 -0.34 0.00 0.00 178.44 179.38 3mah n PHE 439 N -4.44 0.66 1.86 1.25 3.72 -0.11 -5.06 117.46 115.33 3mah n PHE 439 Ca 0.11 -0.34 0.15 0.00 -0.05 0.00 0.00 57.45 57.33 3mah n PHE 439 Cb 0.02 -0.00 0.83 0.00 -0.94 0.00 0.00 39.48 39.39 3mah n PHE 439 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98