#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hm8 h PRO 315 N 0.00 0.35 -5.51 1.61 0.13 -2.13 -3.49 132.00 122.96 2hm8 h PRO 315 Ca 0.00 -0.18 -0.04 0.00 -0.87 0.00 0.00 66.00 64.91 2hm8 h PRO 315 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 2hm8 h PRO 315 CO 0.00 0.73 -0.86 1.28 -0.23 0.00 0.00 178.00 178.92 2hm8 n LEU 316 N -4.57 -6.80 0.00 1.56 4.77 -1.26 -5.00 117.00 105.70 2hm8 n LEU 316 Ca -0.06 0.83 0.00 0.00 -0.03 0.00 0.00 56.01 56.75 2hm8 n LEU 316 Cb 0.36 -2.94 0.00 0.00 -2.33 0.00 0.00 43.42 38.51 2hm8 n LEU 316 CO 0.39 -2.35 0.00 0.61 -1.33 0.00 0.00 177.39 174.71 2hm8 n GLY 317 N 0.36 3.11 0.46 -0.72 0.00 -1.26 -5.17 105.19 101.97 2hm8 n GLY 317 Ca 0.03 -1.46 -0.03 0.00 0.00 0.00 0.00 46.02 44.56 2hm8 n GLY 317 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2hm8 n SER 318 N 0.00 0.65 -3.64 1.61 2.88 -1.26 -5.18 113.62 108.69 2hm8 n SER 318 Ca 0.00 -1.30 -0.06 0.00 -1.33 0.00 0.00 58.87 56.18 2hm8 n SER 318 Cb 0.00 0.17 -0.07 0.00 -0.75 0.00 0.00 64.21 63.56 2hm8 n SER 318 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2hm8 s GLY 319 N -1.34 -0.16 0.00 0.46 0.00 -1.26 -5.13 107.32 99.89 2hm8 s GLY 319 Ca 0.04 2.83 0.00 0.00 0.00 0.00 0.00 44.72 47.59 2hm8 s GLY 319 CO 0.03 2.26 0.00 0.61 0.00 0.00 0.00 173.10 175.99 2hm8 n GLY 320 N 3.20 -1.59 2.88 0.20 0.00 -1.26 -4.98 105.19 103.64 2hm8 n GLY 320 Ca -0.16 -0.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.81 2hm8 n GLY 320 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hm8 n GLN 321 N 1.21 -2.60 -2.94 1.61 6.02 -1.26 -5.01 117.38 114.42 2hm8 n GLN 321 Ca 0.00 2.22 -0.26 0.00 -0.01 0.00 0.00 57.00 58.95 2hm8 n GLN 321 Cb 0.00 -5.15 -0.00 0.00 1.02 0.00 0.00 30.24 26.11 2hm8 n GLN 321 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2hm8 s GLN 322 N -2.27 3.45 0.62 -1.09 1.11 -1.26 -5.07 119.66 115.15 2hm8 s GLN 322 Ca 0.18 -0.07 -0.17 0.00 0.01 0.00 0.00 55.36 55.32 2hm8 s GLN 322 Cb -0.05 -2.50 -0.02 0.00 -1.01 0.00 0.00 33.01 29.44 2hm8 s GLN 322 CO 0.76 -0.10 1.12 -1.25 0.01 0.00 0.00 175.29 175.83 2hm8 s PRO 323 N -4.58 3.00 0.00 2.91 0.04 -1.26 -4.96 135.00 130.16 2hm8 s PRO 323 Ca 0.45 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2hm8 s PRO 323 Cb -0.10 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2hm8 s PRO 323 CO 0.41 -1.10 0.00 0.28 0.04 0.00 0.00 177.00 176.63 2hm8 n VAL 324 N -2.01 0.00 -3.67 -0.36 0.31 -1.26 -5.14 118.33 106.20 2hm8 n VAL 324 Ca 0.11 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.40 2hm8 n VAL 324 Cb 0.52 -0.08 -0.01 0.00 -0.91 0.00 0.00 33.84 33.35 2hm8 n VAL 324 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2hm8 s ASN 325 N -2.92 -0.21 0.01 4.52 3.84 -1.26 -5.00 114.94 113.92 2hm8 s ASN 325 Ca 0.00 -0.25 -0.25 0.00 0.21 0.00 0.00 52.86 52.57 2hm8 s ASN 325 Cb 0.00 0.41 -0.19 0.00 -0.55 0.00 0.00 41.25 40.92 2hm8 s ASN 325 CO 0.00 -0.74 1.40 0.45 -2.79 0.00 0.00 177.10 175.42 2hm8 h HIS 326 N 2.00 0.00 -0.33 0.43 3.86 -2.01 -2.13 115.15 116.98 2hm8 h HIS 326 Ca -0.24 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.86 2hm8 h HIS 326 Cb 1.23 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.68 2hm8 h HIS 326 CO 0.34 0.36 -0.27 1.25 0.86 0.00 0.00 177.93 180.47 2hm8 h LEU 327 N -0.35 0.67 -0.15 2.43 7.12 -1.99 -2.42 115.31 120.64 2hm8 h LEU 327 Ca 0.00 -0.25 0.00 0.00 0.13 0.00 0.00 57.88 57.76 2hm8 h LEU 327 Cb 0.35 -0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 40.29 2hm8 h LEU 327 CO 0.00 0.91 0.09 0.58 -0.13 0.00 0.00 178.44 179.89 2hm8 h VAL 328 N 0.57 1.03 -0.36 1.05 2.07 -1.94 -2.19 116.25 116.48 2hm8 h VAL 328 Ca 0.08 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 2hm8 h VAL 328 Cb 0.75 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2hm8 h VAL 328 CO 0.06 0.03 -0.04 0.50 0.02 0.00 0.00 177.57 178.15 2hm8 h LYS 329 N 0.18 0.58 -0.89 1.57 3.64 -1.33 -2.53 116.57 117.79 2hm8 h LYS 329 Ca 0.05 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2hm8 h LYS 329 Cb -0.01 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 2hm8 h LYS 329 CO -0.02 0.63 0.57 1.49 -2.27 0.00 0.00 179.45 179.85 2hm8 h GLU 330 N 0.55 1.19 -0.39 1.90 4.57 -0.99 -0.93 114.58 120.48 2hm8 h GLU 330 Ca 0.11 -0.08 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 2hm8 h GLU 330 Cb 0.41 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2hm8 h GLU 330 CO 0.02 0.80 -0.21 0.82 -1.18 0.00 0.00 179.01 179.26 2hm8 h ILE 331 N 1.22 1.28 -0.70 2.32 2.04 -1.09 -0.71 117.51 121.87 2hm8 h ILE 331 Ca 0.32 -1.35 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 2hm8 h ILE 331 Cb -0.11 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2hm8 h ILE 331 CO -0.07 0.45 0.35 -0.78 0.00 0.00 0.00 178.15 178.10 2hm8 h ASP 332 N 0.63 0.90 0.35 1.72 1.82 -1.09 -2.31 116.42 118.43 2hm8 h ASP 332 Ca 0.08 -0.12 -0.16 0.00 -0.39 0.00 0.00 57.03 56.45 2hm8 h ASP 332 Cb 0.76 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.53 2hm8 h ASP 332 CO 0.06 0.77 -0.64 0.24 -1.61 0.00 0.00 179.24 178.06 2hm8 h MET 333 N 0.97 0.27 0.56 0.28 2.86 -1.12 -3.00 114.93 115.76 2hm8 h MET 333 Ca 0.24 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2hm8 h MET 333 Cb 0.09 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2hm8 h MET 333 CO -0.03 0.82 -0.28 1.25 1.06 0.00 0.00 176.91 179.73 2hm8 h LEU 334 N 0.20 -0.66 -0.66 1.22 5.85 -0.74 0.21 115.31 120.72 2hm8 h LEU 334 Ca -0.01 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.81 2hm8 h LEU 334 Cb 1.17 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 2hm8 h LEU 334 CO 0.10 -0.47 0.33 -0.07 -0.34 0.00 0.00 178.44 178.00 2hm8 h LEU 335 N -0.76 0.45 -0.50 2.25 3.38 -1.49 -1.04 115.31 117.60 2hm8 h LEU 335 Ca -0.07 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2hm8 h LEU 335 Cb 0.59 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2hm8 h LEU 335 CO 0.12 0.28 0.18 0.11 0.09 0.00 0.00 178.44 179.21 2hm8 h LYS 336 N 0.59 0.76 -0.12 1.13 1.79 -1.36 -1.74 116.57 117.62 2hm8 h LYS 336 Ca 0.31 -0.15 0.02 0.00 -2.18 0.00 0.00 60.65 58.65 2hm8 h LYS 336 Cb 0.28 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.80 2hm8 h LYS 336 CO -0.23 0.70 -0.01 1.49 -1.08 0.00 0.00 179.45 180.32 2hm8 h GLU 337 N 0.67 0.03 -0.48 3.15 4.57 0.17 -1.22 114.58 121.48 2hm8 h GLU 337 Ca 0.16 -0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.35 2hm8 h GLU 337 Cb 0.24 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 2hm8 h GLU 337 CO -0.01 0.02 0.31 -0.92 -1.18 0.00 0.00 179.01 177.23 2hm8 h TYR 338 N 0.03 0.58 0.00 0.92 3.20 -1.11 0.15 116.97 120.75 2hm8 h TYR 338 Ca 0.06 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2hm8 h TYR 338 Cb 0.07 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 2hm8 h TYR 338 CO -0.14 0.36 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.63 2hm8 h LEU 339 N 0.62 0.00 0.00 2.82 3.38 -0.99 0.24 115.31 121.39 2hm8 h LEU 339 Ca 0.18 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 2hm8 h LEU 339 Cb -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2hm8 h LEU 339 CO -0.05 0.04 -0.68 -0.07 0.09 0.00 0.00 178.44 177.76 2hm8 h LEU 340 N 0.00 0.00 0.51 1.67 3.38 0.02 -3.41 115.31 117.48 2hm8 h LEU 340 Ca -0.00 -0.47 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 2hm8 h LEU 340 Cb 0.16 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.92 2hm8 h LEU 340 CO 0.00 1.13 -0.25 0.28 0.09 0.00 0.00 178.44 179.70 2hm8 h SER 341 N -1.00 -0.58 -0.01 -0.43 0.02 -0.62 -3.49 113.55 107.45 2hm8 h SER 341 Ca -0.16 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2hm8 h SER 341 Cb 0.94 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2hm8 h SER 341 CO -0.10 -0.23 0.00 0.61 -1.14 0.00 0.00 176.83 175.97 2hm8 n GLY 342 N -0.16 0.76 2.94 -3.77 0.00 0.84 -5.08 105.19 100.72 2hm8 n GLY 342 Ca -0.09 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2hm8 n GLY 342 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hm8 s ASP 343 N -1.53 0.26 0.60 1.61 2.15 -1.26 -5.01 116.67 113.48 2hm8 s ASP 343 Ca 0.00 0.28 0.30 0.00 0.43 0.00 0.00 52.55 53.56 2hm8 s ASP 343 Cb 0.00 1.09 1.73 0.00 -0.30 0.00 0.00 42.92 45.44 2hm8 s ASP 343 CO 0.00 -0.29 2.12 0.40 -0.17 0.00 0.00 175.17 177.23 2hm8 h ILE 344 N 6.19 0.42 -0.54 4.11 2.04 -1.97 -1.94 117.51 125.81 2hm8 h ILE 344 Ca -0.19 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.75 2hm8 h ILE 344 Cb 1.15 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 38.02 2hm8 h ILE 344 CO 0.26 0.00 0.19 -1.28 0.00 0.00 0.00 178.15 177.32 2hm8 h SER 345 N 0.00 0.19 -0.08 1.72 0.87 -1.99 0.21 113.55 114.47 2hm8 h SER 345 Ca 0.07 0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.61 2hm8 h SER 345 Cb 0.42 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 2hm8 h SER 345 CO -0.00 0.13 -0.30 -0.08 -0.53 0.00 0.00 176.83 176.05 2hm8 h GLU 346 N 0.37 0.34 0.10 2.24 4.81 -1.79 -2.55 114.58 118.11 2hm8 h GLU 346 Ca 0.27 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2hm8 h GLU 346 Cb 0.31 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 2hm8 h GLU 346 CO -0.27 0.89 -0.27 0.00 -0.73 0.00 0.00 179.01 178.63 2hm8 h ALA 347 N 0.44 -0.45 -0.03 2.92 0.00 -1.35 -1.39 119.26 119.39 2hm8 h ALA 347 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2hm8 h ALA 347 Cb 0.94 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2hm8 h ALA 347 CO 0.06 -0.81 -0.02 1.05 0.00 0.00 0.00 179.25 179.54 2hm8 h GLU 348 N -0.48 0.05 -0.15 0.00 4.11 -0.70 -1.40 114.58 116.01 2hm8 h GLU 348 Ca 0.03 -0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.41 2hm8 h GLU 348 Cb 0.51 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2hm8 h GLU 348 CO -0.17 0.07 -0.14 0.45 0.07 0.00 0.00 179.01 179.29 2hm8 h HIS 349 N 0.05 0.25 0.45 2.06 3.86 -0.83 -2.70 115.15 118.29 2hm8 h HIS 349 Ca 0.01 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 2hm8 h HIS 349 Cb 0.07 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2hm8 h HIS 349 CO 0.00 0.38 -0.22 0.00 0.86 0.00 0.00 177.93 178.95 2hm8 h LEU 351 N -0.66 0.00 -0.60 0.00 5.85 -1.57 -1.40 115.31 116.93 2hm8 h LEU 351 Ca -0.06 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 2hm8 h LEU 351 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2hm8 h LEU 351 CO 0.10 0.00 -0.38 0.11 -0.34 0.00 0.00 178.44 177.93 2hm8 h LYS 352 N 0.00 0.68 0.79 1.25 1.57 -1.12 -3.27 116.57 116.46 2hm8 h LYS 352 Ca 0.02 -0.34 -0.04 0.00 -1.87 0.00 0.00 60.65 58.42 2hm8 h LYS 352 Cb 0.08 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.40 2hm8 h LYS 352 CO -0.00 0.95 -0.38 0.93 -0.57 0.00 0.00 179.45 180.38 2hm8 h GLU 353 N 0.56 -1.02 -6.87 3.15 4.39 -0.42 -3.43 114.58 110.94 2hm8 h GLU 353 Ca 0.05 0.07 -0.51 0.00 0.34 0.00 0.00 59.36 59.31 2hm8 h GLU 353 Cb 0.91 0.23 0.04 0.00 -0.10 0.00 0.00 28.75 29.83 2hm8 h GLU 353 CO 0.08 -0.67 0.51 -0.48 -1.16 0.00 0.00 179.01 177.29 2hm8 s LEU 354 N -9.98 4.39 -0.90 1.33 2.34 -1.15 -4.99 118.68 109.71 2hm8 s LEU 354 Ca -0.18 2.36 -0.01 0.00 0.06 0.00 0.00 54.13 56.36 2hm8 s LEU 354 Cb 0.03 -3.79 0.23 0.00 -0.56 0.00 0.00 46.19 42.10 2hm8 s LEU 354 CO 0.60 -0.41 0.83 -0.62 -1.06 0.00 0.00 176.35 175.69 2hm8 n GLU 355 N 0.69 2.75 -3.20 1.48 1.02 -1.26 -4.89 120.64 117.22 2hm8 n GLU 355 Ca 0.01 -4.50 -0.23 0.00 -0.02 0.00 0.00 57.16 52.42 2hm8 n GLU 355 Cb 0.45 -2.41 -0.06 0.00 -0.02 0.00 0.00 31.44 29.40 2hm8 n GLU 355 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2hm8 n VAL 356 N 2.16 -0.21 0.49 2.62 3.14 -1.26 -4.93 118.33 120.34 2hm8 n VAL 356 Ca 0.23 -4.28 0.07 0.00 -2.96 0.00 0.00 64.34 57.39 2hm8 n VAL 356 Cb 0.37 -1.59 0.30 0.00 -1.06 0.00 0.00 33.84 31.86 2hm8 n VAL 356 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2hm8 n PRO 357 N 1.07 0.00 -0.73 1.45 -0.04 -1.26 -2.43 135.00 133.06 2hm8 n PRO 357 Ca 0.23 0.26 -0.00 0.00 -0.04 0.00 0.00 63.50 63.94 2hm8 n PRO 357 Cb 0.54 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.77 2hm8 n PRO 357 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2hm8 n HIS 358 N -1.50 1.74 -2.67 0.54 -0.00 -1.26 -4.64 115.22 107.43 2hm8 n HIS 358 Ca 0.03 -0.77 0.02 0.00 0.46 0.00 0.00 57.72 57.46 2hm8 n HIS 358 Cb 0.17 -0.50 0.01 0.00 -0.12 0.00 0.00 29.99 29.55 2hm8 n HIS 358 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 2hm8 s PHE 359 N -2.36 -0.06 -0.00 1.57 5.36 -1.02 -5.03 117.98 116.44 2hm8 s PHE 359 Ca 0.41 0.01 0.00 0.00 -0.96 0.00 0.00 56.93 56.39 2hm8 s PHE 359 Cb 0.32 0.01 0.00 0.00 -0.34 0.00 0.00 43.02 43.02 2hm8 s PHE 359 CO 0.11 -0.04 0.58 0.72 -1.46 0.00 0.00 175.22 175.13 2hm8 n HIS 360 N 3.51 0.00 0.08 10.12 8.25 -1.26 -4.82 115.22 131.10 2hm8 n HIS 360 Ca 0.04 -0.04 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 2hm8 n HIS 360 Cb 0.65 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.71 2hm8 n HIS 360 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2hm8 h HIS 361 N 0.00 0.27 -0.69 4.41 3.86 -1.96 -3.27 115.15 117.77 2hm8 h HIS 361 Ca 0.00 -0.16 0.09 0.00 -1.16 0.00 0.00 60.37 59.14 2hm8 h HIS 361 Cb 1.00 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 29.37 2hm8 h HIS 361 CO 0.01 1.01 0.33 0.93 0.86 0.00 0.00 177.93 181.07 2hm8 h GLU 362 N 0.08 0.56 0.09 2.45 4.39 -1.97 -1.55 114.58 118.64 2hm8 h GLU 362 Ca -0.05 -0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.63 2hm8 h GLU 362 Cb 1.59 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 30.10 2hm8 h GLU 362 CO 0.14 0.37 -0.15 1.25 -1.16 0.00 0.00 179.01 179.46 2hm8 h LEU 363 N 0.58 -0.42 0.11 1.33 6.46 -1.93 -1.12 115.31 120.32 2hm8 h LEU 363 Ca 0.34 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 58.17 2hm8 h LEU 363 Cb 0.35 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.40 2hm8 h LEU 363 CO -0.26 -0.22 -0.32 0.58 -0.62 0.00 0.00 178.44 177.59 2hm8 h VAL 364 N -0.30 0.31 0.04 1.05 2.07 -1.53 0.30 116.25 118.19 2hm8 h VAL 364 Ca 0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.56 2hm8 h VAL 364 Cb 0.32 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2hm8 h VAL 364 CO -0.08 0.00 -0.50 0.22 0.02 0.00 0.00 177.57 177.22 2hm8 h TYR 365 N -0.54 -1.46 -0.90 1.57 3.20 -1.16 0.14 116.97 117.82 2hm8 h TYR 365 Ca 0.03 0.04 0.16 0.00 3.14 0.00 0.00 58.73 62.11 2hm8 h TYR 365 Cb 0.58 0.63 -0.10 0.00 1.54 0.00 0.00 36.73 39.38 2hm8 h TYR 365 CO -0.30 -0.56 0.48 0.93 -1.64 0.00 0.00 178.16 177.07 2hm8 h GLU 366 N -0.68 0.63 -0.60 1.82 4.39 -1.04 0.11 114.58 119.21 2hm8 h GLU 366 Ca 0.02 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 2hm8 h GLU 366 Cb 0.72 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 2hm8 h GLU 366 CO -0.33 0.42 0.16 0.00 -1.16 0.00 0.00 179.01 178.10 2hm8 h ALA 367 N 1.59 1.15 0.16 3.43 0.00 0.20 -0.84 119.26 124.96 2hm8 h ALA 367 Ca 0.50 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2hm8 h ALA 367 Cb 0.75 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2hm8 h ALA 367 CO -0.38 0.58 -0.08 0.82 0.00 0.00 0.00 179.25 180.19 2hm8 h ILE 368 N 0.89 0.96 -0.37 0.00 2.04 0.16 -3.17 117.51 118.02 2hm8 h ILE 368 Ca 0.20 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2hm8 h ILE 368 Cb 0.30 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2hm8 h ILE 368 CO -0.00 0.20 0.25 -0.37 0.00 0.00 0.00 178.15 178.23 2hm8 h VAL 369 N -0.69 1.00 -0.17 1.67 -1.51 -0.94 -0.98 116.25 114.63 2hm8 h VAL 369 Ca -0.02 -0.12 0.05 0.00 -1.23 0.00 0.00 66.70 65.37 2hm8 h VAL 369 Cb 0.50 0.61 -0.07 0.00 -2.13 0.00 0.00 31.29 30.20 2hm8 h VAL 369 CO 0.04 0.07 -0.36 0.24 -1.23 0.00 0.00 177.57 176.32 2hm8 h MET 370 N 0.36 -0.40 -0.00 5.19 2.86 -1.12 -1.62 114.93 120.20 2hm8 h MET 370 Ca 0.16 0.03 -0.20 0.00 -2.06 0.00 0.00 59.70 57.63 2hm8 h MET 370 Cb 0.18 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 2hm8 h MET 370 CO -0.04 -0.27 -0.86 -0.24 1.06 0.00 0.00 176.91 176.57 2hm8 h VAL 371 N -0.41 1.49 -0.77 -2.22 3.04 -1.53 -2.07 116.25 113.77 2hm8 h VAL 371 Ca 0.10 -2.58 0.16 0.00 -1.01 0.00 0.00 66.70 63.37 2hm8 h VAL 371 Cb 0.58 2.44 -0.10 0.00 -2.01 0.00 0.00 31.29 32.19 2hm8 h VAL 371 CO -0.40 0.75 0.29 0.25 -1.01 0.00 0.00 177.57 177.45 2hm8 h LEU 372 N 0.12 0.22 0.00 3.16 5.85 -0.53 -0.61 115.31 123.52 2hm8 h LEU 372 Ca -0.04 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2hm8 h LEU 372 Cb 1.48 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.63 2hm8 h LEU 372 CO 0.13 0.05 -1.12 -0.62 -0.34 0.00 0.00 178.44 176.54 2hm8 n GLU 373 N -5.05 0.61 -3.34 1.25 1.02 -0.67 -4.59 120.64 109.87 2hm8 n GLU 373 Ca 0.16 0.08 -0.45 0.00 -0.02 0.00 0.00 57.16 56.92 2hm8 n GLU 373 Cb 0.46 -1.79 -0.06 0.00 -0.02 0.00 0.00 31.44 30.04 2hm8 n GLU 373 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2hm8 s SER 374 N -5.24 6.16 0.63 1.62 0.01 -0.23 -4.91 113.70 111.74 2hm8 s SER 374 Ca -0.01 -1.69 0.42 0.00 1.31 0.00 0.00 55.95 55.98 2hm8 s SER 374 Cb 0.10 -2.20 2.28 0.00 0.21 0.00 0.00 66.02 66.41 2hm8 s SER 374 CO 0.80 -0.80 2.29 0.00 0.41 0.00 0.00 173.24 175.94 2hm8 h THR 375 N 5.87 0.00 -1.38 1.44 1.03 -1.85 -3.42 112.91 114.60 2hm8 h THR 375 Ca -0.29 -0.02 -0.62 0.00 -0.01 0.00 0.00 66.41 65.47 2hm8 h THR 375 Cb 1.10 0.96 -0.01 0.00 -1.07 0.00 0.00 68.15 69.13 2hm8 h THR 375 CO 1.00 0.00 1.48 0.61 -0.01 0.00 0.00 175.52 178.60 2hm8 n GLY 376 N -1.06 0.58 0.36 2.99 0.00 -1.26 -4.79 105.19 102.02 2hm8 n GLY 376 Ca -0.03 0.86 0.19 0.00 0.00 0.00 0.00 46.02 47.05 2hm8 n GLY 376 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2hm8 h GLU 377 N 14.04 0.00 -0.99 1.61 4.11 -1.97 -1.07 114.58 130.30 2hm8 h GLU 377 Ca -0.30 0.00 0.19 0.00 0.07 0.00 0.00 59.36 59.31 2hm8 h GLU 377 Cb 1.29 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.44 2hm8 h GLU 377 CO 1.03 0.00 0.61 0.77 0.07 0.00 0.00 179.01 181.50 2hm8 h SER 378 N 0.00 0.74 0.39 3.06 0.02 -1.94 -0.94 113.55 114.88 2hm8 h SER 378 Ca 0.16 0.08 -0.32 0.00 -0.84 0.00 0.00 61.79 60.87 2hm8 h SER 378 Cb 0.81 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.30 2hm8 h SER 378 CO -0.00 0.28 -1.51 0.00 -1.14 0.00 0.00 176.83 174.46 2hm8 h ALA 379 N 1.63 0.11 -0.14 3.77 0.00 -1.54 -2.92 119.26 120.17 2hm8 h ALA 379 Ca 0.55 -1.02 0.05 0.00 0.00 0.00 0.00 54.91 54.49 2hm8 h ALA 379 Cb 0.91 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 2hm8 h ALA 379 CO -0.33 0.98 -0.19 0.35 0.00 0.00 0.00 179.25 180.06 2hm8 h PHE 380 N 0.10 -0.49 -0.27 0.00 3.04 -1.12 0.27 116.94 118.47 2hm8 h PHE 380 Ca -0.25 0.03 -0.14 0.00 3.98 0.00 0.00 57.97 61.59 2hm8 h PHE 380 Cb 2.06 0.24 -0.01 0.00 2.56 0.00 0.00 35.95 40.80 2hm8 h PHE 380 CO 0.09 -0.26 -0.40 1.57 -2.02 0.00 0.00 178.31 177.28 2hm8 h LYS 381 N -0.23 0.64 0.18 1.11 2.10 -1.38 -1.67 116.57 117.32 2hm8 h LYS 381 Ca 0.10 -0.33 -0.01 0.00 -2.00 0.00 0.00 60.65 58.42 2hm8 h LYS 381 Cb 0.38 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 2hm8 h LYS 381 CO -0.28 0.93 -0.09 0.52 -2.00 0.00 0.00 179.45 178.53 2hm8 h MET 382 N 0.52 -0.24 0.21 0.07 2.86 -1.19 0.25 114.93 117.42 2hm8 h MET 382 Ca 0.04 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2hm8 h MET 382 Cb 0.92 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.64 2hm8 h MET 382 CO 0.08 -0.13 -0.10 0.82 1.06 0.00 0.00 176.91 178.64 2hm8 h ILE 383 N -0.28 0.87 -0.35 -1.22 1.08 -0.50 0.28 117.51 117.39 2hm8 h ILE 383 Ca -0.02 -0.43 0.05 0.00 -0.39 0.00 0.00 64.86 64.07 2hm8 h ILE 383 Cb 0.21 1.12 -0.05 0.00 -3.07 0.00 0.00 36.82 35.04 2hm8 h ILE 383 CO 0.04 0.10 0.06 0.25 -0.69 0.00 0.00 178.15 177.90 2hm8 h LEU 384 N -0.50 -0.02 -1.21 1.44 6.46 -1.29 -0.54 115.31 119.65 2hm8 h LEU 384 Ca -0.03 0.06 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 2hm8 h LEU 384 Cb 0.37 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 2hm8 h LEU 384 CO 0.05 0.03 -0.29 -0.78 -0.62 0.00 0.00 178.44 176.83 2hm8 h ASP 385 N 0.17 0.00 0.34 1.25 -0.00 -0.47 -1.56 116.42 116.15 2hm8 h ASP 385 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.18 2hm8 h ASP 385 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.53 2hm8 h ASP 385 CO -0.23 0.29 -0.17 0.25 -0.00 0.00 0.00 179.24 179.38 2hm8 h LEU 386 N 0.00 -0.39 -0.95 2.28 5.85 0.10 -3.09 115.31 119.12 2hm8 h LEU 386 Ca -0.00 -0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.47 2hm8 h LEU 386 Cb 0.72 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 2hm8 h LEU 386 CO 0.04 0.02 -0.16 0.17 -0.34 0.00 0.00 178.44 178.16 2hm8 h LEU 387 N -0.88 0.58 -1.02 2.25 8.10 -1.17 -2.83 115.31 120.33 2hm8 h LEU 387 Ca -0.05 -0.17 0.19 0.00 0.11 0.00 0.00 57.88 57.96 2hm8 h LEU 387 Cb 0.53 -0.16 -0.11 0.00 -0.44 0.00 0.00 40.66 40.49 2hm8 h LEU 387 CO 0.08 0.76 0.61 0.11 -4.11 0.00 0.00 178.44 175.89 2hm8 h LYS 388 N 0.53 0.73 0.25 0.17 1.57 -1.31 0.28 116.57 118.78 2hm8 h LYS 388 Ca 0.09 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2hm8 h LYS 388 Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2hm8 h LYS 388 CO 0.04 0.48 -0.12 1.03 -0.57 0.00 0.00 179.45 180.31 2hm8 h SER 389 N 0.75 -0.28 -0.80 0.86 0.87 -1.42 -3.21 113.55 110.33 2hm8 h SER 389 Ca 0.58 -0.18 0.16 0.00 -1.23 0.00 0.00 61.79 61.12 2hm8 h SER 389 Cb 0.92 0.07 -0.10 0.00 -0.44 0.00 0.00 62.40 62.85 2hm8 h SER 389 CO -0.38 0.22 0.34 -0.07 -0.53 0.00 0.00 176.83 176.42 2hm8 h LEU 390 N -0.99 0.33 -0.65 2.23 4.07 -1.30 0.18 115.31 119.17 2hm8 h LEU 390 Ca -0.03 0.12 0.13 0.00 0.08 0.00 0.00 57.88 58.17 2hm8 h LEU 390 Cb 0.45 0.09 -0.10 0.00 1.08 0.00 0.00 40.66 42.18 2hm8 h LEU 390 CO 0.06 0.10 0.14 -0.25 -1.08 0.00 0.00 178.44 177.41 2hm8 h TRP 391 N 0.47 0.23 0.00 1.13 7.01 -0.54 0.29 115.95 124.53 2hm8 h TRP 391 Ca 0.45 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.49 2hm8 h TRP 391 Cb 0.72 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.78 2hm8 h TRP 391 CO -0.15 -0.05 -0.17 1.63 -2.79 0.00 0.00 178.44 176.91 2hm8 n LYS 392 N -5.14 0.15 -0.21 2.65 5.02 -0.21 -3.26 118.16 117.16 2hm8 n LYS 392 Ca 0.11 0.10 0.06 0.00 -2.02 0.00 0.00 58.31 56.55 2hm8 n LYS 392 Cb 0.37 -1.65 0.16 0.00 -0.02 0.00 0.00 35.03 33.89 2hm8 n LYS 392 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2hm8 n SER 393 N -1.90 2.04 -1.75 4.39 7.64 0.87 -4.88 113.62 120.03 2hm8 n SER 393 Ca 0.06 -2.04 -0.18 0.00 1.01 0.00 0.00 58.87 57.72 2hm8 n SER 393 Cb 0.39 -0.27 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 2hm8 n SER 393 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2hm8 n SER 394 N 0.52 -5.13 -0.02 6.43 2.88 -0.89 -4.86 113.62 112.56 2hm8 n SER 394 Ca 0.12 0.16 0.05 0.00 -1.33 0.00 0.00 58.87 57.87 2hm8 n SER 394 Cb 0.34 -4.20 -0.13 0.00 -0.75 0.00 0.00 64.21 59.47 2hm8 n SER 394 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2hm8 n THR 395 N -3.43 0.26 -3.70 2.46 -1.04 -0.29 -4.78 114.28 103.76 2hm8 n THR 395 Ca -0.20 -0.47 -0.29 0.00 -2.04 0.00 0.00 64.05 61.06 2hm8 n THR 395 Cb 0.63 -0.06 -0.12 0.00 -1.82 0.00 0.00 70.33 68.96 2hm8 n THR 395 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2hm8 s ILE 396 N -3.03 1.61 1.01 12.58 -1.09 -1.15 -4.92 121.20 126.20 2hm8 s ILE 396 Ca -0.07 -3.05 -0.15 0.00 -2.23 0.00 0.00 60.65 55.15 2hm8 s ILE 396 Cb 0.10 -2.10 0.04 0.00 -1.58 0.00 0.00 42.46 38.92 2hm8 s ILE 396 CO 0.72 -0.99 0.16 0.41 -1.23 0.00 0.00 174.94 174.01 2hm8 n THR 397 N 2.98 0.00 0.11 2.92 -1.04 -1.26 -4.49 114.28 113.50 2hm8 n THR 397 Ca 0.16 -0.24 0.03 0.00 -2.04 0.00 0.00 64.05 61.96 2hm8 n THR 397 Cb 0.37 -0.57 0.43 0.00 -1.82 0.00 0.00 70.33 68.74 2hm8 n THR 397 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2hm8 h ILE 398 N -1.68 1.14 0.00 12.58 2.10 -1.93 -1.65 117.51 128.06 2hm8 h ILE 398 Ca -0.47 -0.56 -0.06 0.00 1.08 0.00 0.00 64.86 64.85 2hm8 h ILE 398 Cb 1.31 1.04 -0.01 0.00 -1.09 0.00 0.00 36.82 38.07 2hm8 h ILE 398 CO 0.35 0.18 -0.31 0.44 -1.08 0.00 0.00 178.15 177.73 2hm8 h ASP 399 N 0.27 0.00 -0.49 2.19 5.19 -1.99 -2.91 116.42 118.69 2hm8 h ASP 399 Ca 0.06 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 2hm8 h ASP 399 Cb 0.24 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.72 2hm8 h ASP 399 CO 0.01 0.31 0.12 1.56 -3.12 0.00 0.00 179.24 178.12 2hm8 h GLN 400 N 0.00 0.84 0.08 3.56 4.20 -1.61 -1.93 115.11 120.25 2hm8 h GLN 400 Ca -0.00 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 2hm8 h GLN 400 Cb 0.73 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.39 2hm8 h GLN 400 CO 0.04 0.76 -0.04 0.52 -0.67 0.00 0.00 178.83 179.44 2hm8 h MET 401 N 0.81 -0.10 -0.97 1.46 2.86 -1.55 -1.13 114.93 116.31 2hm8 h MET 401 Ca 0.18 0.01 0.16 0.00 -2.06 0.00 0.00 59.70 57.99 2hm8 h MET 401 Cb 0.31 0.02 -0.10 0.00 0.06 0.00 0.00 31.60 31.89 2hm8 h MET 401 CO -0.00 0.42 0.57 0.87 1.06 0.00 0.00 176.91 179.83 2hm8 h LYS 402 N -0.71 0.76 0.11 1.72 1.57 -1.48 0.85 116.57 119.39 2hm8 h LYS 402 Ca -0.01 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2hm8 h LYS 402 Cb 0.57 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2hm8 h LYS 402 CO 0.02 0.50 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.26 2hm8 h ARG 403 N 0.78 -0.14 0.29 3.15 1.12 -1.38 -2.79 114.38 115.41 2hm8 h ARG 403 Ca 0.53 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 59.42 2hm8 h ARG 403 Cb 0.75 0.03 -0.04 0.00 -0.01 0.00 0.00 29.97 30.70 2hm8 h ARG 403 CO -0.35 0.35 -0.47 0.78 -3.11 0.00 0.00 179.97 177.17 2hm8 h GLY 404 N -0.75 -1.06 0.26 2.80 0.00 -0.66 -1.91 103.07 101.75 2hm8 h GLY 404 Ca -0.01 0.56 0.19 0.00 0.00 0.00 0.00 47.33 48.06 2hm8 h GLY 404 CO 0.02 -0.31 0.61 -0.97 0.00 0.00 0.00 176.54 175.89 2hm8 h TYR 405 N -0.82 0.82 -0.50 5.60 0.05 -0.98 0.21 116.97 121.35 2hm8 h TYR 405 Ca -0.02 0.03 0.09 0.00 0.05 0.00 0.00 58.73 58.87 2hm8 h TYR 405 Cb 0.77 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 38.23 2hm8 h TYR 405 CO -0.33 0.22 0.34 0.93 -1.05 0.00 0.00 178.16 178.27 2hm8 h GLU 406 N 0.62 0.30 -0.36 4.88 4.39 -1.06 -1.03 114.58 122.32 2hm8 h GLU 406 Ca 0.51 -0.02 -0.15 0.00 0.34 0.00 0.00 59.36 60.05 2hm8 h GLU 406 Cb 0.98 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2hm8 h GLU 406 CO -0.27 0.20 -0.36 0.00 -1.16 0.00 0.00 179.01 177.43 2hm8 h ARG 407 N 0.31 0.82 -0.29 2.33 2.47 -0.30 -2.94 114.38 116.78 2hm8 h ARG 407 Ca 0.23 -0.41 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 2hm8 h ARG 407 Cb 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 2hm8 h ARG 407 CO -0.05 1.05 0.18 0.82 0.56 0.00 0.00 179.97 182.53 2hm8 h ILE 408 N 0.68 1.08 0.00 2.04 1.08 -1.11 0.34 117.51 121.63 2hm8 h ILE 408 Ca 0.06 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 2hm8 h ILE 408 Cb 0.92 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2hm8 h ILE 408 CO 0.08 0.08 0.00 -1.22 -0.69 0.00 0.00 178.15 176.40 2hm8 n TYR 409 N -4.49 0.01 -1.77 1.37 4.01 -1.11 -3.17 117.16 112.02 2hm8 n TYR 409 Ca 0.01 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.80 2hm8 n TYR 409 Cb 0.07 -0.51 0.08 0.00 -0.31 0.00 0.00 39.34 38.68 2hm8 n TYR 409 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2hm8 n ASN 410 N -1.51 1.16 -0.85 7.72 5.15 0.14 -4.73 115.26 122.34 2hm8 n ASN 410 Ca 0.06 -2.63 0.01 0.00 -0.60 0.00 0.00 54.58 51.41 2hm8 n ASN 410 Cb 0.30 -0.34 0.00 0.00 -0.53 0.00 0.00 39.78 39.21 2hm8 n ASN 410 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2hm8 n GLU 411 N -0.50 0.00 -3.01 1.20 -0.58 0.97 -4.93 120.64 113.79 2hm8 n GLU 411 Ca 0.09 -1.23 -0.27 0.00 -0.42 0.00 0.00 57.16 55.34 2hm8 n GLU 411 Cb 0.77 -0.23 -0.05 0.00 -0.57 0.00 0.00 31.44 31.36 2hm8 n GLU 411 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 2hm8 n ILE 412 N 0.16 2.89 0.09 -3.67 3.06 -1.22 -4.87 119.36 115.80 2hm8 n ILE 412 Ca 0.00 -5.51 -0.12 0.00 -2.50 0.00 0.00 62.75 54.62 2hm8 n ILE 412 Cb 0.83 -1.46 -0.08 0.00 0.54 0.00 0.00 39.64 39.46 2hm8 n ILE 412 CO 0.00 0.00 0.00 1.55 -2.50 0.00 0.00 176.55 175.60 2hm8 h PRO 413 N 3.14 -0.27 0.00 9.51 0.13 -1.93 -3.33 132.00 139.26 2hm8 h PRO 413 Ca 0.14 0.02 -0.27 0.00 -0.87 0.00 0.00 66.00 65.01 2hm8 h PRO 413 Cb 0.54 0.06 -0.05 0.00 0.13 0.00 0.00 31.00 31.67 2hm8 h PRO 413 CO 0.81 0.12 -2.02 -0.25 -0.23 0.00 0.00 178.00 176.43 2hm8 n ASP 414 N -5.01 1.58 -0.06 1.44 8.00 -1.26 -4.44 116.55 116.81 2hm8 n ASP 414 Ca -0.09 -0.02 0.25 0.00 0.71 0.00 0.00 54.79 55.64 2hm8 n ASP 414 Cb 0.26 0.65 0.70 0.00 -0.02 0.00 0.00 41.12 42.71 2hm8 n ASP 414 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2hm8 h ILE 415 N 0.00 0.36 -0.95 0.53 2.04 -1.90 0.22 117.51 117.81 2hm8 h ILE 415 Ca -0.40 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.46 2hm8 h ILE 415 Cb 1.86 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 2hm8 h ILE 415 CO 0.01 0.00 0.62 -1.13 0.00 0.00 0.00 178.15 177.65 2hm8 h ASN 416 N 0.00 1.11 -3.35 1.72 -0.00 -1.78 -3.42 115.58 109.86 2hm8 h ASN 416 Ca 0.33 -0.04 -0.66 0.00 -0.00 0.00 0.00 56.30 55.93 2hm8 h ASN 416 Cb 1.60 -0.28 -0.18 0.00 -0.00 0.00 0.00 38.32 39.46 2hm8 h ASN 416 CO -0.00 0.81 -0.64 -1.48 -0.00 0.00 0.00 177.43 176.12 2hm8 s LEU 417 N -10.05 3.44 -0.09 0.34 0.05 0.76 -4.63 118.68 108.50 2hm8 s LEU 417 Ca -0.13 0.02 -0.33 0.00 0.05 0.00 0.00 54.13 53.75 2hm8 s LEU 417 Cb 0.18 -1.81 0.14 0.00 -2.05 0.00 0.00 46.19 42.66 2hm8 s LEU 417 CO 0.81 0.28 1.43 -0.62 -0.55 0.00 0.00 176.35 177.70 2hm8 s ASP 418 N -0.29 -0.01 0.12 1.48 -1.08 -1.26 -4.92 116.67 110.71 2hm8 s ASP 418 Ca 0.06 -0.01 -0.31 0.00 -0.52 0.00 0.00 52.55 51.77 2hm8 s ASP 418 Cb -0.12 0.02 -0.09 0.00 -1.46 0.00 0.00 42.92 41.26 2hm8 s ASP 418 CO 0.02 -0.03 1.58 0.58 0.52 0.00 0.00 175.17 177.84 2hm8 h VAL 419 N 2.00 0.14 -1.57 1.11 2.07 -1.98 -3.43 116.25 114.58 2hm8 h VAL 419 Ca -0.33 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2hm8 h VAL 419 Cb 1.19 0.14 0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2hm8 h VAL 419 CO 0.30 0.00 0.01 -0.81 0.02 0.00 0.00 177.57 177.08 2hm8 n PRO 420 N -5.46 -1.13 -3.40 1.57 -0.04 -1.26 -4.98 135.00 120.30 2hm8 n PRO 420 Ca -0.06 -0.08 -0.37 0.00 -0.04 0.00 0.00 63.50 62.95 2hm8 n PRO 420 Cb 0.38 -0.08 -0.04 0.00 -0.04 0.00 0.00 33.50 33.71 2hm8 n PRO 420 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2hm8 n HIS 421 N -2.63 3.67 -0.12 0.54 8.25 -1.26 -4.90 115.22 118.77 2hm8 n HIS 421 Ca 0.01 -3.72 -0.05 0.00 -0.26 0.00 0.00 57.72 53.70 2hm8 n HIS 421 Cb 0.03 -1.08 0.02 0.00 1.12 0.00 0.00 29.99 30.07 2hm8 n HIS 421 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2hm8 h SER 422 N 5.49 -0.37 -0.88 0.41 4.64 -1.85 -0.04 113.55 120.96 2hm8 h SER 422 Ca 0.18 0.12 0.14 0.00 -0.47 0.00 0.00 61.79 61.76 2hm8 h SER 422 Cb 0.73 0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 63.00 2hm8 h SER 422 CO 0.99 -0.13 0.57 0.22 -0.87 0.00 0.00 176.83 177.61 2hm8 h TYR 423 N 0.00 0.81 0.00 4.77 3.20 -1.88 0.25 116.97 124.13 2hm8 h TYR 423 Ca 0.20 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 2hm8 h TYR 423 Cb 0.30 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 2hm8 h TYR 423 CO -0.36 0.31 -0.15 1.03 -1.64 0.00 0.00 178.16 177.35 2hm8 h SER 424 N 0.69 0.00 0.13 -2.11 0.87 -1.42 -1.81 113.55 109.91 2hm8 h SER 424 Ca 0.44 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.81 2hm8 h SER 424 Cb 0.70 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.68 2hm8 h SER 424 CO -0.20 0.15 -0.83 0.58 -0.53 0.00 0.00 176.83 176.00 2hm8 h VAL 425 N 0.00 1.49 -0.18 2.23 2.07 -0.17 -2.99 116.25 118.70 2hm8 h VAL 425 Ca -0.00 -2.52 -0.00 0.00 0.82 0.00 0.00 66.70 65.00 2hm8 h VAL 425 Cb 0.38 3.17 -0.01 0.00 -1.52 0.00 0.00 31.29 33.32 2hm8 h VAL 425 CO 0.02 0.71 0.10 0.25 0.02 0.00 0.00 177.57 178.67 2hm8 h LEU 426 N -0.40 0.23 -0.05 2.57 5.85 -1.15 0.29 115.31 122.65 2hm8 h LEU 426 Ca -0.15 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.50 2hm8 h LEU 426 Cb 1.62 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.58 2hm8 h LEU 426 CO 0.14 0.25 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.13 2hm8 h GLU 427 N 0.19 -0.02 -0.71 1.25 4.39 -1.47 0.28 114.58 118.50 2hm8 h GLU 427 Ca 0.06 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 2hm8 h GLU 427 Cb 0.07 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 2hm8 h GLU 427 CO -0.01 -0.01 0.17 -0.09 -1.16 0.00 0.00 179.01 177.91 2hm8 h ARG 428 N -0.02 1.13 -0.57 2.33 2.43 -1.41 0.19 114.38 118.46 2hm8 h ARG 428 Ca 0.03 -0.27 -0.09 0.00 -0.81 0.00 0.00 59.98 58.84 2hm8 h ARG 428 Cb 0.06 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2hm8 h ARG 428 CO -0.07 0.99 0.01 0.35 -1.51 0.00 0.00 179.97 179.75 2hm8 h PHE 429 N 1.07 1.09 0.22 2.20 3.57 -0.06 -1.72 116.94 123.31 2hm8 h PHE 429 Ca 0.22 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2hm8 h PHE 429 Cb 0.37 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2hm8 h PHE 429 CO 0.03 0.97 -0.11 0.28 -2.23 0.00 0.00 178.31 177.25 2hm8 h VAL 430 N 0.89 0.59 -0.65 1.41 2.07 -0.23 -3.07 116.25 117.26 2hm8 h VAL 430 Ca 0.16 -0.98 0.19 0.00 0.82 0.00 0.00 66.70 66.89 2hm8 h VAL 430 Cb 0.53 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2hm8 h VAL 430 CO 0.03 0.15 0.50 1.05 0.02 0.00 0.00 177.57 179.32 2hm8 h GLU 431 N -0.94 0.00 0.08 1.57 4.11 -0.68 -0.98 114.58 117.74 2hm8 h GLU 431 Ca -0.03 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.40 2hm8 h GLU 431 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2hm8 h GLU 431 CO 0.05 0.00 -0.04 0.93 0.07 0.00 0.00 179.01 180.02 2hm8 h GLU 432 N 0.00 -0.10 -0.88 1.06 4.39 -1.31 -2.81 114.58 114.93 2hm8 h GLU 432 Ca 0.31 0.01 0.02 0.00 0.34 0.00 0.00 59.36 60.03 2hm8 h GLU 432 Cb 1.30 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.93 2hm8 h GLU 432 CO -0.00 0.23 0.58 0.00 -1.16 0.00 0.00 179.01 178.66 2hm8 h PHE 434 N 1.17 0.97 0.00 0.00 3.57 -1.35 0.40 116.94 121.70 2hm8 h PHE 434 Ca 0.33 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.76 2hm8 h PHE 434 Cb -0.09 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.32 2hm8 h PHE 434 CO -0.01 0.46 -0.46 1.96 -2.23 0.00 0.00 178.31 178.04 2hm8 h GLN 435 N 0.92 0.00 0.00 1.11 1.08 -1.10 -3.11 115.11 114.01 2hm8 h GLN 435 Ca 0.40 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.43 2hm8 h GLN 435 Cb 0.35 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 2hm8 h GLN 435 CO -0.17 0.46 -0.82 0.00 -0.95 0.00 0.00 178.83 177.35 2hm8 h ALA 436 N 1.54 0.55 0.00 3.87 0.00 -0.31 -3.48 119.26 121.43 2hm8 h ALA 436 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2hm8 h ALA 436 Cb 1.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2hm8 h ALA 436 CO 0.06 1.03 0.00 0.41 0.00 0.00 0.00 179.25 180.75 2hm8 n GLY 437 N 1.07 0.75 1.49 0.00 0.00 -0.13 -4.96 105.19 103.41 2hm8 n GLY 437 Ca 0.00 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.72 2hm8 n GLY 437 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2hm8 n ILE 438 N -2.41 1.66 -3.75 -0.61 -5.35 -1.14 -4.93 119.36 102.82 2hm8 n ILE 438 Ca 0.00 -1.07 -0.10 0.00 -0.27 0.00 0.00 62.75 61.31 2hm8 n ILE 438 Cb 0.00 0.09 -0.05 0.00 -1.74 0.00 0.00 39.64 37.94 2hm8 n ILE 438 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 2hm8 s ILE 439 N -1.81 0.08 0.32 7.28 -4.36 -1.26 -4.96 121.20 116.49 2hm8 s ILE 439 Ca 0.47 -0.88 0.02 0.00 -0.26 0.00 0.00 60.65 60.00 2hm8 s ILE 439 Cb 0.30 -1.38 -0.03 0.00 1.25 0.00 0.00 42.46 42.60 2hm8 s ILE 439 CO 0.23 -0.36 0.49 -0.44 0.24 0.00 0.00 174.94 175.10 2hm8 s SER 440 N -2.85 6.28 0.34 4.36 0.01 -1.26 -4.87 113.70 115.71 2hm8 s SER 440 Ca 0.07 0.31 0.03 0.00 1.31 0.00 0.00 55.95 57.66 2hm8 s SER 440 Cb 0.02 -1.94 0.62 0.00 0.21 0.00 0.00 66.02 64.93 2hm8 s SER 440 CO -0.08 -0.24 1.96 0.11 0.41 0.00 0.00 173.24 175.40 2hm8 h LYS 441 N 0.87 0.75 -0.66 12.44 1.57 -2.00 -1.85 116.57 127.69 2hm8 h LYS 441 Ca -0.50 -0.08 0.18 0.00 -1.87 0.00 0.00 60.65 58.38 2hm8 h LYS 441 Cb 1.22 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 2hm8 h LYS 441 CO 0.61 0.56 0.47 0.37 -0.57 0.00 0.00 179.45 180.89 2hm8 h GLN 442 N 0.75 0.04 0.05 3.15 4.15 -2.00 -1.49 115.11 119.77 2hm8 h GLN 442 Ca 0.19 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.61 2hm8 h GLN 442 Cb 0.04 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.72 2hm8 h GLN 442 CO -0.03 0.03 -0.02 -0.07 -1.93 0.00 0.00 178.83 176.81 2hm8 h LEU 443 N 0.05 -0.06 -1.39 -2.39 3.38 -1.73 -3.05 115.31 110.12 2hm8 h LEU 443 Ca 0.31 -0.57 0.14 0.00 0.09 0.00 0.00 57.88 57.85 2hm8 h LEU 443 Cb 1.19 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 2hm8 h LEU 443 CO -0.02 0.59 0.54 -0.09 0.09 0.00 0.00 178.44 179.55 2hm8 h ARG 444 N -0.74 0.59 -0.02 1.13 2.43 -1.31 0.15 114.38 116.61 2hm8 h ARG 444 Ca -0.01 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 2hm8 h ARG 444 Cb 0.63 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2hm8 h ARG 444 CO 0.01 0.39 -0.32 -0.44 -1.51 0.00 0.00 179.97 178.10 2hm8 h ASP 445 N 0.61 0.04 1.12 -3.80 5.19 -1.34 -2.53 116.42 115.71 2hm8 h ASP 445 Ca 0.41 -0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.67 2hm8 h ASP 445 Cb 0.71 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.19 2hm8 h ASP 445 CO -0.17 0.37 -0.63 -0.07 -3.12 0.00 0.00 179.24 175.62 2hm8 h LEU 446 N 0.04 0.00 -9.56 1.55 4.07 -0.61 -3.44 115.31 107.35 2hm8 h LEU 446 Ca 0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 2hm8 h LEU 446 Cb 0.59 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 2hm8 h LEU 446 CO 0.04 0.63 0.31 0.00 -1.08 0.00 0.00 178.44 178.34 2hm8 s PRO 448 N -0.01 2.97 0.00 0.00 0.04 -1.26 -4.94 135.00 131.80 2hm8 s PRO 448 Ca 0.45 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2hm8 s PRO 448 Cb -0.23 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2hm8 s PRO 448 CO 0.28 -1.12 0.01 -1.13 0.04 0.00 0.00 177.00 175.08