#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hf9 n GLN 311 N 0.00 3.43 0.14 3.49 7.27 -1.26 -4.01 117.38 126.44 3hf9 n GLN 311 Ca 0.00 -2.19 0.08 0.00 0.07 0.00 0.00 57.00 54.97 3hf9 n GLN 311 Cb 0.00 -1.90 0.06 0.00 2.41 0.00 0.00 30.24 30.81 3hf9 n GLN 311 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hf9 h ALA 312 N 3.58 0.74 0.00 1.69 0.00 -2.06 -2.61 119.26 120.61 3hf9 h ALA 312 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hf9 h ALA 312 Cb 1.36 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3hf9 h ALA 312 CO 0.27 0.25 -0.01 1.98 0.00 0.00 0.00 179.25 181.74 3hf9 h MET 313 N 0.00 0.00 0.02 0.00 1.85 -2.01 -2.80 114.93 112.00 3hf9 h MET 313 Ca -0.02 0.00 -0.29 0.00 -0.61 0.00 0.00 59.70 58.78 3hf9 h MET 313 Cb 1.15 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 33.14 3hf9 h MET 313 CO 0.02 0.01 -1.62 0.00 -0.40 0.00 0.00 176.91 174.92 3hf9 h ARG 314 N 0.00 0.05 0.29 0.39 3.08 -1.74 -2.82 114.38 113.64 3hf9 h ARG 314 Ca -0.00 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 3hf9 h ARG 314 Cb 0.25 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3hf9 h ARG 314 CO 0.00 0.70 -0.23 1.49 -1.07 0.00 0.00 179.97 180.87 3hf9 h GLU 315 N 0.01 -0.50 -0.24 0.04 4.81 -1.30 -1.25 114.58 116.15 3hf9 h GLU 315 Ca -0.26 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.06 3hf9 h GLU 315 Cb 1.98 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 31.43 3hf9 h GLU 315 CO 0.10 -0.34 -0.05 0.00 -0.73 0.00 0.00 179.01 177.99 3hf9 h ARG 316 N -0.52 0.01 -0.51 1.92 3.08 -1.62 -1.08 114.38 115.66 3hf9 h ARG 316 Ca -0.02 -0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.18 3hf9 h ARG 316 Cb 0.46 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 3hf9 h ARG 316 CO -0.01 0.01 0.42 1.03 -1.07 0.00 0.00 179.97 180.35 3hf9 h SER 317 N 0.01 0.00 0.03 7.04 0.87 -1.35 -1.89 113.55 118.26 3hf9 h SER 317 Ca 0.12 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.67 3hf9 h SER 317 Cb 0.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3hf9 h SER 317 CO -0.24 0.00 -0.01 -0.33 -0.53 0.00 0.00 176.83 175.72 3hf9 h GLU 318 N 0.00 -0.04 -0.71 2.24 4.39 0.00 -2.19 114.58 118.27 3hf9 h GLU 318 Ca 0.24 0.00 0.14 0.00 0.34 0.00 0.00 59.36 60.08 3hf9 h GLU 318 Cb 1.07 0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 29.60 3hf9 h GLU 318 CO -0.00 0.54 -0.19 1.25 -1.16 0.00 0.00 179.01 179.44 3hf9 h LEU 319 N -0.96 -0.71 0.91 1.33 5.85 -1.03 0.17 115.31 120.85 3hf9 h LEU 319 Ca -0.00 0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.89 3hf9 h LEU 319 Cb 0.59 0.46 0.01 0.00 0.37 0.00 0.00 40.66 42.09 3hf9 h LEU 319 CO 0.01 -0.24 -0.44 0.00 -0.34 0.00 0.00 178.44 177.43 3hf9 h ALA 320 N 1.67 -1.22 -0.13 1.25 0.00 -1.47 -2.09 119.26 117.27 3hf9 h ALA 320 Ca 0.34 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3hf9 h ALA 320 Cb 0.53 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3hf9 h ALA 320 CO -0.74 -1.16 0.13 -0.09 0.00 0.00 0.00 179.25 177.39 3hf9 h ARG 321 N -1.27 0.00 0.13 0.00 2.43 -0.68 -1.87 114.38 113.12 3hf9 h ARG 321 Ca -0.12 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 3hf9 h ARG 321 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 3hf9 h ARG 321 CO 0.20 0.00 -0.06 0.87 -1.51 0.00 0.00 179.97 179.47 3hf9 h LYS 322 N 0.00 -0.17 -0.94 0.20 1.57 -0.58 -2.66 116.57 113.99 3hf9 h LYS 322 Ca 0.06 0.01 0.21 0.00 -1.87 0.00 0.00 60.65 59.07 3hf9 h LYS 322 Cb 0.31 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.59 3hf9 h LYS 322 CO -0.00 0.24 0.61 0.78 -0.57 0.00 0.00 179.45 180.52 3hf9 h GLY 323 N -0.94 1.02 1.26 3.86 0.00 -0.78 -0.43 103.07 107.06 3hf9 h GLY 323 Ca -0.02 -0.21 -0.19 0.00 0.00 0.00 0.00 47.33 46.91 3hf9 h GLY 323 CO 0.03 -0.03 -0.64 -2.22 0.00 0.00 0.00 176.54 173.68 3hf9 h ILE 324 N 0.45 1.29 0.00 2.60 2.04 -1.43 -2.99 117.51 119.48 3hf9 h ILE 324 Ca 0.50 -1.85 0.00 0.00 1.00 0.00 0.00 64.86 64.51 3hf9 h ILE 324 Cb 1.19 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 3hf9 h ILE 324 CO -0.22 0.59 0.00 0.00 0.00 0.00 0.00 178.15 178.52 3hf9 n ALA 325 N -2.57 1.90 0.73 1.87 0.00 -0.21 -1.68 120.51 120.56 3hf9 n ALA 325 Ca -0.05 -0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.39 3hf9 n ALA 325 Cb 0.67 -1.26 0.01 0.00 0.00 0.00 0.00 19.45 18.87 3hf9 n ALA 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hf9 n ARG 326 N -1.25 1.62 -2.86 0.00 1.74 -0.98 -4.12 116.66 110.82 3hf9 n ARG 326 Ca 0.08 -0.89 -0.21 0.00 -0.77 0.00 0.00 57.85 56.05 3hf9 n ARG 326 Cb 0.12 -1.29 0.02 0.00 -1.02 0.00 0.00 32.46 30.29 3hf9 n ARG 326 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hf9 s ALA 327 N -1.89 3.92 0.59 7.54 0.00 -0.85 -4.91 121.76 126.17 3hf9 s ALA 327 Ca 0.14 -1.27 -0.20 0.00 0.00 0.00 0.00 51.96 50.64 3hf9 s ALA 327 Cb 0.13 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.19 3hf9 s ALA 327 CO 0.40 -0.52 1.29 0.15 0.00 0.00 0.00 175.76 177.08 3hf9 s LYS 328 N -4.61 2.90 0.44 0.00 -0.14 -1.26 -1.97 119.74 115.10 3hf9 s LYS 328 Ca 0.53 2.06 -0.13 0.00 -1.36 0.00 0.00 55.97 57.08 3hf9 s LYS 328 Cb -0.10 -2.03 -0.07 0.00 -1.68 0.00 0.00 37.83 33.95 3hf9 s LYS 328 CO 0.37 -1.33 0.84 -1.12 -0.76 0.00 0.00 175.35 173.36 3hf9 s SER 329 N -1.28 6.56 0.01 2.83 0.01 -1.26 -4.29 113.70 116.28 3hf9 s SER 329 Ca 0.77 1.28 0.00 0.00 1.31 0.00 0.00 55.95 59.31 3hf9 s SER 329 Cb -0.37 -2.39 -0.01 0.00 0.21 0.00 0.00 66.02 63.46 3hf9 s SER 329 CO 0.41 -0.46 -0.02 -0.69 0.41 0.00 0.00 173.24 172.88 3hf9 s VAL 330 N -2.46 0.11 -0.01 3.43 1.01 0.21 -2.51 120.40 120.18 3hf9 s VAL 330 Ca 0.54 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.99 3hf9 s VAL 330 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 36.08 3hf9 s VAL 330 CO 0.31 -0.28 -0.08 -0.69 0.00 0.00 0.00 175.10 174.37 3hf9 s VAL 331 N -0.85 0.61 -0.06 2.92 1.01 0.10 -1.31 120.40 122.83 3hf9 s VAL 331 Ca -0.09 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.57 3hf9 s VAL 331 Cb -0.06 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.82 3hf9 s VAL 331 CO -0.01 0.18 -0.05 0.00 0.00 0.00 0.00 175.10 175.22 3hf9 s ALA 332 N -0.16 0.86 0.04 5.51 0.00 -0.56 -0.48 121.76 126.97 3hf9 s ALA 332 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 51.80 3hf9 s ALA 332 Cb -0.03 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 3hf9 s ALA 332 CO -0.00 -0.12 -0.04 -0.48 0.00 0.00 0.00 175.76 175.12 3hf9 s LEU 333 N 1.15 2.38 -0.17 0.00 2.34 -0.55 0.00 118.68 123.82 3hf9 s LEU 333 Ca -0.07 -0.77 -0.14 0.00 0.06 0.00 0.00 54.13 53.20 3hf9 s LEU 333 Cb -0.14 0.09 -0.05 0.00 -0.56 0.00 0.00 46.19 45.54 3hf9 s LEU 333 CO -0.01 -0.43 0.31 0.00 -1.06 0.00 0.00 176.35 175.15 3hf9 s ALA 334 N -2.73 3.58 0.33 1.48 0.00 0.13 -1.02 121.76 123.52 3hf9 s ALA 334 Ca -0.03 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.50 3hf9 s ALA 334 Cb -0.01 -2.43 -0.06 0.00 0.00 0.00 0.00 23.12 20.62 3hf9 s ALA 334 CO -0.05 0.02 0.07 1.52 0.00 0.00 0.00 175.76 177.32 3hf9 s TYR 335 N 0.61 1.90 0.25 0.00 -0.85 0.11 -4.43 117.35 114.93 3hf9 s TYR 335 Ca 0.17 -1.02 -0.06 0.00 -0.52 0.00 0.00 57.07 55.64 3hf9 s TYR 335 Cb -0.13 -1.23 0.28 0.00 0.38 0.00 0.00 41.96 41.26 3hf9 s TYR 335 CO 0.05 -0.06 1.90 0.00 -1.52 0.00 0.00 175.55 175.92 3hf9 h ALA 336 N 2.10 1.24 -0.75 9.51 0.00 -1.68 -2.69 119.26 126.99 3hf9 h ALA 336 Ca -0.40 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3hf9 h ALA 336 Cb 1.25 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3hf9 h ALA 336 CO 0.67 0.52 0.26 0.78 0.00 0.00 0.00 179.25 181.48 3hf9 h GLY 337 N 1.22 1.23 0.00 0.00 0.00 -1.93 -3.49 103.07 100.10 3hf9 h GLY 337 Ca 0.37 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hf9 h GLY 337 CO -0.11 0.65 0.00 0.61 0.00 0.00 0.00 176.54 177.69 3hf9 n GLY 338 N -0.83 -0.61 3.75 4.60 0.00 -1.01 -2.97 105.19 108.12 3hf9 n GLY 338 Ca 0.06 -0.56 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 3hf9 n GLY 338 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hf9 s VAL 339 N -4.00 5.28 -0.13 1.61 1.01 -1.07 -0.72 120.40 122.39 3hf9 s VAL 339 Ca 0.00 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 3hf9 s VAL 339 Cb 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3hf9 s VAL 339 CO 0.00 0.50 -0.03 -0.22 0.00 0.00 0.00 175.10 175.35 3hf9 s LEU 340 N -0.07 3.32 -0.17 3.92 2.96 -0.19 -0.23 118.68 128.22 3hf9 s LEU 340 Ca 0.09 -0.06 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 3hf9 s LEU 340 Cb -0.12 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 3hf9 s LEU 340 CO 0.00 0.23 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.83 3hf9 s PHE 341 N 0.01 2.93 -0.06 5.38 0.08 0.29 -1.49 117.98 125.13 3hf9 s PHE 341 Ca 0.01 -0.59 -0.00 0.00 0.12 0.00 0.00 56.93 56.46 3hf9 s PHE 341 Cb -0.13 -1.96 0.03 0.00 -0.57 0.00 0.00 43.02 40.38 3hf9 s PHE 341 CO 0.02 -0.24 -0.02 0.08 -0.10 0.00 0.00 175.22 174.96 3hf9 s VAL 342 N 0.68 0.47 0.01 -0.44 1.01 0.37 -2.03 120.40 120.45 3hf9 s VAL 342 Ca -0.04 0.01 0.03 0.00 0.00 0.00 0.00 61.98 61.97 3hf9 s VAL 342 Cb -0.15 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 3hf9 s VAL 342 CO 0.02 0.25 -0.09 0.00 0.00 0.00 0.00 175.10 175.29 3hf9 s ALA 343 N 1.52 0.70 -0.09 5.51 0.00 -0.67 0.02 121.76 128.76 3hf9 s ALA 343 Ca -0.02 -0.45 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 3hf9 s ALA 343 Cb -0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 3hf9 s ALA 343 CO -0.03 0.14 1.17 -1.83 0.00 0.00 0.00 175.76 175.21 3hf9 s GLU 344 N -0.49 4.34 -0.27 0.00 -1.05 -1.05 -1.34 118.70 118.85 3hf9 s GLU 344 Ca 0.01 1.61 -0.00 0.00 -0.15 0.00 0.00 54.97 56.44 3hf9 s GLU 344 Cb -0.05 -3.59 0.15 0.00 -0.44 0.00 0.00 34.13 30.21 3hf9 s GLU 344 CO -0.00 -0.47 0.40 1.21 0.95 0.00 0.00 175.26 177.36 3hf9 s ASN 345 N 1.47 0.22 0.01 0.83 3.84 -0.27 -4.65 114.94 116.40 3hf9 s ASN 345 Ca 0.54 -0.02 -0.25 0.00 0.21 0.00 0.00 52.86 53.34 3hf9 s ASN 345 Cb -0.23 1.17 -0.17 0.00 -0.55 0.00 0.00 41.25 41.47 3hf9 s ASN 345 CO 0.20 -0.32 1.31 -0.65 -2.79 0.00 0.00 177.10 174.85 3hf9 h PRO 346 N 8.16 -0.25 -6.43 0.43 0.11 -1.89 -3.33 132.00 128.82 3hf9 h PRO 346 Ca -0.15 0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.38 3hf9 h PRO 346 Cb 1.14 0.06 0.15 0.00 0.11 0.00 0.00 31.00 32.45 3hf9 h PRO 346 CO 0.27 0.08 -0.28 0.45 -0.21 0.00 0.00 178.00 178.30 3hf9 n SER 347 N -5.06 -0.46 -0.30 -2.05 2.88 -1.26 -4.84 113.62 102.53 3hf9 n SER 347 Ca -0.09 0.90 0.06 0.00 -1.33 0.00 0.00 58.87 58.42 3hf9 n SER 347 Cb 0.23 -1.17 -0.00 0.00 -0.75 0.00 0.00 64.21 62.51 3hf9 n SER 347 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 3hf9 n ARG 348 N 0.37 1.87 -0.00 -1.46 1.85 -1.26 -4.54 116.66 113.49 3hf9 n ARG 348 Ca 0.11 -0.71 0.00 0.00 -1.00 0.00 0.00 57.85 56.26 3hf9 n ARG 348 Cb 0.41 -1.18 -0.00 0.00 -1.05 0.00 0.00 32.46 30.63 3hf9 n ARG 348 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 3hf9 n SER 349 N -0.19 3.20 -4.55 2.89 3.41 -1.26 -5.00 113.62 112.11 3hf9 n SER 349 Ca 0.05 -0.18 -0.35 0.00 -0.26 0.00 0.00 58.87 58.13 3hf9 n SER 349 Cb 0.28 1.01 -0.11 0.00 -0.26 0.00 0.00 64.21 65.13 3hf9 n SER 349 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hf9 s LEU 350 N -2.67 3.63 -0.05 1.04 1.43 -1.26 -5.09 118.68 115.71 3hf9 s LEU 350 Ca -0.00 -0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.11 3hf9 s LEU 350 Cb 0.00 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 3hf9 s LEU 350 CO 0.02 0.09 -0.25 -1.10 0.23 0.00 0.00 176.35 175.33 3hf9 s GLN 351 N 0.89 2.51 -0.00 1.70 -0.21 -1.26 -4.81 119.66 118.48 3hf9 s GLN 351 Ca 0.04 -0.90 0.16 0.00 0.02 0.00 0.00 55.36 54.68 3hf9 s GLN 351 Cb -0.14 -2.16 -0.18 0.00 1.00 0.00 0.00 33.01 31.53 3hf9 s GLN 351 CO 0.03 0.41 0.68 1.63 -2.12 0.00 0.00 175.29 175.91 3hf9 n LYS 352 N 2.88 1.58 -4.88 2.91 5.02 -1.26 -4.93 118.16 119.47 3hf9 n LYS 352 Ca -0.17 -0.01 -0.26 0.00 -2.02 0.00 0.00 58.31 55.85 3hf9 n LYS 352 Cb 0.52 -1.27 -0.15 0.00 -0.02 0.00 0.00 35.03 34.10 3hf9 n LYS 352 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hf9 s ILE 353 N -2.56 1.52 0.25 -0.18 1.01 -1.26 -1.09 121.20 118.90 3hf9 s ILE 353 Ca 0.06 -0.87 -0.22 0.00 0.00 0.00 0.00 60.65 59.62 3hf9 s ILE 353 Cb 0.12 -1.28 0.03 0.00 0.01 0.00 0.00 42.46 41.35 3hf9 s ILE 353 CO 0.67 0.39 0.71 -0.55 0.00 0.00 0.00 174.94 176.16 3hf9 s SER 354 N -0.56 -0.31 -0.20 3.58 0.15 0.12 -4.99 113.70 111.49 3hf9 s SER 354 Ca 0.07 -0.50 -0.11 0.00 0.70 0.00 0.00 55.95 56.12 3hf9 s SER 354 Cb -0.08 0.70 -0.05 0.00 -1.71 0.00 0.00 66.02 64.88 3hf9 s SER 354 CO -0.00 -1.26 0.15 -0.70 1.20 0.00 0.00 173.24 172.62 3hf9 s GLU 355 N -3.86 4.18 -0.17 5.44 2.12 -1.26 0.07 118.70 125.22 3hf9 s GLU 355 Ca 0.09 -0.19 0.03 0.00 0.36 0.00 0.00 54.97 55.26 3hf9 s GLU 355 Cb -0.05 -3.44 -0.22 0.00 0.26 0.00 0.00 34.13 30.68 3hf9 s GLU 355 CO 0.03 0.26 0.15 1.28 -0.54 0.00 0.00 175.26 176.44 3hf9 n LEU 356 N 3.65 2.09 0.00 2.70 4.77 -0.19 -4.93 117.00 125.09 3hf9 n LEU 356 Ca -0.15 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3hf9 n LEU 356 Cb 0.52 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3hf9 n LEU 356 CO 0.37 0.76 0.00 0.00 -1.33 0.00 0.00 177.39 177.19 3hf9 n TYR 357 N -3.23 -0.50 -0.14 -1.77 9.36 -0.52 -4.67 117.16 115.69 3hf9 n TYR 357 Ca -0.35 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 60.81 3hf9 n TYR 357 Cb 1.05 0.00 0.03 0.00 -0.63 0.00 0.00 39.34 39.78 3hf9 n TYR 357 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 3hf9 h ASP 358 N 0.00 0.32 -0.09 2.98 3.32 -1.94 -3.26 116.42 117.75 3hf9 h ASP 358 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3hf9 h ASP 358 Cb 0.00 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3hf9 h ASP 358 CO 0.00 0.23 0.00 0.54 -1.72 0.00 0.00 179.24 178.29 3hf9 n ARG 359 N -4.91 1.63 -5.10 3.56 5.12 -1.26 -0.36 116.66 115.34 3hf9 n ARG 359 Ca 0.02 -1.36 -0.30 0.00 -1.93 0.00 0.00 57.85 54.29 3hf9 n ARG 359 Cb 0.11 -1.11 -0.17 0.00 -1.16 0.00 0.00 32.46 30.13 3hf9 n ARG 359 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3hf9 s VAL 360 N -0.76 1.84 0.50 1.55 0.11 -1.23 -1.87 120.40 120.54 3hf9 s VAL 360 Ca 0.08 -0.93 0.05 0.00 -2.93 0.00 0.00 61.98 58.25 3hf9 s VAL 360 Cb 0.05 -1.58 -0.01 0.00 -1.53 0.00 0.00 36.38 33.32 3hf9 s VAL 360 CO 0.07 0.51 0.20 -0.83 -3.33 0.00 0.00 175.10 171.72 3hf9 s GLY 361 N 0.07 2.59 -0.14 6.54 0.00 -0.26 -1.03 107.32 115.08 3hf9 s GLY 361 Ca -0.08 -1.21 -0.09 0.00 0.00 0.00 0.00 44.72 43.34 3hf9 s GLY 361 CO 0.05 -2.02 0.35 -0.12 0.00 0.00 0.00 173.10 171.35 3hf9 s PHE 362 N -2.76 -0.48 0.00 1.90 2.19 0.11 -1.40 117.98 117.54 3hf9 s PHE 362 Ca 0.26 1.07 0.01 0.00 0.33 0.00 0.00 56.93 58.60 3hf9 s PHE 362 Cb 0.01 0.17 -0.00 0.00 -1.31 0.00 0.00 43.02 41.89 3hf9 s PHE 362 CO 0.15 -0.28 -0.03 0.00 1.83 0.00 0.00 175.22 176.89 3hf9 s ALA 363 N 1.11 0.24 0.08 11.12 0.00 -0.14 0.15 121.76 134.32 3hf9 s ALA 363 Ca -0.08 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 51.72 3hf9 s ALA 363 Cb -0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3hf9 s ALA 363 CO -0.09 0.04 -0.06 0.00 0.00 0.00 0.00 175.76 175.65 3hf9 s ALA 364 N -0.22 0.79 0.09 0.00 0.00 -0.25 0.74 121.76 122.92 3hf9 s ALA 364 Ca -0.01 -1.18 0.06 0.00 0.00 0.00 0.00 51.96 50.83 3hf9 s ALA 364 Cb -0.02 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 3hf9 s ALA 364 CO -0.00 -0.21 -0.15 0.00 0.00 0.00 0.00 175.76 175.40 3hf9 s ALA 365 N -3.15 1.35 0.00 0.00 0.00 -0.35 -4.81 121.76 114.81 3hf9 s ALA 365 Ca 0.06 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.88 3hf9 s ALA 365 Cb 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.04 3hf9 s ALA 365 CO -0.04 0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.28 3hf9 n GLY 366 N 0.97 0.30 3.66 0.00 0.00 -1.26 -1.55 105.19 107.32 3hf9 n GLY 366 Ca -0.19 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 3hf9 n GLY 366 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hf9 s LYS 367 N -0.59 4.28 0.05 1.61 2.20 -0.80 -4.90 119.74 121.59 3hf9 s LYS 367 Ca 0.00 1.36 -0.24 0.00 -0.36 0.00 0.00 55.97 56.72 3hf9 s LYS 367 Cb 0.00 -3.63 -0.12 0.00 -1.51 0.00 0.00 37.83 32.57 3hf9 s LYS 367 CO 0.00 -0.59 1.38 0.35 -0.36 0.00 0.00 175.35 176.12 3hf9 h PHE 368 N 7.41 -0.92 -1.23 4.03 3.57 -1.96 -2.08 116.94 125.76 3hf9 h PHE 368 Ca -0.20 -0.00 0.36 0.00 3.53 0.00 0.00 57.97 61.65 3hf9 h PHE 368 Cb 1.07 0.34 -0.05 0.00 2.79 0.00 0.00 35.95 40.10 3hf9 h PHE 368 CO 0.75 -0.47 1.05 -2.95 -2.23 0.00 0.00 178.31 174.45 3hf9 h ASN 369 N -0.75 0.00 0.00 0.41 -1.07 -1.99 0.14 115.58 112.33 3hf9 h ASN 369 Ca -0.06 0.00 -0.06 0.00 0.07 0.00 0.00 56.30 56.25 3hf9 h ASN 369 Cb 0.62 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.86 3hf9 h ASN 369 CO 0.01 0.00 -0.43 -0.33 0.07 0.00 0.00 177.43 176.75 3hf9 h GLU 370 N 0.00 0.00 0.00 4.14 5.08 -1.86 -3.07 114.58 118.88 3hf9 h GLU 370 Ca 0.58 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.86 3hf9 h GLU 370 Cb 2.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.91 3hf9 h GLU 370 CO -0.01 0.63 -0.41 0.27 -1.00 0.00 0.00 179.01 178.49 3hf9 h PHE 371 N -1.00 0.00 0.18 4.33 -5.15 -0.59 -2.31 116.94 112.41 3hf9 h PHE 371 Ca -0.10 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.66 3hf9 h PHE 371 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.96 3hf9 h PHE 371 CO 0.09 0.41 -0.09 0.22 -2.00 0.00 0.00 178.31 176.94 3hf9 h ASP 372 N 0.00 -0.21 -0.89 -0.68 3.58 -0.93 -0.89 116.42 116.40 3hf9 h ASP 372 Ca -0.00 -0.20 0.18 0.00 0.42 0.00 0.00 57.03 57.42 3hf9 h ASP 372 Cb 0.78 0.05 -0.17 0.00 1.72 0.00 0.00 39.33 41.72 3hf9 h ASP 372 CO 0.05 0.10 -0.23 -3.20 -2.88 0.00 0.00 179.24 173.08 3hf9 n ASN 373 N -5.07 -0.34 -0.23 2.28 5.15 -1.14 -0.50 115.26 115.40 3hf9 n ASN 373 Ca -0.09 1.54 -0.07 0.00 -0.60 0.00 0.00 54.58 55.36 3hf9 n ASN 373 Cb 0.21 -0.46 0.04 0.00 -0.53 0.00 0.00 39.78 39.05 3hf9 n ASN 373 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3hf9 h LEU 374 N 0.00 0.90 -0.85 1.20 3.38 -0.94 -2.09 115.31 116.91 3hf9 h LEU 374 Ca 0.42 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 58.32 3hf9 h LEU 374 Cb 0.65 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 3hf9 h LEU 374 CO -0.92 0.83 0.49 -0.09 0.09 0.00 0.00 178.44 178.83 3hf9 h ARG 375 N 0.92 0.78 -0.16 1.13 2.43 0.63 0.37 114.38 120.48 3hf9 h ARG 375 Ca 0.22 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 3hf9 h ARG 375 Cb 0.21 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 3hf9 h ARG 375 CO -0.02 0.51 -0.06 0.00 -1.51 0.00 0.00 179.97 178.89 3hf9 h ARG 376 N 0.80 0.32 -0.24 0.20 3.08 -0.89 -1.37 114.38 116.28 3hf9 h ARG 376 Ca 0.42 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.34 3hf9 h ARG 376 Cb 0.41 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3hf9 h ARG 376 CO -0.26 0.63 0.16 0.78 -1.07 0.00 0.00 179.97 180.21 3hf9 h GLY 377 N 0.00 0.34 0.57 0.04 0.00 -0.93 0.56 103.07 103.64 3hf9 h GLY 377 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 3hf9 h GLY 377 CO 0.02 0.12 -0.00 -1.33 0.00 0.00 0.00 176.54 175.35 3hf9 h GLY 378 N 0.33 0.00 0.53 4.60 0.00 -0.62 -1.14 103.07 106.78 3hf9 h GLY 378 Ca 0.09 -0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.48 3hf9 h GLY 378 CO -0.02 0.00 0.11 -2.22 0.00 0.00 0.00 176.54 174.41 3hf9 h ILE 379 N -0.43 0.81 -0.41 2.60 2.04 -0.86 -0.22 117.51 121.04 3hf9 h ILE 379 Ca 0.00 -0.08 0.07 0.00 1.00 0.00 0.00 64.86 65.85 3hf9 h ILE 379 Cb 0.43 0.54 -0.09 0.00 -0.74 0.00 0.00 36.82 36.97 3hf9 h ILE 379 CO 0.00 0.04 -0.40 1.56 0.00 0.00 0.00 178.15 179.35 3hf9 h GLN 380 N 0.25 -0.30 0.13 2.37 1.08 -0.87 -0.27 115.11 117.50 3hf9 h GLN 380 Ca 0.20 0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.41 3hf9 h GLN 380 Cb 0.23 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 3hf9 h GLN 380 CO -0.24 -0.20 -0.06 0.35 -0.95 0.00 0.00 178.83 177.73 3hf9 h PHE 381 N -0.31 -0.17 0.18 2.96 3.57 -0.83 -2.51 116.94 119.84 3hf9 h PHE 381 Ca 0.15 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.66 3hf9 h PHE 381 Cb 0.57 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 3hf9 h PHE 381 CO -0.60 -0.05 -0.27 0.00 -2.23 0.00 0.00 178.31 175.16 3hf9 h ALA 382 N 0.61 -0.51 -0.98 2.41 0.00 -0.79 -0.95 119.26 119.07 3hf9 h ALA 382 Ca -0.02 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.89 3hf9 h ALA 382 Cb 0.19 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 3hf9 h ALA 382 CO 0.03 -0.83 0.63 -0.44 0.00 0.00 0.00 179.25 178.65 3hf9 h ASP 383 N -0.52 1.01 0.01 0.00 3.32 -1.02 -1.13 116.42 118.09 3hf9 h ASP 383 Ca 0.01 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 3hf9 h ASP 383 Cb 0.52 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3hf9 h ASP 383 CO -0.12 0.66 -0.00 0.74 -1.72 0.00 0.00 179.24 178.80 3hf9 h THR 384 N 1.15 1.04 -0.12 0.35 2.02 -0.96 -2.36 112.91 114.03 3hf9 h THR 384 Ca 0.41 -0.14 0.03 0.00 0.77 0.00 0.00 66.41 67.48 3hf9 h THR 384 Cb 0.14 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 3hf9 h THR 384 CO -0.16 0.04 -0.05 0.03 0.37 0.00 0.00 175.52 175.76 3hf9 h ARG 385 N -0.07 -0.03 -0.61 6.66 2.47 -0.31 -1.07 114.38 121.42 3hf9 h ARG 385 Ca -0.00 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 58.86 3hf9 h ARG 385 Cb 0.07 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.36 3hf9 h ARG 385 CO 0.00 -0.02 0.42 0.78 0.56 0.00 0.00 179.97 181.72 3hf9 h GLY 386 N -0.03 0.31 1.38 0.04 0.00 -1.21 0.17 103.07 103.73 3hf9 h GLY 386 Ca 0.06 -0.08 -0.29 0.00 0.00 0.00 0.00 47.33 47.02 3hf9 h GLY 386 CO -0.14 0.03 -1.25 -1.82 0.00 0.00 0.00 176.54 173.36 3hf9 h TYR 387 N 0.19 0.83 0.00 5.60 3.20 -1.02 -3.31 116.97 122.46 3hf9 h TYR 387 Ca 0.29 -0.55 0.00 0.00 3.14 0.00 0.00 58.73 61.61 3hf9 h TYR 387 Cb 0.89 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.11 3hf9 h TYR 387 CO -0.00 1.40 -0.06 0.00 -1.64 0.00 0.00 178.16 177.87 3hf9 n ALA 388 N -2.63 2.38 -2.00 1.82 0.00 -0.44 -4.83 120.51 114.80 3hf9 n ALA 388 Ca -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3hf9 n ALA 388 Cb 1.00 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 19.01 3hf9 n ALA 388 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hf9 n TYR 389 N -2.02 0.00 -4.43 0.00 4.01 0.48 -5.07 117.16 110.13 3hf9 n TYR 389 Ca 0.06 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.58 3hf9 n TYR 389 Cb 0.40 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.33 3hf9 n TYR 389 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 3hf9 s ASP 390 N 1.00 2.79 0.61 7.72 3.84 -1.25 -4.97 116.67 126.41 3hf9 s ASP 390 Ca 0.00 -1.19 0.40 0.00 -0.00 0.00 0.00 52.55 51.76 3hf9 s ASP 390 Cb 0.00 -0.17 2.03 0.00 -1.38 0.00 0.00 42.92 43.40 3hf9 s ASP 390 CO 0.00 -0.34 2.22 0.03 -0.00 0.00 0.00 175.17 177.08 3hf9 h ARG 391 N 2.27 0.00 -0.31 2.11 3.08 -1.90 -2.88 114.38 116.75 3hf9 h ARG 391 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 3hf9 h ARG 391 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 3hf9 h ARG 391 CO 0.67 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 180.11 3hf9 n ARG 392 N -3.05 1.99 0.19 0.04 1.74 -1.26 -3.39 116.66 112.93 3hf9 n ARG 392 Ca -0.02 -1.51 0.08 0.00 -0.77 0.00 0.00 57.85 55.64 3hf9 n ARG 392 Cb 0.15 -1.40 0.14 0.00 -1.02 0.00 0.00 32.46 30.33 3hf9 n ARG 392 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 3hf9 h ASP 393 N 2.79 0.00 -3.18 0.55 3.58 -1.88 -3.44 116.42 114.84 3hf9 h ASP 393 Ca 0.00 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.88 3hf9 h ASP 393 Cb 0.62 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.62 3hf9 h ASP 393 CO 0.00 0.21 0.65 -0.69 -2.88 0.00 0.00 179.24 176.54 3hf9 s VAL 394 N -3.14 4.75 0.04 2.25 1.01 -1.22 -4.95 120.40 119.14 3hf9 s VAL 394 Ca 0.05 1.96 0.01 0.00 0.00 0.00 0.00 61.98 64.00 3hf9 s VAL 394 Cb 0.06 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 3hf9 s VAL 394 CO 0.69 -0.09 -0.05 0.42 0.00 0.00 0.00 175.10 176.07 3hf9 s THR 395 N 2.66 0.35 0.14 3.92 -4.23 -1.26 -4.96 115.64 112.26 3hf9 s THR 395 Ca 0.44 -1.20 -0.19 0.00 -1.18 0.00 0.00 61.69 59.56 3hf9 s THR 395 Cb -0.16 -0.71 0.00 0.00 1.34 0.00 0.00 72.50 72.97 3hf9 s THR 395 CO 0.11 -0.56 1.71 1.23 -0.54 0.00 0.00 174.62 176.56 3hf9 h GLY 396 N 4.21 0.23 -0.49 3.99 0.00 -1.94 -1.74 103.07 107.34 3hf9 h GLY 396 Ca -0.34 0.05 0.13 0.00 0.00 0.00 0.00 47.33 47.17 3hf9 h GLY 396 CO 0.47 -0.07 -0.24 -0.09 0.00 0.00 0.00 176.54 176.61 3hf9 h ARG 397 N 0.05 -0.05 0.74 4.80 1.12 -1.95 -1.54 114.38 117.55 3hf9 h ARG 397 Ca 0.13 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.96 3hf9 h ARG 397 Cb 0.17 0.01 0.01 0.00 -0.01 0.00 0.00 29.97 30.15 3hf9 h ARG 397 CO -0.23 -0.03 -0.36 0.37 -3.11 0.00 0.00 179.97 176.61 3hf9 h GLN 398 N -0.05 -0.96 -0.53 0.20 4.15 -1.71 -2.48 115.11 113.74 3hf9 h GLN 398 Ca 0.32 0.07 0.09 0.00 0.77 0.00 0.00 58.65 59.89 3hf9 h GLN 398 Cb 0.55 0.22 -0.07 0.00 0.21 0.00 0.00 27.48 28.38 3hf9 h GLN 398 CO -0.75 -0.62 0.12 -0.07 -1.93 0.00 0.00 178.83 175.59 3hf9 h LEU 399 N -1.10 0.04 -0.32 -2.39 3.38 -1.04 -1.17 115.31 112.71 3hf9 h LEU 399 Ca -0.10 0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.03 3hf9 h LEU 399 Cb 0.78 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 3hf9 h LEU 399 CO 0.17 0.04 -0.12 0.00 0.09 0.00 0.00 178.44 178.62 3hf9 h ALA 400 N 1.40 0.15 -0.82 1.53 0.00 -1.33 0.42 119.26 120.62 3hf9 h ALA 400 Ca 0.27 0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.49 3hf9 h ALA 400 Cb 0.36 0.31 -0.12 0.00 0.00 0.00 0.00 17.79 18.33 3hf9 h ALA 400 CO -0.33 -0.50 0.25 -0.97 0.00 0.00 0.00 179.25 177.70 3hf9 h ASN 401 N -0.06 0.09 0.11 0.00 -0.73 -0.79 0.27 115.58 114.48 3hf9 h ASN 401 Ca 0.16 0.16 -0.01 0.00 1.87 0.00 0.00 56.30 58.49 3hf9 h ASN 401 Cb 0.30 0.20 0.00 0.00 0.27 0.00 0.00 38.32 39.09 3hf9 h ASN 401 CO -0.36 -0.06 -0.05 0.58 -0.37 0.00 0.00 177.43 177.17 3hf9 h VAL 402 N 0.29 1.06 -0.98 2.57 2.07 0.00 -1.79 116.25 119.48 3hf9 h VAL 402 Ca 0.49 -0.73 0.14 0.00 0.82 0.00 0.00 66.70 67.42 3hf9 h VAL 402 Cb 0.90 1.52 -0.09 0.00 -1.52 0.00 0.00 31.29 32.11 3hf9 h VAL 402 CO -0.55 0.18 0.62 1.88 0.02 0.00 0.00 177.57 179.71 3hf9 h TYR 403 N -0.50 1.06 -0.06 1.57 0.05 -0.54 -1.22 116.97 117.33 3hf9 h TYR 403 Ca -0.02 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3hf9 h TYR 403 Cb 0.40 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 3hf9 h TYR 403 CO 0.04 0.37 0.03 0.00 -1.05 0.00 0.00 178.16 177.55 3hf9 h ALA 404 N 1.58 0.07 0.00 3.88 0.00 -0.03 0.46 119.26 125.21 3hf9 h ALA 404 Ca 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 3hf9 h ALA 404 Cb 0.64 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3hf9 h ALA 404 CO -0.28 -0.45 -0.14 1.96 0.00 0.00 0.00 179.25 180.34 3hf9 h GLN 405 N 0.06 0.00 0.00 0.00 4.20 -0.78 0.12 115.11 118.71 3hf9 h GLN 405 Ca 0.02 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 3hf9 h GLN 405 Cb 0.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 3hf9 h GLN 405 CO -0.02 0.14 -0.06 1.15 -0.67 0.00 0.00 178.83 179.38 3hf9 h THR 406 N 0.00 1.11 -1.00 -0.54 2.02 -0.73 -2.50 112.91 111.28 3hf9 h THR 406 Ca -0.00 -1.85 0.06 0.00 0.77 0.00 0.00 66.41 65.39 3hf9 h THR 406 Cb 0.49 2.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.95 3hf9 h THR 406 CO 0.02 0.38 0.65 -0.07 0.37 0.00 0.00 175.52 176.86 3hf9 h LEU 407 N -1.00 1.05 -0.51 2.58 3.38 -0.81 -0.40 115.31 119.59 3hf9 h LEU 407 Ca -0.01 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.99 3hf9 h LEU 407 Cb 0.66 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3hf9 h LEU 407 CO -0.01 0.68 0.29 1.23 0.09 0.00 0.00 178.44 180.73 3hf9 h GLY 408 N 1.19 0.73 0.82 0.83 0.00 -0.85 0.53 103.07 106.31 3hf9 h GLY 408 Ca 0.42 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 3hf9 h GLY 408 CO -0.16 0.17 0.02 -0.84 0.00 0.00 0.00 176.54 175.73 3hf9 h THR 409 N 0.58 1.17 -0.40 4.70 2.02 -0.89 -2.59 112.91 117.50 3hf9 h THR 409 Ca 0.21 -0.50 0.04 0.00 0.77 0.00 0.00 66.41 66.94 3hf9 h THR 409 Cb 0.06 1.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 3hf9 h THR 409 CO -0.11 0.14 0.15 0.40 0.37 0.00 0.00 175.52 176.47 3hf9 h ILE 410 N -0.11 0.90 0.00 3.11 2.04 -0.81 0.19 117.51 122.84 3hf9 h ILE 410 Ca 0.02 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 3hf9 h ILE 410 Cb 0.21 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3hf9 h ILE 410 CO -0.00 0.06 -0.01 0.15 0.00 0.00 0.00 178.15 178.34 3hf9 h PHE 411 N 0.32 0.00 0.00 1.37 3.57 -0.81 -2.09 116.94 119.30 3hf9 h PHE 411 Ca 0.18 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.47 3hf9 h PHE 411 Cb 0.15 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3hf9 h PHE 411 CO -0.14 0.01 -1.20 2.41 -2.23 0.00 0.00 178.31 177.16 3hf9 n THR 412 N -3.98 1.52 0.39 4.41 -1.04 -0.54 -4.78 114.28 110.26 3hf9 n THR 412 Ca -0.03 -0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.03 3hf9 n THR 412 Cb 0.10 -2.08 -0.08 0.00 -1.82 0.00 0.00 70.33 66.45 3hf9 n THR 412 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3hf9 n GLU 413 N -4.45 2.23 -2.56 -2.82 1.02 0.57 -4.99 120.64 109.64 3hf9 n GLU 413 Ca -0.30 -0.03 -0.23 0.00 -0.02 0.00 0.00 57.16 56.58 3hf9 n GLU 413 Cb 0.64 -1.14 0.07 0.00 -0.02 0.00 0.00 31.44 30.99 3hf9 n GLU 413 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3hf9 s GLN 414 N -2.35 2.15 0.09 3.49 -0.21 -0.79 -5.02 119.66 117.01 3hf9 s GLN 414 Ca 0.02 -0.84 -0.14 0.00 0.02 0.00 0.00 55.36 54.42 3hf9 s GLN 414 Cb 0.09 -2.38 -0.16 0.00 1.00 0.00 0.00 33.01 31.56 3hf9 s GLN 414 CO 0.50 -1.08 1.30 0.00 -2.12 0.00 0.00 175.29 173.89 3hf9 h ALA 415 N -0.26 0.30 -3.86 6.09 0.00 -1.94 -3.44 119.26 116.14 3hf9 h ALA 415 Ca -0.40 -0.57 -0.47 0.00 0.00 0.00 0.00 54.91 53.47 3hf9 h ALA 415 Cb 1.29 -0.02 -0.31 0.00 0.00 0.00 0.00 17.79 18.75 3hf9 h ALA 415 CO 0.48 0.61 -0.80 0.21 0.00 0.00 0.00 179.25 179.76 3hf9 s LYS 416 N -3.78 1.20 0.50 0.00 2.20 -1.26 -5.13 119.74 113.46 3hf9 s LYS 416 Ca -0.11 -0.40 -0.22 0.00 -0.36 0.00 0.00 55.97 54.88 3hf9 s LYS 416 Cb 0.08 -1.09 -0.06 0.00 -1.51 0.00 0.00 37.83 35.24 3hf9 s LYS 416 CO 0.89 0.16 1.18 -1.25 -0.36 0.00 0.00 175.35 175.97 3hf9 s PRO 417 N 0.11 3.54 0.06 4.03 0.04 -1.26 -4.87 135.00 136.65 3hf9 s PRO 417 Ca -0.03 1.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.49 3hf9 s PRO 417 Cb -0.09 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 32.13 3hf9 s PRO 417 CO 0.01 -0.73 1.29 0.71 0.04 0.00 0.00 177.00 178.31 3hf9 s TYR 418 N -1.58 3.27 -1.31 0.56 1.51 -1.26 -4.86 117.35 113.67 3hf9 s TYR 418 Ca 0.68 1.12 -0.12 0.00 -1.01 0.00 0.00 57.07 57.74 3hf9 s TYR 418 Cb -0.29 -3.54 0.13 0.00 -0.11 0.00 0.00 41.96 38.16 3hf9 s TYR 418 CO 0.34 -1.79 1.89 0.39 -1.11 0.00 0.00 175.55 175.27 3hf9 n GLU 419 N 4.25 3.38 -4.12 -0.62 1.02 -1.26 -4.68 120.64 118.60 3hf9 n GLU 419 Ca 0.10 -3.34 -0.10 0.00 -0.02 0.00 0.00 57.16 53.81 3hf9 n GLU 419 Cb 0.45 -3.07 -0.10 0.00 -0.02 0.00 0.00 31.44 28.70 3hf9 n GLU 419 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3hf9 s VAL 420 N 1.48 0.10 -0.12 2.62 -7.23 -1.26 -1.91 120.40 114.08 3hf9 s VAL 420 Ca 0.43 -1.83 -0.04 0.00 -1.81 0.00 0.00 61.98 58.72 3hf9 s VAL 420 Cb 0.08 -2.00 0.06 0.00 0.56 0.00 0.00 36.38 35.09 3hf9 s VAL 420 CO -0.01 -0.46 0.23 -0.70 -0.31 0.00 0.00 175.10 173.85 3hf9 s GLU 421 N -4.03 0.11 0.14 4.82 2.12 -0.59 -3.26 118.70 118.00 3hf9 s GLU 421 Ca 0.23 0.69 0.04 0.00 0.36 0.00 0.00 54.97 56.29 3hf9 s GLU 421 Cb 0.07 -0.11 -0.04 0.00 0.26 0.00 0.00 34.13 34.31 3hf9 s GLU 421 CO 0.01 -0.30 0.13 -0.51 -0.54 0.00 0.00 175.26 174.05 3hf9 s LEU 422 N 2.38 3.84 -0.06 2.70 1.02 -0.17 -1.21 118.68 127.18 3hf9 s LEU 422 Ca 0.02 -0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.09 3hf9 s LEU 422 Cb -0.12 -2.46 0.02 0.00 0.02 0.00 0.00 46.19 43.65 3hf9 s LEU 422 CO -0.08 0.10 -0.04 0.00 0.02 0.00 0.00 176.35 176.35 3hf9 s VAL 424 N 1.34 3.72 -0.05 0.00 1.01 -0.60 -0.96 120.40 124.86 3hf9 s VAL 424 Ca -0.04 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 61.61 3hf9 s VAL 424 Cb -0.14 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 3hf9 s VAL 424 CO -0.03 0.44 -0.24 0.00 0.00 0.00 0.00 175.10 175.28 3hf9 s ALA 425 N 0.97 2.24 0.13 5.51 0.00 -0.49 -1.34 121.76 128.78 3hf9 s ALA 425 Ca 0.01 -1.05 0.10 0.00 0.00 0.00 0.00 51.96 51.02 3hf9 s ALA 425 Cb -0.14 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 3hf9 s ALA 425 CO 0.01 0.46 -0.25 -2.00 0.00 0.00 0.00 175.76 173.98 3hf9 s GLU 426 N -0.32 1.34 0.25 0.00 2.12 -0.30 -1.11 118.70 120.67 3hf9 s GLU 426 Ca 0.01 -1.32 0.04 0.00 0.36 0.00 0.00 54.97 54.06 3hf9 s GLU 426 Cb -0.12 -1.75 -0.05 0.00 0.26 0.00 0.00 34.13 32.47 3hf9 s GLU 426 CO 0.02 0.41 -0.01 0.54 -0.54 0.00 0.00 175.26 175.67 3hf9 s VAL 427 N -1.18 1.21 0.57 3.70 0.11 -0.78 -2.02 120.40 122.00 3hf9 s VAL 427 Ca 0.13 -2.05 -0.17 0.00 -2.93 0.00 0.00 61.98 56.95 3hf9 s VAL 427 Cb -0.10 -2.40 -0.05 0.00 -1.53 0.00 0.00 36.38 32.30 3hf9 s VAL 427 CO 0.06 -0.30 1.07 0.00 -3.33 0.00 0.00 175.10 172.61 3hf9 s ALA 428 N -3.30 2.73 0.74 1.54 0.00 -1.26 -4.88 121.76 117.32 3hf9 s ALA 428 Ca 0.29 0.54 -0.12 0.00 0.00 0.00 0.00 51.96 52.68 3hf9 s ALA 428 Cb 0.05 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 19.94 3hf9 s ALA 428 CO 0.10 -0.74 1.10 -1.01 0.00 0.00 0.00 175.76 175.21 3hf9 s HIS 429 N -2.20 2.56 0.09 0.00 3.76 -1.26 -4.82 115.29 113.42 3hf9 s HIS 429 Ca 0.67 1.56 -0.19 0.00 -0.15 0.00 0.00 55.06 56.94 3hf9 s HIS 429 Cb -0.18 -3.10 -0.05 0.00 1.11 0.00 0.00 32.58 30.36 3hf9 s HIS 429 CO 0.31 -1.81 1.33 -0.92 -0.85 0.00 0.00 174.74 172.81 3hf9 h TYR 430 N -0.78 -1.13 0.20 1.40 3.20 -1.79 -2.57 116.97 115.49 3hf9 h TYR 430 Ca -0.45 0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.50 3hf9 h TYR 430 Cb 1.24 0.56 -0.02 0.00 1.54 0.00 0.00 36.73 40.05 3hf9 h TYR 430 CO 0.56 -0.25 -0.22 0.78 -1.64 0.00 0.00 178.16 177.39 3hf9 h GLY 431 N -0.07 -0.47 -0.86 1.82 0.00 -1.91 -3.47 103.07 98.12 3hf9 h GLY 431 Ca 0.08 0.25 -0.44 0.00 0.00 0.00 0.00 47.33 47.23 3hf9 h GLY 431 CO -0.52 -0.21 0.35 -1.83 0.00 0.00 0.00 176.54 174.34 3hf9 s GLU 432 N -6.09 0.10 -0.09 4.80 -1.05 -0.97 -5.07 118.70 110.32 3hf9 s GLU 432 Ca -0.15 -0.36 0.04 0.00 -0.15 0.00 0.00 54.97 54.34 3hf9 s GLU 432 Cb 0.07 -1.78 0.00 0.00 -0.44 0.00 0.00 34.13 31.98 3hf9 s GLU 432 CO 0.65 -2.79 -0.22 0.95 0.95 0.00 0.00 175.26 174.81 3hf9 s THR 433 N -3.69 1.86 0.09 1.83 -4.23 -1.26 -4.70 115.64 105.54 3hf9 s THR 433 Ca 0.74 -0.91 -0.25 0.00 -1.18 0.00 0.00 61.69 60.09 3hf9 s THR 433 Cb -0.05 -1.62 0.07 0.00 1.34 0.00 0.00 72.50 72.24 3hf9 s THR 433 CO 0.54 0.52 0.63 -0.75 -0.54 0.00 0.00 174.62 175.02 3hf9 s LYS 434 N 0.38 1.20 -0.27 3.99 2.20 -1.26 -5.07 119.74 120.92 3hf9 s LYS 434 Ca -0.17 -0.25 -0.16 0.00 -0.36 0.00 0.00 55.97 55.02 3hf9 s LYS 434 Cb -0.17 0.56 -0.03 0.00 -1.51 0.00 0.00 37.83 36.67 3hf9 s LYS 434 CO 0.08 -0.49 0.45 0.50 -0.36 0.00 0.00 175.35 175.53 3hf9 s ARG 435 N -2.98 4.04 0.09 4.03 3.52 -1.26 -4.65 118.95 121.73 3hf9 s ARG 435 Ca -0.02 0.18 -0.36 0.00 -0.13 0.00 0.00 55.73 55.40 3hf9 s ARG 435 Cb -0.01 -3.66 -0.18 0.00 -1.56 0.00 0.00 34.95 29.55 3hf9 s ARG 435 CO -0.06 -0.32 1.06 -2.30 -0.81 0.00 0.00 175.30 172.87 3hf9 n PRO 436 N 5.45 0.53 -4.46 5.12 -0.02 -1.26 -4.96 135.00 135.39 3hf9 n PRO 436 Ca -0.06 0.19 -0.34 0.00 -2.02 0.00 0.00 63.50 61.27 3hf9 n PRO 436 Cb 0.50 -1.64 -0.12 0.00 -0.02 0.00 0.00 33.50 32.22 3hf9 n PRO 436 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3hf9 s GLU 437 N -0.16 3.48 -0.00 -0.52 2.02 -0.86 -4.93 118.70 117.73 3hf9 s GLU 437 Ca 0.81 -0.53 0.06 0.00 0.02 0.00 0.00 54.97 55.33 3hf9 s GLU 437 Cb -1.05 -2.84 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 3hf9 s GLU 437 CO 0.54 0.33 -0.17 -0.51 0.02 0.00 0.00 175.26 175.47 3hf9 s LEU 438 N 0.11 2.63 -0.02 1.80 1.02 -1.23 -1.15 118.68 121.84 3hf9 s LEU 438 Ca -0.01 -0.32 0.03 0.00 0.02 0.00 0.00 54.13 53.84 3hf9 s LEU 438 Cb -0.14 -1.53 -0.00 0.00 0.02 0.00 0.00 46.19 44.54 3hf9 s LEU 438 CO 0.03 0.30 -0.09 -0.31 0.02 0.00 0.00 176.35 176.30 3hf9 s TYR 439 N -0.82 0.90 -0.22 0.29 1.51 -0.45 -3.08 117.35 115.49 3hf9 s TYR 439 Ca 0.13 -0.20 -0.02 0.00 -1.01 0.00 0.00 57.07 55.97 3hf9 s TYR 439 Cb -0.11 -0.62 0.00 0.00 -0.11 0.00 0.00 41.96 41.13 3hf9 s TYR 439 CO 0.03 -0.06 -0.08 0.50 -1.11 0.00 0.00 175.55 174.83 3hf9 s ARG 440 N 0.00 3.21 -0.13 -0.62 3.52 -0.12 -1.56 118.95 123.24 3hf9 s ARG 440 Ca 0.00 -0.73 -0.03 0.00 -0.13 0.00 0.00 55.73 54.84 3hf9 s ARG 440 Cb -0.06 -2.91 -0.03 0.00 -1.56 0.00 0.00 34.95 30.38 3hf9 s ARG 440 CO 0.00 -0.23 -0.01 0.42 -0.81 0.00 0.00 175.30 174.66 3hf9 s ILE 441 N 1.41 4.15 0.45 4.11 1.09 -0.70 -0.87 121.20 130.84 3hf9 s ILE 441 Ca 0.05 -0.28 0.07 0.00 -1.10 0.00 0.00 60.65 59.39 3hf9 s ILE 441 Cb -0.14 -2.80 -0.01 0.00 -1.06 0.00 0.00 42.46 38.45 3hf9 s ILE 441 CO -0.06 0.53 0.38 0.42 -0.10 0.00 0.00 174.94 176.11 3hf9 s THR 442 N -0.08 2.39 0.66 2.92 -4.23 -0.81 -1.00 115.64 115.49 3hf9 s THR 442 Ca 0.03 -1.40 0.24 0.00 -1.18 0.00 0.00 61.69 59.38 3hf9 s THR 442 Cb -0.13 -2.78 0.24 0.00 1.34 0.00 0.00 72.50 71.17 3hf9 s THR 442 CO 0.02 0.00 1.74 0.10 -0.54 0.00 0.00 174.62 175.94 3hf9 h TYR 443 N 0.98 0.00 -0.02 3.99 -0.00 -1.82 -0.84 116.97 119.26 3hf9 h TYR 443 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.33 3hf9 h TYR 443 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.00 3hf9 h TYR 443 CO 0.62 0.00 -0.17 -0.40 -0.00 0.00 0.00 178.16 178.21 3hf9 n ASP 444 N -2.82 2.30 0.00 0.10 5.75 -1.26 -4.58 116.55 116.04 3hf9 n ASP 444 Ca -0.01 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 3hf9 n ASP 444 Cb 0.51 0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.80 3hf9 n ASP 444 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hf9 n GLY 445 N 1.18 0.41 3.74 6.12 0.00 -0.32 -4.00 105.19 112.32 3hf9 n GLY 445 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3hf9 n GLY 445 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hf9 s SER 446 N -2.47 6.67 -0.13 1.61 0.01 -1.26 -4.72 113.70 113.41 3hf9 s SER 446 Ca 0.00 2.61 0.01 0.00 1.31 0.00 0.00 55.95 59.88 3hf9 s SER 446 Cb 0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.64 3hf9 s SER 446 CO 0.00 -0.71 -0.14 -0.51 0.41 0.00 0.00 173.24 172.28 3hf9 s ILE 447 N 0.36 1.52 0.14 1.44 2.07 -1.26 -1.92 121.20 123.55 3hf9 s ILE 447 Ca 0.62 -0.62 0.07 0.00 -1.41 0.00 0.00 60.65 59.31 3hf9 s ILE 447 Cb -0.41 -1.42 -0.04 0.00 0.13 0.00 0.00 42.46 40.71 3hf9 s ILE 447 CO 0.39 0.45 -0.05 0.00 -1.91 0.00 0.00 174.94 173.82 3hf9 s ALA 448 N 1.34 3.09 -0.38 1.50 0.00 -0.05 -4.98 121.76 122.29 3hf9 s ALA 448 Ca 0.01 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.69 3hf9 s ALA 448 Cb -0.13 -0.95 0.12 0.00 0.00 0.00 0.00 23.12 22.15 3hf9 s ALA 448 CO -0.08 0.57 0.16 0.16 0.00 0.00 0.00 175.76 176.58 3hf9 s ASP 449 N -2.56 3.97 0.65 0.00 -4.77 -1.26 -0.95 116.67 111.75 3hf9 s ASP 449 Ca 0.25 -2.23 -0.12 0.00 -3.30 0.00 0.00 52.55 47.14 3hf9 s ASP 449 Cb -0.10 -1.09 -0.02 0.00 -1.09 0.00 0.00 42.92 40.62 3hf9 s ASP 449 CO 0.16 -0.33 1.05 -1.61 0.70 0.00 0.00 175.17 175.14 3hf9 s GLU 450 N 0.84 3.24 -0.07 2.11 2.02 -1.18 -4.95 118.70 120.72 3hf9 s GLU 450 Ca 0.14 0.94 0.17 0.00 0.02 0.00 0.00 54.97 56.24 3hf9 s GLU 450 Cb -0.21 -2.03 -0.26 0.00 0.10 0.00 0.00 34.13 31.73 3hf9 s GLU 450 CO -0.10 -0.86 0.29 -0.35 0.02 0.00 0.00 175.26 174.26 3hf9 n PRO 451 N -2.75 0.77 -0.01 0.39 -0.05 -1.26 -3.52 135.00 128.57 3hf9 n PRO 451 Ca 0.07 -0.12 -0.04 0.00 -0.05 0.00 0.00 63.50 63.36 3hf9 n PRO 451 Cb 0.54 -1.43 -0.01 0.00 -0.05 0.00 0.00 33.50 32.54 3hf9 n PRO 451 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 175.50 176.17 3hf9 n HIS 452 N -2.28 0.00 -4.01 0.54 8.25 -1.26 -4.83 115.22 111.64 3hf9 n HIS 452 Ca -0.11 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.26 3hf9 n HIS 452 Cb 0.65 -0.16 -0.07 0.00 1.12 0.00 0.00 29.99 31.53 3hf9 n HIS 452 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3hf9 s PHE 453 N -2.13 0.50 -0.02 4.41 -0.12 -1.26 -0.70 117.98 118.66 3hf9 s PHE 453 Ca -0.07 -0.84 -0.01 0.00 -0.05 0.00 0.00 56.93 55.96 3hf9 s PHE 453 Cb 0.02 -0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.37 3hf9 s PHE 453 CO 0.09 -0.79 0.04 0.08 -0.05 0.00 0.00 175.22 174.59 3hf9 s VAL 454 N -4.01 -0.02 -0.05 -2.49 1.01 0.10 -4.82 120.40 110.12 3hf9 s VAL 454 Ca 0.22 0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.31 3hf9 s VAL 454 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.33 3hf9 s VAL 454 CO 0.05 0.03 -0.16 -0.69 0.00 0.00 0.00 175.10 174.33 3hf9 s VAL 455 N 0.38 1.35 0.03 2.92 1.01 -1.26 -1.49 120.40 123.33 3hf9 s VAL 455 Ca -0.03 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.32 3hf9 s VAL 455 Cb -0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 3hf9 s VAL 455 CO -0.01 0.39 -0.07 -0.04 0.00 0.00 0.00 175.10 175.37 3hf9 s MET 456 N 0.20 0.50 0.19 2.72 -1.94 -0.43 -4.99 119.30 115.56 3hf9 s MET 456 Ca -0.07 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 3hf9 s MET 456 Cb -0.12 -0.30 0.00 0.00 2.01 0.00 0.00 34.83 36.41 3hf9 s MET 456 CO 0.03 0.06 0.00 0.41 -0.01 0.00 0.00 175.02 175.51 3hf9 n GLY 457 N 1.74 -2.94 7.00 -0.03 0.00 -1.26 -0.62 105.19 109.08 3hf9 n GLY 457 Ca -0.21 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.52 3hf9 n GLY 457 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hf9 n GLY 458 N -2.52 1.20 3.45 -0.02 0.00 -0.68 -4.25 105.19 102.37 3hf9 n GLY 458 Ca -0.02 -0.58 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 3hf9 n GLY 458 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hf9 s THR 459 N 0.00 4.78 0.05 2.61 -4.23 -1.26 -4.49 115.64 113.10 3hf9 s THR 459 Ca 0.00 -0.44 -0.11 0.00 -1.18 0.00 0.00 61.69 59.96 3hf9 s THR 459 Cb 0.00 -4.37 -0.32 0.00 1.34 0.00 0.00 72.50 69.15 3hf9 s THR 459 CO 0.00 -0.91 1.08 0.71 -0.54 0.00 0.00 174.62 174.95 3hf9 h THR 460 N 5.90 1.36 -0.45 3.99 1.35 -1.94 -3.38 112.91 119.73 3hf9 h THR 460 Ca -0.28 -2.78 0.09 0.00 -0.55 0.00 0.00 66.41 62.90 3hf9 h THR 460 Cb 1.09 2.94 -0.09 0.00 -1.73 0.00 0.00 68.15 70.36 3hf9 h THR 460 CO 1.01 0.83 -0.12 -0.33 -0.25 0.00 0.00 175.52 176.66 3hf9 h GLU 461 N 0.15 -0.00 -0.49 4.72 3.07 -1.96 0.15 114.58 120.21 3hf9 h GLU 461 Ca -0.20 0.00 0.12 0.00 -0.50 0.00 0.00 59.36 58.78 3hf9 h GLU 461 Cb 2.05 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.93 3hf9 h GLU 461 CO 0.24 -0.00 0.34 -1.35 -1.40 0.00 0.00 179.01 176.84 3hf9 h PRO 462 N -0.00 0.14 0.14 2.33 0.11 -1.90 0.01 132.00 132.82 3hf9 h PRO 462 Ca 0.22 -0.01 -0.33 0.00 0.11 0.00 0.00 66.00 65.99 3hf9 h PRO 462 Cb 0.33 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3hf9 h PRO 462 CO -0.46 0.09 -1.72 0.82 -0.21 0.00 0.00 178.00 176.52 3hf9 h ILE 463 N 0.14 0.85 -0.63 4.15 2.04 -1.40 -2.86 117.51 119.80 3hf9 h ILE 463 Ca 0.23 -2.40 -0.01 0.00 1.00 0.00 0.00 64.86 63.68 3hf9 h ILE 463 Cb 0.73 2.63 -0.03 0.00 -0.74 0.00 0.00 36.82 39.41 3hf9 h ILE 463 CO -0.03 0.80 0.37 0.00 0.00 0.00 0.00 178.15 179.29 3hf9 h ALA 464 N 0.02 0.80 -0.22 1.87 0.00 -0.35 -1.28 119.26 120.10 3hf9 h ALA 464 Ca -0.36 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 3hf9 h ALA 464 Cb 1.94 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 3hf9 h ALA 464 CO 0.09 0.29 0.01 -0.91 0.00 0.00 0.00 179.25 178.74 3hf9 h ASN 465 N 0.85 0.37 -0.84 0.00 2.35 -1.15 -0.39 115.58 116.76 3hf9 h ASN 465 Ca 0.22 -0.29 0.16 0.00 -0.55 0.00 0.00 56.30 55.84 3hf9 h ASN 465 Cb -0.00 -0.10 -0.10 0.00 0.05 0.00 0.00 38.32 38.17 3hf9 h ASN 465 CO -0.04 0.57 0.41 0.00 -1.65 0.00 0.00 177.43 176.72 3hf9 h ALA 466 N 0.81 1.28 -0.02 -0.83 0.00 -1.27 -2.38 119.26 116.85 3hf9 h ALA 466 Ca 0.06 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hf9 h ALA 466 Cb 0.37 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hf9 h ALA 466 CO 0.01 -0.16 -0.05 -0.07 0.00 0.00 0.00 179.25 178.98 3hf9 h LEU 467 N 0.55 0.08 -0.95 0.00 3.38 -1.10 -2.36 115.31 114.89 3hf9 h LEU 467 Ca 0.48 -0.58 0.30 0.00 0.09 0.00 0.00 57.88 58.16 3hf9 h LEU 467 Cb 0.73 -0.02 -0.18 0.00 0.09 0.00 0.00 40.66 41.29 3hf9 h LEU 467 CO -0.40 0.65 0.17 0.29 0.09 0.00 0.00 178.44 179.23 3hf9 n LYS 468 N -4.75 -0.07 0.02 1.13 5.02 -0.17 0.24 118.16 119.58 3hf9 n LYS 468 Ca -0.08 1.39 -0.19 0.00 -2.02 0.00 0.00 58.31 57.41 3hf9 n LYS 468 Cb 0.32 -2.30 -0.14 0.00 -0.02 0.00 0.00 35.03 32.89 3hf9 n LYS 468 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 3hf9 h GLU 469 N 0.00 0.24 -0.36 1.97 4.11 -1.58 -3.36 114.58 115.61 3hf9 h GLU 469 Ca 0.65 -0.42 0.00 0.00 0.07 0.00 0.00 59.36 59.66 3hf9 h GLU 469 Cb 1.47 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.88 3hf9 h GLU 469 CO -0.85 1.12 0.00 -1.13 0.07 0.00 0.00 179.01 178.22 3hf9 n SER 470 N -3.43 2.15 -4.54 3.06 3.41 -0.37 -4.88 113.62 109.01 3hf9 n SER 470 Ca -0.27 -1.93 -0.42 0.00 -0.26 0.00 0.00 58.87 55.98 3hf9 n SER 470 Cb 1.05 -0.24 -0.07 0.00 -0.26 0.00 0.00 64.21 64.70 3hf9 n SER 470 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3hf9 s TYR 471 N -1.53 3.12 -0.20 7.33 5.04 0.14 -4.97 117.35 126.27 3hf9 s TYR 471 Ca 0.29 0.13 -0.05 0.00 -2.44 0.00 0.00 57.07 55.01 3hf9 s TYR 471 Cb 0.16 -3.20 -0.02 0.00 0.35 0.00 0.00 41.96 39.25 3hf9 s TYR 471 CO 0.21 -0.73 -0.01 0.00 -1.34 0.00 0.00 175.55 173.69 3hf9 s ALA 472 N 2.70 2.98 0.55 3.97 0.00 -1.26 -5.01 121.76 125.69 3hf9 s ALA 472 Ca 0.23 -1.02 -0.19 0.00 0.00 0.00 0.00 51.96 50.97 3hf9 s ALA 472 Cb -0.14 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.18 3hf9 s ALA 472 CO 0.16 -0.19 1.13 -1.83 0.00 0.00 0.00 175.76 175.03 3hf9 s GLU 473 N 1.08 3.30 -1.54 0.00 -1.05 -1.26 -3.14 118.70 116.08 3hf9 s GLU 473 Ca 0.02 1.61 -0.04 0.00 -0.15 0.00 0.00 54.97 56.41 3hf9 s GLU 473 Cb -0.14 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.55 3hf9 s GLU 473 CO 0.01 -0.90 0.57 0.09 0.95 0.00 0.00 175.26 175.99 3hf9 n ASN 474 N -1.39 -6.06 -4.80 0.83 4.13 -1.26 -4.92 115.26 101.80 3hf9 n ASN 474 Ca 0.12 -0.27 -0.32 0.00 1.68 0.00 0.00 54.58 55.78 3hf9 n ASN 474 Cb 0.51 -4.88 0.03 0.00 -1.54 0.00 0.00 39.78 33.89 3hf9 n ASN 474 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3hf9 s ALA 475 N -3.17 2.65 0.72 5.41 0.00 -1.19 -4.25 121.76 121.95 3hf9 s ALA 475 Ca 0.28 0.38 -0.13 0.00 0.00 0.00 0.00 51.96 52.49 3hf9 s ALA 475 Cb -0.13 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.79 3hf9 s ALA 475 CO 0.35 -1.01 1.13 0.45 0.00 0.00 0.00 175.76 176.68 3hf9 s SER 476 N -2.91 4.58 0.15 0.00 0.15 -1.26 -2.64 113.70 111.77 3hf9 s SER 476 Ca 0.63 2.05 -0.15 0.00 0.70 0.00 0.00 55.95 59.18 3hf9 s SER 476 Cb -0.17 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.62 3hf9 s SER 476 CO 0.41 -1.99 1.77 0.25 1.20 0.00 0.00 173.24 174.89 3hf9 h LEU 477 N -0.49 0.56 -0.64 3.45 5.85 -1.99 0.20 115.31 122.26 3hf9 h LEU 477 Ca -0.46 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.15 3hf9 h LEU 477 Cb 1.25 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 3hf9 h LEU 477 CO 0.51 0.47 0.26 0.74 -0.34 0.00 0.00 178.44 180.08 3hf9 h THR 478 N 0.61 1.23 -0.67 1.05 2.02 -1.95 -0.32 112.91 114.88 3hf9 h THR 478 Ca 0.16 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 3hf9 h THR 478 Cb 0.02 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 3hf9 h THR 478 CO -0.03 0.29 0.33 0.44 0.37 0.00 0.00 175.52 176.92 3hf9 h ASP 479 N 0.90 0.86 -0.67 4.18 5.19 -1.85 -0.49 116.42 124.54 3hf9 h ASP 479 Ca 0.21 -0.12 -0.05 0.00 -0.62 0.00 0.00 57.03 56.45 3hf9 h ASP 479 Cb 0.20 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.46 3hf9 h ASP 479 CO -0.02 0.74 0.23 0.00 -3.12 0.00 0.00 179.24 177.07 3hf9 h ALA 480 N 1.16 0.87 -0.59 3.45 0.00 -0.55 -0.14 119.26 123.47 3hf9 h ALA 480 Ca 0.23 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hf9 h ALA 480 Cb 0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3hf9 h ALA 480 CO -0.03 0.53 0.26 1.25 0.00 0.00 0.00 179.25 181.26 3hf9 h LEU 481 N 0.96 0.79 -0.66 0.00 5.85 -0.62 -0.32 115.31 121.31 3hf9 h LEU 481 Ca 0.22 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3hf9 h LEU 481 Cb 0.27 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3hf9 h LEU 481 CO -0.01 0.73 0.30 0.03 -0.34 0.00 0.00 178.44 179.14 3hf9 h ARG 482 N 0.80 0.97 -0.69 1.25 3.08 -0.65 -0.57 114.38 118.57 3hf9 h ARG 482 Ca 0.20 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 3hf9 h ARG 482 Cb 0.17 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3hf9 h ARG 482 CO -0.02 0.79 0.32 0.82 -1.07 0.00 0.00 179.97 180.80 3hf9 h ILE 483 N 0.92 1.23 -0.59 2.04 2.04 -0.58 0.04 117.51 122.61 3hf9 h ILE 483 Ca 0.22 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 3hf9 h ILE 483 Cb 0.15 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 3hf9 h ILE 483 CO -0.02 0.28 0.23 0.00 0.00 0.00 0.00 178.15 178.64 3hf9 h ALA 484 N 1.15 0.77 -0.70 1.87 0.00 -0.62 0.16 119.26 121.88 3hf9 h ALA 484 Ca 0.24 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3hf9 h ALA 484 Cb 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3hf9 h ALA 484 CO -0.03 0.39 0.23 0.28 0.00 0.00 0.00 179.25 180.12 3hf9 h VAL 485 N 0.82 1.25 -0.63 0.00 2.07 -0.68 0.25 116.25 119.32 3hf9 h VAL 485 Ca 0.20 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 3hf9 h VAL 485 Cb 0.21 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 3hf9 h VAL 485 CO -0.02 0.34 0.27 0.00 0.02 0.00 0.00 177.57 178.18 3hf9 h ALA 486 N 1.11 0.82 0.00 1.67 0.00 -0.51 -1.65 119.26 120.69 3hf9 h ALA 486 Ca 0.23 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3hf9 h ALA 486 Cb 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3hf9 h ALA 486 CO -0.01 0.42 -0.49 0.00 0.00 0.00 0.00 179.25 179.17 3hf9 h ALA 487 N 1.11 0.85 0.00 0.00 0.00 -0.25 -3.13 119.26 117.84 3hf9 h ALA 487 Ca 0.21 -0.45 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 3hf9 h ALA 487 Cb 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3hf9 h ALA 487 CO -0.02 0.61 -0.60 -0.07 0.00 0.00 0.00 179.25 179.17 3hf9 h LEU 488 N 0.00 0.00 -0.61 0.00 3.38 -0.11 -3.31 115.31 114.66 3hf9 h LEU 488 Ca -0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3hf9 h LEU 488 Cb 1.12 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 3hf9 h LEU 488 CO 0.06 0.60 0.21 0.03 0.09 0.00 0.00 178.44 179.43 3hf9 h ARG 489 N 0.00 0.36 0.00 1.13 3.08 -1.25 -3.49 114.38 114.20 3hf9 h ARG 489 Ca -0.01 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3hf9 h ARG 489 Cb 1.12 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.08 3hf9 h ARG 489 CO 0.08 0.24 0.00 0.00 -1.07 0.00 0.00 179.97 179.22 3hf9 n ALA 490 N -2.50 0.36 0.00 0.04 0.00 -1.25 -5.13 120.51 112.03 3hf9 n ALA 490 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3hf9 n ALA 490 Cb 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.50 3hf9 n ALA 490 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3hf9 n VAL 505 N -0.12 0.00 -0.00 0.00 0.24 -1.26 -4.65 118.33 112.54 3hf9 n VAL 505 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.33 3hf9 n VAL 505 Cb 0.00 0.00 0.07 0.00 -1.47 0.00 0.00 33.84 32.44 3hf9 n VAL 505 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hf9 n ALA 506 N -0.41 2.21 -0.94 2.33 0.00 -1.26 -4.39 120.51 118.05 3hf9 n ALA 506 Ca 0.00 -0.94 0.05 0.00 0.00 0.00 0.00 53.44 52.55 3hf9 n ALA 506 Cb 0.00 -0.25 0.38 0.00 0.00 0.00 0.00 19.45 19.59 3hf9 n ALA 506 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hf9 n SER 507 N 0.17 5.50 -4.22 0.00 7.64 -1.26 -4.85 113.62 116.60 3hf9 n SER 507 Ca 0.06 -2.99 -0.27 0.00 1.01 0.00 0.00 58.87 56.68 3hf9 n SER 507 Cb 0.30 -0.69 -0.15 0.00 -1.01 0.00 0.00 64.21 62.66 3hf9 n SER 507 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hf9 s LEU 508 N -2.82 2.06 -0.23 -3.43 1.43 -1.25 -1.11 118.68 113.33 3hf9 s LEU 508 Ca 0.54 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.21 3hf9 s LEU 508 Cb 0.42 -1.05 -0.00 0.00 0.03 0.00 0.00 46.19 45.59 3hf9 s LEU 508 CO 0.15 0.24 -0.03 -0.70 0.23 0.00 0.00 176.35 176.24 3hf9 s GLU 509 N -0.59 3.27 0.00 1.70 2.12 -0.45 -4.84 118.70 119.91 3hf9 s GLU 509 Ca 0.08 -0.70 0.04 0.00 0.36 0.00 0.00 54.97 54.76 3hf9 s GLU 509 Cb -0.08 -3.04 -0.01 0.00 0.26 0.00 0.00 34.13 31.26 3hf9 s GLU 509 CO -0.00 -0.25 -0.14 0.08 -0.54 0.00 0.00 175.26 174.41 3hf9 s VAL 510 N 1.46 1.08 0.12 3.70 1.01 -1.26 -1.67 120.40 124.84 3hf9 s VAL 510 Ca 0.05 -0.67 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 3hf9 s VAL 510 Cb -0.15 -0.92 0.06 0.00 0.00 0.00 0.00 36.38 35.37 3hf9 s VAL 510 CO -0.03 0.24 0.53 0.00 0.00 0.00 0.00 175.10 175.84 3hf9 s ALA 511 N -0.44 -1.36 0.07 5.51 0.00 -0.86 -1.65 121.76 123.04 3hf9 s ALA 511 Ca 0.04 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.40 3hf9 s ALA 511 Cb -0.06 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 3hf9 s ALA 511 CO -0.00 -0.67 -0.06 0.14 0.00 0.00 0.00 175.76 175.17 3hf9 s VAL 512 N -3.42 0.55 -0.31 0.00 -7.23 0.25 -0.55 120.40 109.69 3hf9 s VAL 512 Ca -0.00 -1.67 -0.10 0.00 -1.81 0.00 0.00 61.98 58.40 3hf9 s VAL 512 Cb -0.00 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.59 3hf9 s VAL 512 CO -0.10 -0.77 0.16 -0.22 -0.31 0.00 0.00 175.10 173.87 3hf9 s LEU 513 N -2.61 4.15 -0.32 1.32 2.96 0.68 -1.31 118.68 123.56 3hf9 s LEU 513 Ca 0.05 -0.49 -0.10 0.00 -0.22 0.00 0.00 54.13 53.37 3hf9 s LEU 513 Cb 0.01 -2.02 -0.00 0.00 0.50 0.00 0.00 46.19 44.68 3hf9 s LEU 513 CO -0.04 -0.19 0.16 -0.62 -1.32 0.00 0.00 176.35 174.33 3hf9 s ASP 514 N 1.63 5.57 0.44 3.68 2.15 0.14 -2.58 116.67 127.70 3hf9 s ASP 514 Ca 0.05 -0.57 0.15 0.00 0.43 0.00 0.00 52.55 52.60 3hf9 s ASP 514 Cb -0.17 -2.00 1.00 0.00 -0.30 0.00 0.00 42.92 41.44 3hf9 s ASP 514 CO 0.07 -0.21 1.98 0.00 -0.17 0.00 0.00 175.17 176.83 3hf9 h ALA 515 N 8.36 1.64 -0.28 3.66 0.00 -1.84 -2.94 119.26 127.86 3hf9 h ALA 515 Ca -0.31 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 3hf9 h ALA 515 Cb 1.14 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3hf9 h ALA 515 CO 0.62 0.25 -0.04 -0.97 0.00 0.00 0.00 179.25 179.11 3hf9 h ASN 516 N 0.00 0.41 -3.99 0.00 -1.24 -1.92 -3.41 115.58 105.43 3hf9 h ASN 516 Ca -0.00 -0.08 -0.54 0.00 0.71 0.00 0.00 56.30 56.39 3hf9 h ASN 516 Cb 0.36 -0.11 0.12 0.00 0.73 0.00 0.00 38.32 39.42 3hf9 h ASN 516 CO 0.03 0.51 0.72 -0.13 -1.29 0.00 0.00 177.43 177.26 3hf9 s ARG 517 N -4.90 3.72 0.14 6.67 0.52 -1.11 -4.95 118.95 119.04 3hf9 s ARG 517 Ca -0.07 2.45 -0.16 0.00 -0.52 0.00 0.00 55.73 57.43 3hf9 s ARG 517 Cb 0.15 -2.69 0.00 0.00 0.52 0.00 0.00 34.95 32.94 3hf9 s ARG 517 CO 0.76 -0.80 1.73 -1.35 0.02 0.00 0.00 175.30 175.65 3hf9 h PRO 518 N 2.38 0.57 0.00 3.54 0.11 -1.90 -3.41 132.00 133.29 3hf9 h PRO 518 Ca -0.51 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.53 3hf9 h PRO 518 Cb 1.26 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3hf9 h PRO 518 CO 0.61 0.48 0.00 -2.13 -0.21 0.00 0.00 178.00 176.75 3hf9 n ARG 519 N -4.71 0.00 -2.52 1.05 0.63 -1.26 -4.43 116.66 105.41 3hf9 n ARG 519 Ca 0.00 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.51 3hf9 n ARG 519 Cb 0.10 -0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.98 3hf9 n ARG 519 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3hf9 s ARG 520 N -1.00 3.41 0.27 -0.14 0.52 -1.26 -4.41 118.95 116.33 3hf9 s ARG 520 Ca 0.00 0.24 0.14 0.00 -0.52 0.00 0.00 55.73 55.59 3hf9 s ARG 520 Cb 0.00 -4.07 0.17 0.00 0.52 0.00 0.00 34.95 31.57 3hf9 s ARG 520 CO 0.00 -1.82 1.49 0.00 0.02 0.00 0.00 175.30 174.99 3hf9 h ALA 521 N 10.04 0.69 -2.72 2.13 0.00 -0.94 -3.45 119.26 125.02 3hf9 h ALA 521 Ca -0.26 -0.53 -0.53 0.00 0.00 0.00 0.00 54.91 53.59 3hf9 h ALA 521 Cb 1.07 -0.09 0.05 0.00 0.00 0.00 0.00 17.79 18.81 3hf9 h ALA 521 CO 1.20 0.73 0.73 0.12 0.00 0.00 0.00 179.25 182.02 3hf9 s PHE 522 N -3.09 3.10 -0.20 0.00 5.36 -1.26 0.25 117.98 122.14 3hf9 s PHE 522 Ca 0.02 1.08 -0.09 0.00 -0.96 0.00 0.00 56.93 56.99 3hf9 s PHE 522 Cb 0.09 -3.75 0.08 0.00 -0.34 0.00 0.00 43.02 39.10 3hf9 s PHE 522 CO 0.75 -2.41 0.45 0.50 -1.46 0.00 0.00 175.22 173.04 3hf9 s ARG 523 N -0.25 0.39 0.12 10.12 3.52 -0.42 -4.92 118.95 127.51 3hf9 s ARG 523 Ca 0.59 0.99 -0.19 0.00 -0.13 0.00 0.00 55.73 56.99 3hf9 s ARG 523 Cb -0.40 0.22 -0.07 0.00 -1.56 0.00 0.00 34.95 33.14 3hf9 s ARG 523 CO 0.41 -0.21 0.60 1.03 -0.81 0.00 0.00 175.30 176.33 3hf9 s ARG 524 N 2.11 4.18 -0.22 5.12 0.52 -1.26 -0.58 118.95 128.83 3hf9 s ARG 524 Ca -0.05 0.73 -0.06 0.00 -0.52 0.00 0.00 55.73 55.82 3hf9 s ARG 524 Cb -0.10 -3.11 -0.03 0.00 0.52 0.00 0.00 34.95 32.23 3hf9 s ARG 524 CO -0.14 0.56 0.04 0.42 0.02 0.00 0.00 175.30 176.20 3hf9 s ILE 525 N -1.26 4.26 0.07 1.52 1.01 -0.66 -4.95 121.20 121.18 3hf9 s ILE 525 Ca 0.34 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.73 3hf9 s ILE 525 Cb -0.18 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 3hf9 s ILE 525 CO 0.20 0.40 0.09 -0.89 0.00 0.00 0.00 174.94 174.74 3hf9 s THR 526 N 1.13 0.18 0.00 2.92 2.01 -1.26 -4.29 115.64 116.33 3hf9 s THR 526 Ca 0.04 -1.46 0.00 0.00 0.31 0.00 0.00 61.69 60.58 3hf9 s THR 526 Cb -0.14 -1.41 0.00 0.00 0.01 0.00 0.00 72.50 70.95 3hf9 s THR 526 CO 0.03 -0.81 0.00 0.61 -0.69 0.00 0.00 174.62 173.76 3hf9 n GLY 527 N 0.03 3.40 0.30 4.40 0.00 -1.26 -3.32 105.19 108.74 3hf9 n GLY 527 Ca -0.15 -0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 3hf9 n GLY 527 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hf9 h SER 528 N 0.00 0.91 -0.63 1.61 4.64 -1.99 -0.33 113.55 117.76 3hf9 h SER 528 Ca 0.00 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 3hf9 h SER 528 Cb 0.00 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.83 3hf9 h SER 528 CO 0.00 0.71 0.23 0.00 -0.87 0.00 0.00 176.83 176.89 3hf9 h ALA 529 N 1.25 0.82 -0.77 5.18 0.00 -1.98 0.06 119.26 123.82 3hf9 h ALA 529 Ca 0.27 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3hf9 h ALA 529 Cb -0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 3hf9 h ALA 529 CO -0.05 0.47 0.32 1.25 0.00 0.00 0.00 179.25 181.24 3hf9 h LEU 530 N 0.89 1.04 -0.76 0.00 6.46 -1.48 -0.61 115.31 120.85 3hf9 h LEU 530 Ca 0.21 -0.16 -0.07 0.00 -0.12 0.00 0.00 57.88 57.73 3hf9 h LEU 530 Cb 0.25 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 3hf9 h LEU 530 CO -0.01 0.92 0.13 -0.61 -0.62 0.00 0.00 178.44 178.24 3hf9 h GLN 531 N 1.10 1.06 -0.81 1.25 4.15 -0.61 -2.40 115.11 118.86 3hf9 h GLN 531 Ca 0.26 -0.27 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 3hf9 h GLN 531 Cb 0.19 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 3hf9 h GLN 531 CO -0.02 0.96 0.36 0.00 -1.93 0.00 0.00 178.83 178.20 3hf9 h ALA 532 N 1.13 1.11 0.00 3.38 0.00 -0.49 -3.51 119.26 120.87 3hf9 h ALA 532 Ca 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hf9 h ALA 532 Cb 0.40 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hf9 h ALA 532 CO 0.01 0.66 0.00 1.28 0.00 0.00 0.00 179.25 181.19