#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mmv s PHE 300 N 0.00 3.21 0.15 -0.14 0.40 -1.26 -4.88 117.98 115.46 1mmv s PHE 300 Ca 0.00 -0.38 -0.04 0.00 -0.60 0.00 0.00 56.93 55.91 1mmv s PHE 300 Cb 0.00 -2.43 -0.05 0.00 0.51 0.00 0.00 43.02 41.05 1mmv s PHE 300 CO 0.00 -0.41 0.38 -0.51 0.70 0.00 0.00 175.22 175.39 1mmv s LEU 301 N 1.67 4.26 0.12 -0.37 1.43 -1.15 -4.93 118.68 119.71 1mmv s LEU 301 Ca 0.05 0.57 0.09 0.00 -1.03 0.00 0.00 54.13 53.81 1mmv s LEU 301 Cb -0.17 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 1mmv s LEU 301 CO 0.09 0.03 -0.20 -0.54 0.23 0.00 0.00 176.35 175.96 1mmv s LYS 302 N -2.76 1.70 -0.05 1.70 1.02 -1.26 0.38 119.74 120.46 1mmv s LYS 302 Ca 0.41 -1.22 0.03 0.00 0.02 0.00 0.00 55.97 55.21 1mmv s LYS 302 Cb -0.12 -2.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 1mmv s LYS 302 CO 0.25 0.47 -0.14 0.08 -0.92 0.00 0.00 175.35 175.10 1mmv s VAL 303 N -1.12 1.20 0.05 3.17 1.01 0.11 -4.95 120.40 119.85 1mmv s VAL 303 Ca 0.17 -0.56 0.09 0.00 0.00 0.00 0.00 61.98 61.68 1mmv s VAL 303 Cb -0.10 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 1mmv s VAL 303 CO 0.09 0.36 -0.25 -0.75 0.00 0.00 0.00 175.10 174.55 1mmv s LYS 304 N 0.30 1.85 -0.34 2.72 2.20 -1.26 -0.15 119.74 125.06 1mmv s LYS 304 Ca -0.08 -1.09 -0.11 0.00 -0.36 0.00 0.00 55.97 54.34 1mmv s LYS 304 Cb -0.13 -2.02 0.01 0.00 -1.51 0.00 0.00 37.83 34.18 1mmv s LYS 304 CO 0.03 0.52 0.19 1.21 -0.36 0.00 0.00 175.35 176.93 1mmv s ASN 305 N -1.29 5.69 0.00 1.43 3.84 -0.42 -1.67 114.94 122.51 1mmv s ASN 305 Ca 0.12 -0.71 0.02 0.00 0.21 0.00 0.00 52.86 52.51 1mmv s ASN 305 Cb -0.10 -2.03 0.14 0.00 -0.55 0.00 0.00 41.25 38.71 1mmv s ASN 305 CO 0.03 -0.28 0.81 0.79 -2.79 0.00 0.00 177.10 175.66 1mmv n TRP 306 N 5.01 0.00 -0.06 0.43 7.02 0.02 0.13 117.44 129.99 1mmv n TRP 306 Ca -0.13 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.28 1mmv n TRP 306 Cb 0.48 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.29 1mmv n TRP 306 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1mmv n GLU 307 N -0.55 1.40 0.00 -0.99 2.13 -1.26 -4.66 120.64 116.70 1mmv n GLU 307 Ca 0.02 0.03 0.03 0.00 0.66 0.00 0.00 57.16 57.90 1mmv n GLU 307 Cb 0.01 -1.28 0.01 0.00 0.27 0.00 0.00 31.44 30.45 1mmv n GLU 307 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1mmv n THR 308 N -2.62 0.00 -0.36 6.31 -2.24 -1.15 -4.99 114.28 109.23 1mmv n THR 308 Ca -0.21 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1mmv n THR 308 Cb 0.81 1.09 0.00 0.00 -2.10 0.00 0.00 70.33 70.14 1mmv n THR 308 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1mmv n ASP 309 N -0.05 0.00 -4.70 3.42 8.00 0.12 -4.94 116.55 118.40 1mmv n ASP 309 Ca 0.03 0.00 -0.44 0.00 0.71 0.00 0.00 54.79 55.09 1mmv n ASP 309 Cb 0.13 -1.47 -0.02 0.00 -0.02 0.00 0.00 41.12 39.74 1mmv n ASP 309 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1mmv n VAL 310 N -2.00 0.93 -5.26 2.53 0.31 -1.24 -4.67 118.33 108.93 1mmv n VAL 310 Ca 0.00 -0.23 -0.32 0.00 -0.01 0.00 0.00 64.34 63.78 1mmv n VAL 310 Cb 0.00 -1.68 -0.17 0.00 -0.91 0.00 0.00 33.84 31.08 1mmv n VAL 310 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1mmv s VAL 311 N 0.01 2.06 0.03 2.52 1.01 -1.26 -1.30 120.40 123.47 1mmv s VAL 311 Ca 0.67 -1.06 0.08 0.00 0.00 0.00 0.00 61.98 61.67 1mmv s VAL 311 Cb -0.59 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1mmv s VAL 311 CO 0.48 0.57 -0.25 -0.76 0.00 0.00 0.00 175.10 175.15 1mmv s LEU 312 N -0.09 2.14 -0.14 3.92 1.43 0.78 -4.95 118.68 121.78 1mmv s LEU 312 Ca -0.06 -0.54 -0.07 0.00 -1.03 0.00 0.00 54.13 52.43 1mmv s LEU 312 Cb -0.14 -1.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 1mmv s LEU 312 CO 0.05 0.24 0.09 -0.89 0.23 0.00 0.00 176.35 176.07 1mmv s THR 313 N -0.75 5.11 -0.20 5.49 2.01 -1.26 0.04 115.64 126.07 1mmv s THR 313 Ca 0.10 0.07 -0.03 0.00 0.31 0.00 0.00 61.69 62.13 1mmv s THR 313 Cb -0.10 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 69.15 1mmv s THR 313 CO 0.01 0.55 -0.05 -0.62 -0.69 0.00 0.00 174.62 173.82 1mmv s ASP 314 N -0.44 4.37 -0.00 3.53 -1.08 0.16 -4.60 116.67 118.61 1mmv s ASP 314 Ca 0.11 -0.34 0.01 0.00 -0.52 0.00 0.00 52.55 51.81 1mmv s ASP 314 Cb -0.12 -1.74 -0.01 0.00 -1.46 0.00 0.00 42.92 39.59 1mmv s ASP 314 CO 0.02 0.03 0.02 0.35 0.52 0.00 0.00 175.17 176.10 1mmv n THR 315 N 4.45 0.01 -0.09 1.71 -2.24 0.10 -2.92 114.28 115.30 1mmv n THR 315 Ca -0.18 -0.02 0.16 0.00 -2.27 0.00 0.00 64.05 61.74 1mmv n THR 315 Cb 0.51 0.17 0.56 0.00 -2.10 0.00 0.00 70.33 69.48 1mmv n THR 315 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1mmv h LEU 316 N 0.00 0.26 -2.24 3.22 6.46 -1.51 -0.27 115.31 121.23 1mmv h LEU 316 Ca -0.00 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1mmv h LEU 316 Cb 0.25 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.14 1mmv h LEU 316 CO 0.00 0.14 -0.04 1.12 -0.62 0.00 0.00 178.44 179.04 1mmv h HIS 317 N 0.28 0.00 0.00 1.25 2.07 -1.83 -1.41 115.15 115.51 1mmv h HIS 317 Ca 0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.83 1mmv h HIS 317 Cb 0.84 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.82 1mmv h HIS 317 CO -0.00 0.04 0.00 1.28 -3.07 0.00 0.00 177.93 176.18 1mmv n LEU 318 N -3.85 0.00 -0.73 6.12 4.77 -0.11 -1.13 117.00 122.07 1mmv n LEU 318 Ca -0.03 0.18 0.06 0.00 -0.03 0.00 0.00 56.01 56.20 1mmv n LEU 318 Cb 0.13 -0.18 0.19 0.00 -2.33 0.00 0.00 43.42 41.23 1mmv n LEU 318 CO 0.29 -0.12 0.66 0.29 -1.33 0.00 0.00 177.39 177.17 1mmv n LYS 319 N -1.18 2.91 -2.04 3.23 5.02 -0.53 -5.01 118.16 120.55 1mmv n LYS 319 Ca 0.06 -2.29 -0.34 0.00 -2.02 0.00 0.00 58.31 53.72 1mmv n LYS 319 Cb 0.06 -1.44 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 1mmv n LYS 319 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1mmv s SER 320 N -1.26 5.43 0.09 4.39 0.15 -0.28 -4.93 113.70 117.30 1mmv s SER 320 Ca 0.29 2.12 0.00 0.00 0.70 0.00 0.00 55.95 59.06 1mmv s SER 320 Cb 0.19 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 1mmv s SER 320 CO 0.14 -1.41 0.00 1.07 1.20 0.00 0.00 173.24 174.24 1mmv n THR 321 N -1.77 0.70 -1.29 6.45 5.66 -1.16 -5.07 114.28 117.80 1mmv n THR 321 Ca 0.11 0.23 -0.30 0.00 -3.05 0.00 0.00 64.05 61.04 1mmv n THR 321 Cb 0.51 -1.37 0.12 0.00 -1.55 0.00 0.00 70.33 68.04 1mmv n THR 321 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1mmv s LEU 322 N -6.63 2.51 0.58 1.09 1.43 -1.26 -5.04 118.68 111.36 1mmv s LEU 322 Ca 0.00 1.53 -0.07 0.00 -1.03 0.00 0.00 54.13 54.56 1mmv s LEU 322 Cb 0.00 -4.06 -0.01 0.00 0.03 0.00 0.00 46.19 42.16 1mmv s LEU 322 CO 0.00 -2.36 0.91 -1.61 0.23 0.00 0.00 176.35 173.52 1mmv s GLU 323 N -4.97 3.12 -0.02 1.70 2.02 -1.26 -4.58 118.70 114.71 1mmv s GLU 323 Ca 0.62 0.18 0.19 0.00 0.02 0.00 0.00 54.97 55.98 1mmv s GLU 323 Cb -0.17 -2.24 -0.27 0.00 0.10 0.00 0.00 34.13 31.55 1mmv s GLU 323 CO 0.56 -0.62 0.52 0.25 0.02 0.00 0.00 175.26 176.00 1mmv n THR 324 N -2.58 0.00 -0.03 3.63 -2.24 -1.26 -4.83 114.28 106.97 1mmv n THR 324 Ca 0.04 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1mmv n THR 324 Cb 0.57 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1mmv n THR 324 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mmv n GLY 325 N 1.42 0.57 3.99 3.38 0.00 -1.26 -4.91 105.19 108.38 1mmv n GLY 325 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1mmv n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mmv s THR 327 N -2.19 0.00 0.39 0.00 -4.23 0.47 -4.99 115.64 105.09 1mmv s THR 327 Ca 0.46 -1.71 0.36 0.00 -1.18 0.00 0.00 61.69 59.61 1mmv s THR 327 Cb -0.10 -2.53 0.38 0.00 1.34 0.00 0.00 72.50 71.60 1mmv s THR 327 CO 0.31 0.00 2.14 -0.33 -0.54 0.00 0.00 174.62 176.21 1mmv h GLU 328 N 2.22 0.00 0.00 3.99 3.07 -2.05 -2.90 114.58 118.91 1mmv h GLU 328 Ca -0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 1mmv h GLU 328 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1mmv h GLU 328 CO 0.40 0.04 -1.94 0.72 -1.40 0.00 0.00 179.01 176.83 1mmv n HIS 329 N -3.24 0.01 -3.74 4.33 8.25 -1.26 -4.99 115.22 114.58 1mmv n HIS 329 Ca -0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.32 1mmv n HIS 329 Cb 0.21 -0.48 -0.11 0.00 1.12 0.00 0.00 29.99 30.73 1mmv n HIS 329 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1mmv s ILE 330 N -3.49 -0.01 -0.20 1.59 2.07 -1.09 -5.14 121.20 114.93 1mmv s ILE 330 Ca -0.07 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.13 1mmv s ILE 330 Cb 0.14 -0.54 -0.03 0.00 0.13 0.00 0.00 42.46 42.16 1mmv s ILE 330 CO 0.91 0.01 0.04 0.00 -1.91 0.00 0.00 174.94 173.99 1mmv n MET 332 N 4.03 1.95 -0.15 0.00 0.00 -1.26 -4.78 117.12 116.90 1mmv n MET 332 Ca -0.17 -3.25 0.27 0.00 0.00 0.00 0.00 57.70 54.56 1mmv n MET 332 Cb 0.52 -1.87 0.72 0.00 0.00 0.00 0.00 33.22 32.59 1mmv n MET 332 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1mmv h GLY 333 N 1.09 0.00 -2.03 3.03 0.00 -1.93 -1.41 103.07 101.82 1mmv h GLY 333 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1mmv h GLY 333 CO 0.47 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.87 1mmv n SER 334 N -4.27 3.07 -4.69 0.19 3.41 -1.26 -4.88 113.62 105.19 1mmv n SER 334 Ca 0.17 -1.95 -0.42 0.00 -0.26 0.00 0.00 58.87 56.41 1mmv n SER 334 Cb 0.92 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 1mmv n SER 334 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1mmv s ILE 335 N -1.43 4.82 0.35 -1.33 -1.09 -0.53 -4.93 121.20 117.05 1mmv s ILE 335 Ca 0.38 2.03 0.06 0.00 -2.23 0.00 0.00 60.65 60.90 1mmv s ILE 335 Cb 0.21 -4.31 0.30 0.00 -1.58 0.00 0.00 42.46 37.08 1mmv s ILE 335 CO 0.29 0.06 1.93 -0.03 -1.23 0.00 0.00 174.94 175.96 1mmv h MET 336 N 7.00 0.75 -1.47 2.79 4.05 -1.90 -3.38 114.93 122.77 1mmv h MET 336 Ca -0.34 -0.05 -0.21 0.00 -0.28 0.00 0.00 59.70 58.82 1mmv h MET 336 Cb 1.17 -0.17 -0.25 0.00 -0.80 0.00 0.00 31.60 31.55 1mmv h MET 336 CO 0.82 0.50 -0.57 -0.48 0.23 0.00 0.00 176.91 177.41 1mmv s LEU 337 N -9.76 -0.81 0.00 3.39 0.05 -1.26 -5.18 118.68 105.12 1mmv s LEU 337 Ca -0.10 -1.17 -0.01 0.00 0.05 0.00 0.00 54.13 52.90 1mmv s LEU 337 Cb 0.20 1.27 -0.01 0.00 -2.05 0.00 0.00 46.19 45.61 1mmv s LEU 337 CO 0.78 -0.21 1.02 -0.65 -0.55 0.00 0.00 176.35 176.73 1mmv h PRO 338 N 7.03 -0.03 0.00 1.48 0.11 -1.91 -3.54 132.00 135.13 1mmv h PRO 338 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1mmv h PRO 338 Cb 1.12 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1mmv h PRO 338 CO 0.15 -0.02 0.00 2.41 -0.21 0.00 0.00 178.00 180.33 1mmv n THR 350 N -2.34 0.00 -0.34 -1.15 -1.04 -1.26 -5.03 114.28 103.13 1mmv n THR 350 Ca -0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.06 1mmv n THR 350 Cb 0.02 0.00 0.21 0.00 -1.82 0.00 0.00 70.33 68.74 1mmv n THR 350 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1mmv h LYS 351 N 0.00 0.89 -0.04 -2.82 1.57 -1.95 0.43 116.57 114.65 1mmv h LYS 351 Ca 0.00 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1mmv h LYS 351 Cb 0.00 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1mmv h LYS 351 CO 0.00 0.59 -0.14 -0.44 -0.57 0.00 0.00 179.45 178.88 1mmv h ASP 352 N 0.91 0.06 0.49 0.86 3.32 -2.00 -2.54 116.42 117.52 1mmv h ASP 352 Ca 0.46 -0.01 -0.30 0.00 0.02 0.00 0.00 57.03 57.20 1mmv h ASP 352 Cb 0.45 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 1mmv h ASP 352 CO -0.26 0.21 -1.46 1.56 -1.72 0.00 0.00 179.24 177.56 1mmv h GLN 353 N 0.06 0.26 0.10 3.56 4.20 -1.16 -3.39 115.11 118.75 1mmv h GLN 353 Ca 0.01 -0.45 -0.01 0.00 0.06 0.00 0.00 58.65 58.27 1mmv h GLN 353 Cb 0.29 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1mmv h GLN 353 CO 0.02 1.15 -0.05 1.25 -0.67 0.00 0.00 178.83 180.53 1mmv h LEU 354 N 0.07 -0.12 -1.42 1.46 5.85 0.10 -3.24 115.31 118.01 1mmv h LEU 354 Ca -0.22 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.26 1mmv h LEU 354 Cb 2.01 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 43.04 1mmv h LEU 354 CO 0.18 0.22 0.42 0.15 -0.34 0.00 0.00 178.44 179.07 1mmv h PHE 355 N -0.47 0.73 -0.39 1.25 3.57 -1.69 0.97 116.94 120.91 1mmv h PHE 355 Ca -0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1mmv h PHE 355 Cb 0.39 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1mmv h PHE 355 CO 0.03 0.42 0.22 -1.35 -2.23 0.00 0.00 178.31 175.40 1mmv h PRO 356 N 0.75 0.54 -0.36 6.41 0.11 -1.75 0.14 132.00 137.85 1mmv h PRO 356 Ca 0.25 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 1mmv h PRO 356 Cb 0.08 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1mmv h PRO 356 CO -0.07 0.44 0.16 -0.07 -0.21 0.00 0.00 178.00 178.25 1mmv h LEU 357 N 0.50 0.48 -0.69 2.35 3.38 -1.39 -0.68 115.31 119.26 1mmv h LEU 357 Ca 0.14 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1mmv h LEU 357 Cb 0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1mmv h LEU 357 CO -0.02 0.48 0.44 0.00 0.09 0.00 0.00 178.44 179.43 1mmv h ALA 358 N 1.01 0.88 -0.33 1.53 0.00 -0.56 -1.18 119.26 120.61 1mmv h ALA 358 Ca 0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1mmv h ALA 358 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1mmv h ALA 358 CO -0.01 0.33 0.17 -0.22 0.00 0.00 0.00 179.25 179.51 1mmv h LYS 359 N 0.94 0.46 -0.26 0.00 3.64 -0.43 0.12 116.57 121.04 1mmv h LYS 359 Ca 0.25 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1mmv h LYS 359 Cb -0.07 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 1mmv h LYS 359 CO -0.05 0.41 -0.00 1.49 -2.27 0.00 0.00 179.45 179.03 1mmv h GLU 360 N 0.40 0.08 0.48 1.90 4.81 -0.80 0.03 114.58 121.49 1mmv h GLU 360 Ca 0.11 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1mmv h GLU 360 Cb 0.09 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1mmv h GLU 360 CO -0.02 0.05 -0.23 0.35 -0.73 0.00 0.00 179.01 178.43 1mmv h PHE 361 N 0.08 -0.60 -0.75 0.92 3.57 -0.86 -2.51 116.94 116.79 1mmv h PHE 361 Ca 0.13 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.71 1mmv h PHE 361 Cb 0.16 0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.05 1mmv h PHE 361 CO -0.21 -0.35 0.49 -0.07 -2.23 0.00 0.00 178.31 175.95 1mmv h LEU 362 N -0.70 0.59 -0.37 0.59 3.38 -0.60 0.35 115.31 118.54 1mmv h LEU 362 Ca -0.07 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1mmv h LEU 362 Cb 0.52 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1mmv h LEU 362 CO 0.11 0.35 0.15 0.44 0.09 0.00 0.00 178.44 179.58 1mmv h ASP 363 N 0.65 0.52 -0.05 -0.43 3.32 -0.80 0.20 116.42 119.83 1mmv h ASP 363 Ca 0.35 -0.17 -0.12 0.00 0.02 0.00 0.00 57.03 57.11 1mmv h ASP 363 Cb 0.48 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1mmv h ASP 363 CO -0.13 0.54 -0.35 0.06 -1.72 0.00 0.00 179.24 177.64 1mmv h GLN 364 N 0.46 0.54 0.81 3.56 3.07 -0.86 -1.01 115.11 121.68 1mmv h GLN 364 Ca 0.12 -0.25 -0.04 0.00 0.09 0.00 0.00 58.65 58.57 1mmv h GLN 364 Cb 0.19 -0.01 0.01 0.00 0.08 0.00 0.00 27.48 27.75 1mmv h GLN 364 CO -0.01 0.82 -0.39 -0.92 0.09 0.00 0.00 178.83 178.42 1mmv h TYR 365 N 0.46 -1.01 -0.02 0.06 3.20 -0.55 -0.09 116.97 119.02 1mmv h TYR 365 Ca 0.05 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1mmv h TYR 365 Cb 0.83 0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.43 1mmv h TYR 365 CO 0.03 -0.62 -0.05 1.88 -1.64 0.00 0.00 178.16 177.76 1mmv h TYR 366 N -1.11 0.03 -0.48 -3.82 -1.99 -0.95 -0.93 116.97 107.71 1mmv h TYR 366 Ca -0.11 -0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.53 1mmv h TYR 366 Cb 0.84 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 39.55 1mmv h TYR 366 CO -0.01 0.08 -0.06 1.03 -0.00 0.00 0.00 178.16 179.19 1mmv h SER 367 N 0.03 0.88 0.22 3.88 0.87 -0.88 0.62 113.55 119.17 1mmv h SER 367 Ca 0.01 -0.34 -0.03 0.00 -1.23 0.00 0.00 61.79 60.20 1mmv h SER 367 Cb 0.10 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.82 1mmv h SER 367 CO 0.01 1.01 -0.16 0.77 -0.53 0.00 0.00 176.83 177.92 1mmv h SER 368 N 0.74 0.00 -0.58 6.23 4.64 0.36 -1.62 113.55 123.33 1mmv h SER 368 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1mmv h SER 368 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1mmv h SER 368 CO 0.04 0.16 0.00 2.30 -0.87 0.00 0.00 176.83 178.46 1mmv n ILE 369 N -4.12 0.99 -3.20 0.95 -5.35 -0.91 -4.94 119.36 102.79 1mmv n ILE 369 Ca -0.02 -0.84 -0.20 0.00 -0.27 0.00 0.00 62.75 61.41 1mmv n ILE 369 Cb 0.24 0.29 0.05 0.00 -1.74 0.00 0.00 39.64 38.48 1mmv n ILE 369 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1mmv n LYS 370 N 1.13 -5.73 -1.09 6.28 5.02 -0.61 -4.90 118.16 118.26 1mmv n LYS 370 Ca 0.20 0.77 0.05 0.00 -2.02 0.00 0.00 58.31 57.31 1mmv n LYS 370 Cb 0.57 -5.46 0.10 0.00 -0.02 0.00 0.00 35.03 30.22 1mmv n LYS 370 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1mmv n ARG 371 N -4.07 0.65 -1.89 1.97 5.12 0.18 -5.03 116.66 113.58 1mmv n ARG 371 Ca -0.04 -2.49 -0.42 0.00 -1.93 0.00 0.00 57.85 52.96 1mmv n ARG 371 Cb 0.58 -0.68 -0.03 0.00 -1.16 0.00 0.00 32.46 31.17 1mmv n ARG 371 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1mmv s PHE 372 N -1.33 2.58 -0.08 -1.55 5.36 -1.09 -2.05 117.98 119.83 1mmv s PHE 372 Ca 0.35 0.36 0.00 0.00 -0.96 0.00 0.00 56.93 56.68 1mmv s PHE 372 Cb 0.37 -3.99 0.00 0.00 -0.34 0.00 0.00 43.02 39.06 1mmv s PHE 372 CO -0.12 -3.89 0.00 0.41 -1.46 0.00 0.00 175.22 170.16 1mmv n GLY 373 N 3.96 0.47 3.93 13.12 0.00 -1.26 -5.02 105.19 120.38 1mmv n GLY 373 Ca 0.16 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1mmv n GLY 373 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mmv s SER 374 N -2.20 3.75 0.07 1.61 1.04 -0.87 -4.86 113.70 112.24 1mmv s SER 374 Ca 0.00 0.40 -0.19 0.00 0.48 0.00 0.00 55.95 56.64 1mmv s SER 374 Cb 0.00 -0.65 -0.10 0.00 0.10 0.00 0.00 66.02 65.38 1mmv s SER 374 CO 0.00 -2.34 1.49 0.50 0.98 0.00 0.00 173.24 173.87 1mmv h LYS 375 N -1.31 0.41 -0.63 4.02 3.64 -1.96 -0.95 116.57 119.79 1mmv h LYS 375 Ca -0.44 -0.15 0.10 0.00 -1.27 0.00 0.00 60.65 58.89 1mmv h LYS 375 Cb 1.27 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.99 1mmv h LYS 375 CO 0.48 0.63 0.23 0.00 -2.27 0.00 0.00 179.45 178.52 1mmv h ALA 376 N 0.77 0.82 0.28 5.00 0.00 -1.94 1.01 119.26 125.20 1mmv h ALA 376 Ca 0.06 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1mmv h ALA 376 Cb 0.46 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1mmv h ALA 376 CO 0.02 -0.20 -0.23 1.25 0.00 0.00 0.00 179.25 180.09 1mmv h HIS 377 N 0.41 -0.59 -0.44 0.00 -0.00 -1.74 -0.83 115.15 111.96 1mmv h HIS 377 Ca 0.32 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.69 1mmv h HIS 377 Cb 0.41 0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.03 1mmv h HIS 377 CO -0.17 -0.34 0.28 0.52 -0.00 0.00 0.00 177.93 178.21 1mmv h MET 378 N -0.52 0.58 0.03 5.26 2.07 0.02 -1.25 114.93 121.13 1mmv h MET 378 Ca -0.02 -0.04 0.01 0.00 -2.07 0.00 0.00 59.70 57.58 1mmv h MET 378 Cb 0.46 -0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 30.04 1mmv h MET 378 CO -0.02 0.41 -0.10 -0.44 1.07 0.00 0.00 176.91 177.83 1mmv h ASP 379 N 0.58 -0.29 -0.47 1.22 3.32 0.11 -0.67 116.42 120.23 1mmv h ASP 379 Ca 0.16 0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.32 1mmv h ASP 379 Cb -0.03 0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.57 1mmv h ASP 379 CO -0.03 -0.15 0.14 -0.09 -1.72 0.00 0.00 179.24 177.38 1mmv h ARG 380 N -0.19 0.28 -0.85 3.56 9.65 -0.96 0.29 114.38 126.16 1mmv h ARG 380 Ca 0.03 -0.02 0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1mmv h ARG 380 Cb 0.22 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.69 1mmv h ARG 380 CO -0.08 0.19 0.56 1.25 2.80 0.00 0.00 179.97 184.69 1mmv h LEU 381 N 0.29 0.89 -0.18 3.80 5.85 -0.85 -0.02 115.31 125.10 1mmv h LEU 381 Ca 0.23 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.80 1mmv h LEU 381 Cb 0.26 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1mmv h LEU 381 CO -0.26 0.61 -0.44 -0.08 -0.34 0.00 0.00 178.44 177.93 1mmv h GLU 382 N 1.03 0.60 -0.18 1.25 4.57 0.28 -1.63 114.58 120.51 1mmv h GLU 382 Ca 0.34 -0.42 0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1mmv h GLU 382 Cb 0.07 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1mmv h GLU 382 CO -0.11 1.03 0.05 1.49 -1.18 0.00 0.00 179.01 180.29 1mmv h GLU 383 N 0.27 0.12 -0.55 1.92 4.81 0.17 0.95 114.58 122.27 1mmv h GLU 383 Ca -0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1mmv h GLU 383 Cb 1.05 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 1mmv h GLU 383 CO 0.09 0.08 0.22 0.28 -0.73 0.00 0.00 179.01 178.96 1mmv h VAL 384 N 0.12 1.22 -0.34 0.32 2.07 -1.07 0.61 116.25 119.19 1mmv h VAL 384 Ca 0.08 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 66.97 1mmv h VAL 384 Cb 0.06 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1mmv h VAL 384 CO -0.09 0.26 0.06 -1.13 0.02 0.00 0.00 177.57 176.69 1mmv h ASN 385 N 0.76 0.00 0.20 0.57 -0.73 -0.82 0.12 115.58 115.68 1mmv h ASN 385 Ca 0.19 0.06 -0.09 0.00 1.87 0.00 0.00 56.30 58.32 1mmv h ASN 385 Cb 0.19 0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.85 1mmv h ASN 385 CO -0.02 0.04 -0.34 0.11 -0.37 0.00 0.00 177.43 176.85 1mmv h LYS 386 N 0.18 0.21 -0.40 6.67 1.79 -0.49 -2.29 116.57 122.24 1mmv h LYS 386 Ca 0.16 -0.09 -0.12 0.00 -2.18 0.00 0.00 60.65 58.42 1mmv h LYS 386 Cb 0.18 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1mmv h LYS 386 CO -0.21 0.54 -0.22 1.49 -1.08 0.00 0.00 179.45 179.97 1mmv h GLU 387 N 0.19 0.85 0.00 3.15 4.81 0.22 -2.37 114.58 121.44 1mmv h GLU 387 Ca 0.02 -0.38 -0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1mmv h GLU 387 Cb 0.70 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1mmv h GLU 387 CO 0.05 1.02 -0.00 0.82 -0.73 0.00 0.00 179.01 180.17 1mmv h ILE 388 N 0.66 1.19 -0.14 2.32 2.04 -0.66 0.69 117.51 123.61 1mmv h ILE 388 Ca 0.09 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.42 1mmv h ILE 388 Cb 0.78 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1mmv h ILE 388 CO 0.06 0.15 0.13 -0.08 0.00 0.00 0.00 178.15 178.41 1mmv h GLU 389 N -0.24 0.00 0.03 2.37 4.57 -1.41 1.14 114.58 121.02 1mmv h GLU 389 Ca -0.00 0.00 -0.38 0.00 -1.18 0.00 0.00 59.36 57.80 1mmv h GLU 389 Cb 0.24 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.78 1mmv h GLU 389 CO 0.00 0.00 -2.23 0.45 -1.18 0.00 0.00 179.01 176.05 1mmv n SER 390 N -4.03 1.99 -0.78 1.04 2.88 -0.89 -4.59 113.62 109.23 1mmv n SER 390 Ca 0.00 0.14 0.08 0.00 -1.33 0.00 0.00 58.87 57.77 1mmv n SER 390 Cb 0.24 -0.70 0.13 0.00 -0.75 0.00 0.00 64.21 63.14 1mmv n SER 390 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1mmv n THR 391 N -3.74 0.41 -1.66 2.46 -2.24 0.24 -4.96 114.28 104.79 1mmv n THR 391 Ca -0.44 -0.71 -0.19 0.00 -2.27 0.00 0.00 64.05 60.45 1mmv n THR 391 Cb 0.93 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 70.09 1mmv n THR 391 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1mmv n SER 392 N 0.97 -5.15 -3.37 3.42 3.41 0.39 -4.84 113.62 108.45 1mmv n SER 392 Ca 0.13 0.43 0.03 0.00 -0.26 0.00 0.00 58.87 59.19 1mmv n SER 392 Cb 0.45 -4.55 0.01 0.00 -0.26 0.00 0.00 64.21 59.87 1mmv n SER 392 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1mmv n THR 393 N -2.47 0.00 -3.93 6.66 5.66 -1.24 -4.83 114.28 114.13 1mmv n THR 393 Ca -0.20 -0.11 -0.09 0.00 -3.05 0.00 0.00 64.05 60.61 1mmv n THR 393 Cb 0.64 0.46 -0.04 0.00 -1.55 0.00 0.00 70.33 69.84 1mmv n THR 393 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1mmv s TYR 394 N -2.17 0.17 -0.06 1.09 -0.85 -1.26 -3.26 117.35 111.00 1mmv s TYR 394 Ca 0.25 -0.56 0.03 0.00 -0.52 0.00 0.00 57.07 56.28 1mmv s TYR 394 Cb -0.01 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.64 1mmv s TYR 394 CO -0.01 -1.04 -0.15 -0.65 -1.52 0.00 0.00 175.55 172.18 1mmv s GLN 395 N -3.98 2.66 0.32 -3.49 -1.52 -1.26 -5.05 119.66 107.35 1mmv s GLN 395 Ca 0.18 -0.72 -0.24 0.00 -1.95 0.00 0.00 55.36 52.64 1mmv s GLN 395 Cb -0.02 -2.40 -0.10 0.00 -0.22 0.00 0.00 33.01 30.27 1mmv s GLN 395 CO 0.07 0.53 0.90 -0.51 -0.25 0.00 0.00 175.29 176.03 1mmv s LEU 396 N -0.48 4.26 0.66 2.90 1.43 -1.26 -5.04 118.68 121.16 1mmv s LEU 396 Ca 0.06 1.73 -0.14 0.00 -1.03 0.00 0.00 54.13 54.75 1mmv s LEU 396 Cb -0.12 -4.04 -0.00 0.00 0.03 0.00 0.00 46.19 42.06 1mmv s LEU 396 CO 0.02 -0.10 1.08 -0.54 0.23 0.00 0.00 176.35 177.03 1mmv s LYS 397 N -2.26 2.91 0.29 1.70 -0.14 -1.26 -4.81 119.74 116.17 1mmv s LYS 397 Ca 0.51 1.20 0.02 0.00 -1.36 0.00 0.00 55.97 56.34 1mmv s LYS 397 Cb -0.16 -1.98 0.57 0.00 -1.68 0.00 0.00 37.83 34.58 1mmv s LYS 397 CO 0.21 -1.14 1.84 -0.44 -0.76 0.00 0.00 175.35 175.06 1mmv h ASP 398 N -0.18 0.92 -0.62 2.83 3.32 -1.99 -0.97 116.42 119.72 1mmv h ASP 398 Ca -0.46 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 1mmv h ASP 398 Cb 1.23 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1mmv h ASP 398 CO 0.55 0.48 0.20 0.71 -1.72 0.00 0.00 179.24 179.47 1mmv h THR 399 N 0.98 1.24 -0.05 0.35 1.35 -2.00 -1.72 112.91 113.06 1mmv h THR 399 Ca 0.50 -0.82 -0.15 0.00 -0.55 0.00 0.00 66.41 65.39 1mmv h THR 399 Cb 0.51 0.53 -0.01 0.00 -1.73 0.00 0.00 68.15 67.44 1mmv h THR 399 CO -0.27 0.32 -0.63 -0.33 -0.25 0.00 0.00 175.52 174.37 1mmv h GLU 400 N 0.95 0.20 -0.06 4.72 5.08 -1.59 -1.99 114.58 121.88 1mmv h GLU 400 Ca 0.21 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1mmv h GLU 400 Cb 0.27 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1mmv h GLU 400 CO -0.01 0.76 -0.01 1.25 -1.00 0.00 0.00 179.01 180.00 1mmv h LEU 401 N 0.14 0.11 -0.24 1.33 5.85 -0.86 0.36 115.31 122.00 1mmv h LEU 401 Ca -0.01 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 1mmv h LEU 401 Cb 1.14 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1mmv h LEU 401 CO 0.09 0.42 0.14 0.40 -0.34 0.00 0.00 178.44 179.15 1mmv h ILE 402 N -0.20 1.10 -1.00 4.05 2.04 -1.31 -0.80 117.51 121.39 1mmv h ILE 402 Ca 0.02 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1mmv h ILE 402 Cb 0.36 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 1mmv h ILE 402 CO 0.00 0.10 0.66 0.22 0.00 0.00 0.00 178.15 179.13 1mmv h TYR 403 N 0.29 1.24 0.22 1.37 3.20 -1.33 -1.40 116.97 120.57 1mmv h TYR 403 Ca 0.09 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1mmv h TYR 403 Cb 0.04 -0.42 0.00 0.00 1.54 0.00 0.00 36.73 37.89 1mmv h TYR 403 CO -0.04 0.76 -0.11 0.78 -1.64 0.00 0.00 178.16 177.91 1mmv h GLY 404 N 1.32 -0.31 0.70 1.82 0.00 -0.47 -1.52 103.07 104.60 1mmv h GLY 404 Ca 0.38 0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.86 1mmv h GLY 404 CO -0.09 -0.11 0.10 0.00 0.00 0.00 0.00 176.54 176.43 1mmv h ALA 405 N 0.17 0.37 -0.89 3.60 0.00 -1.00 0.16 119.26 121.67 1mmv h ALA 405 Ca -0.03 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1mmv h ALA 405 Cb 0.40 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1mmv h ALA 405 CO 0.05 -0.30 0.59 0.87 0.00 0.00 0.00 179.25 180.46 1mmv h LYS 406 N 0.24 1.13 0.00 0.00 1.57 -1.26 -2.31 116.57 115.94 1mmv h LYS 406 Ca 0.15 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.74 1mmv h LYS 406 Cb 0.13 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1mmv h LYS 406 CO -0.16 0.75 -0.57 0.45 -0.57 0.00 0.00 179.45 179.34 1mmv h HIS 407 N 1.17 0.00 -0.52 -1.35 3.86 -0.52 -1.18 115.15 116.61 1mmv h HIS 407 Ca 0.34 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.48 1mmv h HIS 407 Cb -0.07 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 1mmv h HIS 407 CO -0.00 0.57 0.04 0.00 0.86 0.00 0.00 177.93 179.41 1mmv h ALA 408 N 1.43 1.09 -0.14 2.45 0.00 -0.19 0.40 119.26 124.29 1mmv h ALA 408 Ca -0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1mmv h ALA 408 Cb 1.30 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1mmv h ALA 408 CO 0.07 0.58 -0.10 2.35 0.00 0.00 0.00 179.25 182.16 1mmv h TRP 409 N 0.80 0.38 -0.70 0.00 7.01 -1.29 -2.47 115.95 119.69 1mmv h TRP 409 Ca 0.16 -0.10 0.14 0.00 2.11 0.00 0.00 58.89 61.20 1mmv h TRP 409 Cb 0.42 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.36 1mmv h TRP 409 CO 0.02 0.68 0.47 -0.09 -2.79 0.00 0.00 178.44 176.74 1mmv h ARG 410 N -0.03 0.33 -0.01 2.65 2.43 -0.77 -1.46 114.38 117.52 1mmv h ARG 410 Ca 0.03 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1mmv h ARG 410 Cb 0.60 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1mmv h ARG 410 CO 0.03 0.22 -0.13 0.09 -1.51 0.00 0.00 179.97 178.67 1mmv n ASN 411 N -4.46 1.45 -4.56 -3.80 3.02 0.09 -4.81 115.26 102.19 1mmv n ASN 411 Ca 0.13 -1.29 -0.28 0.00 -0.03 0.00 0.00 54.58 53.11 1mmv n ASN 411 Cb 0.52 0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.72 1mmv n ASN 411 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mmv s ALA 412 N -2.23 1.72 0.38 5.41 0.00 -0.55 -4.72 121.76 121.77 1mmv s ALA 412 Ca 0.31 -1.53 0.27 0.00 0.00 0.00 0.00 51.96 51.01 1mmv s ALA 412 Cb 0.20 -4.55 1.47 0.00 0.00 0.00 0.00 23.12 20.24 1mmv s ALA 412 CO 0.42 -4.74 1.80 0.66 0.00 0.00 0.00 175.76 173.90 1mmv h SER 413 N 11.28 0.00 -0.01 0.00 4.64 -1.88 -0.86 113.55 126.73 1mmv h SER 413 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1mmv h SER 413 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1mmv h SER 413 CO 1.22 0.00 -0.07 0.54 -0.87 0.00 0.00 176.83 177.65 1mmv n ARG 414 N -2.62 1.92 -3.32 4.77 1.74 -1.26 0.27 116.66 118.16 1mmv n ARG 414 Ca -0.02 -1.46 -0.39 0.00 -0.77 0.00 0.00 57.85 55.21 1mmv n ARG 414 Cb 0.26 -1.47 -0.08 0.00 -1.02 0.00 0.00 32.46 30.16 1mmv n ARG 414 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mmv n VAL 416 N 4.81 0.25 -1.22 0.00 3.14 -1.26 -3.99 118.33 120.06 1mmv n VAL 416 Ca -0.06 -0.14 -0.15 0.00 -2.96 0.00 0.00 64.34 61.03 1mmv n VAL 416 Cb 0.50 -0.31 0.22 0.00 -1.06 0.00 0.00 33.84 33.19 1mmv n VAL 416 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1mmv n GLY 417 N 1.41 4.35 0.00 7.55 0.00 -1.26 -4.33 105.19 112.91 1mmv n GLY 417 Ca 0.06 -1.09 0.08 0.00 0.00 0.00 0.00 46.02 45.07 1mmv n GLY 417 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mmv n ARG 418 N -0.87 0.35 0.27 1.61 1.74 -1.26 -2.64 116.66 115.85 1mmv n ARG 418 Ca 0.49 0.08 0.18 0.00 -0.77 0.00 0.00 57.85 57.83 1mmv n ARG 418 Cb 1.46 -1.50 0.87 0.00 -1.02 0.00 0.00 32.46 32.26 1mmv n ARG 418 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1mmv h ILE 419 N 0.00 0.00 -0.07 0.55 2.10 -1.89 -0.34 117.51 117.86 1mmv h ILE 419 Ca 0.00 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.72 1mmv h ILE 419 Cb 0.10 1.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.96 1mmv h ILE 419 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.07 1mmv n GLN 420 N -2.89 1.87 -0.31 2.19 1.13 -1.08 -4.66 117.38 113.64 1mmv n GLN 420 Ca -0.01 -1.27 0.15 0.00 -1.94 0.00 0.00 57.00 53.93 1mmv n GLN 420 Cb 0.17 -1.46 0.32 0.00 0.11 0.00 0.00 30.24 29.38 1mmv n GLN 420 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 1mmv h TRP 421 N 2.94 0.48 0.00 1.08 5.08 -1.25 -0.83 115.95 123.44 1mmv h TRP 421 Ca 0.00 0.05 0.00 0.00 1.08 0.00 0.00 58.89 60.02 1mmv h TRP 421 Cb 0.63 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 1mmv h TRP 421 CO 0.04 -0.19 0.00 0.66 -1.28 0.00 0.00 178.44 177.67 1mmv h SER 422 N 0.25 0.00 -3.41 0.11 4.64 -1.84 -3.36 113.55 109.94 1mmv h SER 422 Ca 0.58 0.00 -0.79 0.00 -0.47 0.00 0.00 61.79 61.11 1mmv h SER 422 Cb 1.20 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.02 1mmv h SER 422 CO -0.63 0.00 0.55 0.29 -0.87 0.00 0.00 176.83 176.17 1mmv n LYS 423 N -2.48 3.55 -3.82 4.77 5.02 -0.32 -4.96 118.16 119.93 1mmv n LYS 423 Ca 0.02 -4.40 -0.23 0.00 -2.02 0.00 0.00 58.31 51.68 1mmv n LYS 423 Cb 0.30 -2.60 -0.17 0.00 -0.02 0.00 0.00 35.03 32.54 1mmv n LYS 423 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1mmv s LEU 424 N -1.07 0.73 -0.19 -0.35 2.96 -1.26 -4.62 118.68 114.89 1mmv s LEU 424 Ca 0.32 -0.12 -0.28 0.00 -0.22 0.00 0.00 54.13 53.84 1mmv s LEU 424 Cb -0.09 -0.50 -0.00 0.00 0.50 0.00 0.00 46.19 46.10 1mmv s LEU 424 CO -0.07 -0.17 0.95 -1.58 -1.32 0.00 0.00 176.35 174.16 1mmv s GLN 425 N 1.85 4.29 -0.19 1.98 2.00 -0.92 -4.96 119.66 123.71 1mmv s GLN 425 Ca 0.04 1.22 -0.07 0.00 -2.00 0.00 0.00 55.36 54.55 1mmv s GLN 425 Cb -0.12 -3.60 -0.04 0.00 0.80 0.00 0.00 33.01 30.04 1mmv s GLN 425 CO -0.05 -0.47 0.05 0.08 -0.50 0.00 0.00 175.29 174.40 1mmv s VAL 426 N 2.63 4.64 -0.29 1.34 1.01 -1.26 -1.38 120.40 127.08 1mmv s VAL 426 Ca 0.42 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.27 1mmv s VAL 426 Cb -0.16 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.15 1mmv s VAL 426 CO 0.10 0.45 0.04 -0.36 0.00 0.00 0.00 175.10 175.33 1mmv s PHE 427 N 0.52 3.16 -0.57 5.22 0.08 0.50 -4.97 117.98 121.91 1mmv s PHE 427 Ca 0.02 -1.31 -0.28 0.00 0.12 0.00 0.00 56.93 55.48 1mmv s PHE 427 Cb -0.13 -2.19 0.03 0.00 -0.57 0.00 0.00 43.02 40.16 1mmv s PHE 427 CO 0.01 -0.67 1.24 0.34 -0.10 0.00 0.00 175.22 176.05 1mmv s ASP 428 N 1.41 6.38 -0.28 1.36 -1.08 -1.26 -1.30 116.67 121.89 1mmv s ASP 428 Ca 0.00 0.16 0.09 0.00 -0.52 0.00 0.00 52.55 52.29 1mmv s ASP 428 Cb -0.18 -2.55 0.51 0.00 -1.46 0.00 0.00 42.92 39.24 1mmv s ASP 428 CO 0.00 -1.53 1.46 0.00 0.52 0.00 0.00 175.17 175.62 1mmv n ALA 429 N 8.69 4.24 0.69 3.66 0.00 0.56 -4.65 120.51 133.69 1mmv n ALA 429 Ca 0.09 -3.11 0.08 0.00 0.00 0.00 0.00 53.44 50.50 1mmv n ALA 429 Cb 0.49 -0.73 0.39 0.00 0.00 0.00 0.00 19.45 19.60 1mmv n ALA 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mmv n ARG 430 N -1.10 0.13 -0.06 0.00 1.74 -1.07 -1.98 116.66 114.32 1mmv n ARG 430 Ca 0.32 0.17 0.12 0.00 -0.77 0.00 0.00 57.85 57.69 1mmv n ARG 430 Cb 1.02 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 31.31 1mmv n ARG 430 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1mmv n ASP 431 N -1.38 2.12 -4.78 0.55 5.75 -1.26 -4.51 116.55 113.04 1mmv n ASP 431 Ca 0.06 -1.74 -0.36 0.00 -0.01 0.00 0.00 54.79 52.74 1mmv n ASP 431 Cb 0.16 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.13 1mmv n ASP 431 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mmv n THR 433 N -0.25 0.00 -4.23 0.00 -2.24 -1.26 -4.77 114.28 101.52 1mmv n THR 433 Ca 0.06 -0.04 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 1mmv n THR 433 Cb 0.49 0.36 -0.10 0.00 -2.10 0.00 0.00 70.33 68.99 1mmv n THR 433 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1mmv s THR 434 N -0.47 0.71 0.31 4.28 -4.23 -1.26 -4.62 115.64 110.35 1mmv s THR 434 Ca 0.00 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.52 1mmv s THR 434 Cb 0.00 -2.06 0.27 0.00 1.34 0.00 0.00 72.50 72.05 1mmv s THR 434 CO 0.00 -0.54 1.96 0.00 -0.54 0.00 0.00 174.62 175.50 1mmv h ALA 435 N 2.73 1.47 -0.63 3.99 0.00 -1.90 -0.38 119.26 124.53 1mmv h ALA 435 Ca -0.37 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 1mmv h ALA 435 Cb 1.20 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1mmv h ALA 435 CO 0.63 0.46 0.14 0.45 0.00 0.00 0.00 179.25 180.93 1mmv h HIS 436 N 1.06 1.06 -0.82 0.00 3.86 -1.96 0.48 115.15 118.83 1mmv h HIS 436 Ca 0.32 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.37 1mmv h HIS 436 Cb -0.01 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 28.12 1mmv h HIS 436 CO -0.00 0.88 0.35 0.78 0.86 0.00 0.00 177.93 180.79 1mmv h GLY 437 N 1.04 1.29 1.00 2.45 0.00 -1.64 -0.88 103.07 106.34 1mmv h GLY 437 Ca 0.20 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 1mmv h GLY 437 CO 0.00 0.65 0.30 -0.33 0.00 0.00 0.00 176.54 177.16 1mmv h MET 438 N 1.18 0.95 -0.37 4.80 0.00 -0.39 -0.95 114.93 120.14 1mmv h MET 438 Ca 0.28 -0.15 -0.00 0.00 0.00 0.00 0.00 59.70 59.83 1mmv h MET 438 Cb 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 31.60 31.60 1mmv h MET 438 CO -0.03 0.76 0.23 0.35 0.00 0.00 0.00 176.91 178.23 1mmv h PHE 439 N 0.90 0.49 -0.31 -0.22 3.04 -0.37 0.10 116.94 120.56 1mmv h PHE 439 Ca 0.22 0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.18 1mmv h PHE 439 Cb 0.14 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 1mmv h PHE 439 CO 0.01 0.34 0.20 -0.97 -2.02 0.00 0.00 178.31 175.86 1mmv h ASN 440 N 0.49 0.33 -0.78 0.41 -1.24 -0.79 -0.24 115.58 113.77 1mmv h ASN 440 Ca 0.14 -0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.14 1mmv h ASN 440 Cb -0.01 -0.08 -0.04 0.00 0.73 0.00 0.00 38.32 38.92 1mmv h ASN 440 CO -0.03 0.24 0.48 1.88 -1.29 0.00 0.00 177.43 178.72 1mmv h TYR 441 N 0.40 1.02 -0.47 0.67 -1.99 -0.92 -2.09 116.97 113.60 1mmv h TYR 441 Ca 0.12 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.76 1mmv h TYR 441 Cb -0.03 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.35 1mmv h TYR 441 CO -0.06 0.68 -0.05 0.82 -0.00 0.00 0.00 178.16 179.54 1mmv h ILE 442 N 1.07 1.27 -0.57 -2.88 2.04 -0.55 -0.89 117.51 117.00 1mmv h ILE 442 Ca 0.28 -1.15 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 1mmv h ILE 442 Cb -0.06 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1mmv h ILE 442 CO -0.05 0.40 0.28 0.00 0.00 0.00 0.00 178.15 178.77 1mmv h ASN 444 N 0.77 1.07 0.19 0.00 2.35 -1.20 -0.55 115.58 118.20 1mmv h ASN 444 Ca 0.20 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1mmv h ASN 444 Cb 0.12 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.22 1mmv h ASN 444 CO -0.02 0.84 -0.09 -0.74 -1.65 0.00 0.00 177.43 175.77 1mmv h HIS 445 N 1.21 -0.23 -0.48 1.19 2.76 -0.52 -1.23 115.15 117.85 1mmv h HIS 445 Ca 0.31 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.56 1mmv h HIS 445 Cb -0.00 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 28.96 1mmv h HIS 445 CO 0.01 0.00 0.08 0.28 -1.30 0.00 0.00 177.93 177.00 1mmv h VAL 446 N -0.43 0.72 -0.55 5.26 2.07 -0.45 -0.14 116.25 122.73 1mmv h VAL 446 Ca -0.03 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1mmv h VAL 446 Cb 0.33 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1mmv h VAL 446 CO 0.04 0.04 0.19 0.50 0.02 0.00 0.00 177.57 178.36 1mmv h LYS 447 N 0.21 0.84 -0.36 1.57 3.64 -1.03 -0.03 116.57 121.42 1mmv h LYS 447 Ca 0.24 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1mmv h LYS 447 Cb 0.32 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1mmv h LYS 447 CO -0.33 0.76 0.09 -0.92 -2.27 0.00 0.00 179.45 176.78 1mmv h TYR 448 N 0.76 0.60 -0.36 1.91 3.20 -0.77 -2.62 116.97 119.69 1mmv h TYR 448 Ca 0.18 -0.07 -0.14 0.00 3.14 0.00 0.00 58.73 61.84 1mmv h TYR 448 Cb 0.26 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1mmv h TYR 448 CO 0.01 0.59 -0.33 0.00 -1.64 0.00 0.00 178.16 176.79 1mmv h ALA 449 N 0.93 0.52 -0.61 1.82 0.00 -0.94 -3.22 119.26 117.76 1mmv h ALA 449 Ca 0.11 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1mmv h ALA 449 Cb 0.29 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1mmv h ALA 449 CO 0.00 0.58 0.31 1.15 0.00 0.00 0.00 179.25 181.30 1mmv h THR 450 N 0.65 1.21 -6.97 0.00 2.02 -1.00 0.76 112.91 109.58 1mmv h THR 450 Ca 0.06 -0.55 -0.59 0.00 0.77 0.00 0.00 66.41 66.10 1mmv h THR 450 Cb 0.92 0.45 -0.24 0.00 -1.74 0.00 0.00 68.15 67.54 1mmv h THR 450 CO 0.08 0.23 -0.91 -3.20 0.37 0.00 0.00 175.52 172.09 1mmv n ASN 451 N -4.54 -0.82 -1.92 4.18 4.05 -0.99 0.17 115.26 115.38 1mmv n ASN 451 Ca 0.04 -1.18 -0.18 0.00 0.45 0.00 0.00 54.58 53.71 1mmv n ASN 451 Cb 0.11 -2.04 -0.05 0.00 1.23 0.00 0.00 39.78 39.03 1mmv n ASN 451 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1mmv n LYS 452 N -4.37 -1.60 0.00 1.20 5.02 -1.26 -1.90 118.16 115.25 1mmv n LYS 452 Ca -0.12 1.00 0.00 0.00 -2.02 0.00 0.00 58.31 57.17 1mmv n LYS 452 Cb 0.59 -5.48 0.00 0.00 -0.02 0.00 0.00 35.03 30.12 1mmv n LYS 452 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mmv n GLY 453 N -0.61 2.28 3.00 0.72 0.00 0.13 -4.92 105.19 105.78 1mmv n GLY 453 Ca -0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1mmv n GLY 453 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mmv n ASN 454 N 0.00 5.49 -4.58 1.61 4.05 -0.80 -0.47 115.26 120.55 1mmv n ASN 454 Ca 0.00 -3.17 -0.45 0.00 0.45 0.00 0.00 54.58 51.40 1mmv n ASN 454 Cb 0.00 -1.43 -0.02 0.00 1.23 0.00 0.00 39.78 39.56 1mmv n ASN 454 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1mmv n LEU 455 N 3.33 1.65 -3.95 1.20 4.77 -1.23 -4.47 117.00 118.30 1mmv n LEU 455 Ca 0.35 1.17 -0.23 0.00 -0.03 0.00 0.00 56.01 57.27 1mmv n LEU 455 Cb 0.36 -1.27 -0.17 0.00 -2.33 0.00 0.00 43.42 40.02 1mmv n LEU 455 CO 0.75 -1.43 -0.44 -0.13 -1.33 0.00 0.00 177.39 174.81 1mmv s ARG 456 N -1.33 1.34 0.44 3.23 0.52 0.26 -5.01 118.95 118.41 1mmv s ARG 456 Ca 0.61 -0.27 -0.25 0.00 -0.52 0.00 0.00 55.73 55.30 1mmv s ARG 456 Cb -0.73 -1.23 -0.08 0.00 0.52 0.00 0.00 34.95 33.43 1mmv s ARG 456 CO 0.58 -0.07 1.36 -1.12 0.02 0.00 0.00 175.30 176.08 1mmv s SER 457 N 0.96 5.99 0.14 0.23 0.01 -1.26 -4.35 113.70 115.42 1mmv s SER 457 Ca -0.10 2.78 -0.25 0.00 1.31 0.00 0.00 55.95 59.70 1mmv s SER 457 Cb -0.15 -2.64 0.07 0.00 0.21 0.00 0.00 66.02 63.51 1mmv s SER 457 CO 0.00 -1.08 0.75 0.00 0.41 0.00 0.00 173.24 173.33 1mmv s ALA 458 N -1.25 -1.60 -0.05 1.44 0.00 -0.77 -2.17 121.76 117.37 1mmv s ALA 458 Ca 0.61 0.44 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 1mmv s ALA 458 Cb -0.41 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.44 1mmv s ALA 458 CO 0.52 -0.84 0.18 -1.50 0.00 0.00 0.00 175.76 174.12 1mmv s ILE 459 N -3.54 0.02 -0.17 0.00 2.07 -0.48 -0.34 121.20 118.78 1mmv s ILE 459 Ca 0.06 -0.20 0.01 0.00 -1.41 0.00 0.00 60.65 59.10 1mmv s ILE 459 Cb -0.02 -0.32 0.01 0.00 0.13 0.00 0.00 42.46 42.26 1mmv s ILE 459 CO -0.06 -0.11 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.79 1mmv s THR 460 N -0.34 2.34 -0.30 4.00 2.01 -0.35 -0.37 115.64 122.62 1mmv s THR 460 Ca -0.04 -0.87 -0.06 0.00 0.31 0.00 0.00 61.69 61.02 1mmv s THR 460 Cb -0.03 -1.98 0.02 0.00 0.01 0.00 0.00 72.50 70.52 1mmv s THR 460 CO 0.01 0.53 0.08 -0.63 -0.69 0.00 0.00 174.62 173.91 1mmv s ILE 461 N 1.04 3.88 0.73 1.82 1.01 -0.42 -3.25 121.20 126.01 1mmv s ILE 461 Ca -0.01 -0.79 -0.05 0.00 0.00 0.00 0.00 60.65 59.80 1mmv s ILE 461 Cb -0.14 -3.04 0.10 0.00 0.01 0.00 0.00 42.46 39.39 1mmv s ILE 461 CO -0.05 0.04 1.02 -0.36 0.00 0.00 0.00 174.94 175.59 1mmv s PHE 462 N 1.47 2.24 0.28 3.97 0.08 -0.97 -0.32 117.98 124.73 1mmv s PHE 462 Ca 0.02 0.11 -0.29 0.00 0.12 0.00 0.00 56.93 56.89 1mmv s PHE 462 Cb -0.18 -3.21 -0.14 0.00 -0.57 0.00 0.00 43.02 38.93 1mmv s PHE 462 CO 0.02 -1.63 1.08 -2.30 -0.10 0.00 0.00 175.22 172.30 1mmv n PRO 463 N -2.94 1.47 -1.75 0.24 -0.02 -1.25 -4.66 135.00 126.08 1mmv n PRO 463 Ca 0.12 0.52 -0.32 0.00 -2.02 0.00 0.00 63.50 61.79 1mmv n PRO 463 Cb 0.60 -1.94 0.04 0.00 -0.02 0.00 0.00 33.50 32.18 1mmv n PRO 463 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1mmv s GLN 464 N -1.40 2.89 0.53 -0.52 -2.07 -1.26 -4.57 119.66 113.25 1mmv s GLN 464 Ca 0.60 1.27 -0.22 0.00 -1.82 0.00 0.00 55.36 55.19 1mmv s GLN 464 Cb -0.70 -1.97 -0.05 0.00 -1.09 0.00 0.00 33.01 29.20 1mmv s GLN 464 CO 0.59 -1.17 1.36 0.50 -1.32 0.00 0.00 175.29 175.26 1mmv s ARG 465 N -4.28 3.24 0.00 9.60 3.52 0.83 -4.95 118.95 126.91 1mmv s ARG 465 Ca 0.64 2.25 0.00 0.00 -0.13 0.00 0.00 55.73 58.49 1mmv s ARG 465 Cb -0.18 -2.32 0.00 0.00 -1.56 0.00 0.00 34.95 30.89 1mmv s ARG 465 CO 0.43 -1.12 0.00 0.25 -0.81 0.00 0.00 175.30 174.05 1mmv n THR 466 N -0.89 0.00 -0.33 4.11 -2.24 -1.26 -4.79 114.28 108.88 1mmv n THR 466 Ca 0.09 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.95 1mmv n THR 466 Cb 0.45 -0.56 0.22 0.00 -2.10 0.00 0.00 70.33 68.33 1mmv n THR 466 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1mmv n ASP 467 N -1.07 3.40 0.00 3.42 5.75 -1.26 -4.93 116.55 121.86 1mmv n ASP 467 Ca 0.00 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.66 1mmv n ASP 467 Cb 0.00 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 1mmv n ASP 467 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mmv n GLY 468 N 0.74 1.85 0.81 6.12 0.00 -1.26 -4.76 105.19 108.68 1mmv n GLY 468 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1mmv n GLY 468 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mmv n LYS 469 N -2.00 2.07 -2.11 1.61 5.02 -1.26 -4.40 118.16 117.08 1mmv n LYS 469 Ca 0.00 -1.91 -0.03 0.00 -2.02 0.00 0.00 58.31 54.35 1mmv n LYS 469 Cb 0.00 -1.36 0.05 0.00 -0.02 0.00 0.00 35.03 33.70 1mmv n LYS 469 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1mmv n HIS 470 N 0.97 1.12 -2.45 2.13 8.25 -1.26 -4.27 115.22 119.71 1mmv n HIS 470 Ca 0.13 -1.69 -0.40 0.00 -0.26 0.00 0.00 57.72 55.50 1mmv n HIS 470 Cb 0.46 -0.23 -0.04 0.00 1.12 0.00 0.00 29.99 31.30 1mmv n HIS 470 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1mmv s ASP 471 N -3.27 7.20 -0.00 0.41 1.11 -1.26 -3.79 116.67 117.07 1mmv s ASP 471 Ca 0.35 2.29 -0.16 0.00 0.18 0.00 0.00 52.55 55.21 1mmv s ASP 471 Cb 0.36 -2.63 -0.06 0.00 1.07 0.00 0.00 42.92 41.67 1mmv s ASP 471 CO -0.06 -0.19 0.44 -0.36 1.18 0.00 0.00 175.17 176.18 1mmv s PHE 472 N -1.19 3.72 -0.08 4.23 0.40 -1.26 -2.02 117.98 121.78 1mmv s PHE 472 Ca 0.46 1.02 -0.12 0.00 -0.60 0.00 0.00 56.93 57.69 1mmv s PHE 472 Cb -0.32 -2.35 0.03 0.00 0.51 0.00 0.00 43.02 40.89 1mmv s PHE 472 CO 0.41 0.59 0.30 1.03 0.70 0.00 0.00 175.22 178.25 1mmv s ARG 473 N -0.90 0.48 -0.30 0.44 1.81 0.23 -2.99 118.95 117.71 1mmv s ARG 473 Ca 0.25 0.17 -0.09 0.00 -1.72 0.00 0.00 55.73 54.34 1mmv s ARG 473 Cb -0.17 0.22 -0.00 0.00 -0.45 0.00 0.00 34.95 34.55 1mmv s ARG 473 CO 0.14 -0.10 0.13 0.08 -0.68 0.00 0.00 175.30 174.87 1mmv s VAL 474 N -0.43 4.39 0.18 3.52 1.01 -1.26 -0.54 120.40 127.26 1mmv s VAL 474 Ca -0.06 -0.50 0.27 0.00 0.00 0.00 0.00 61.98 61.69 1mmv s VAL 474 Cb -0.04 -3.24 0.27 0.00 0.00 0.00 0.00 36.38 33.38 1mmv s VAL 474 CO 0.02 0.08 1.90 -0.50 0.00 0.00 0.00 175.10 176.60 1mmv h TRP 475 N 8.31 0.00 -4.27 5.22 4.06 -1.49 -3.42 115.95 124.36 1mmv h TRP 475 Ca -0.32 0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.11 1mmv h TRP 475 Cb 1.14 0.00 0.13 0.00 -1.00 0.00 0.00 29.16 29.43 1mmv h TRP 475 CO 0.63 0.16 0.33 -0.80 -3.56 0.00 0.00 178.44 175.21 1mmv s ASN 476 N -6.08 4.53 -0.02 -3.49 -0.87 -1.26 -4.93 114.94 102.82 1mmv s ASN 476 Ca 0.00 1.93 0.09 0.00 -1.57 0.00 0.00 52.86 53.31 1mmv s ASN 476 Cb 0.10 -2.54 -0.23 0.00 -0.02 0.00 0.00 41.25 38.57 1mmv s ASN 476 CO 0.61 -2.02 0.75 0.77 -2.57 0.00 0.00 177.10 174.64 1mmv h SER 477 N -0.82 0.05 -4.84 -1.22 4.64 -1.91 -3.33 113.55 106.12 1mmv h SER 477 Ca -0.45 -0.10 -0.23 0.00 -0.47 0.00 0.00 61.79 60.54 1mmv h SER 477 Cb 1.24 -0.02 -0.20 0.00 -0.31 0.00 0.00 62.40 63.11 1mmv h SER 477 CO 0.51 1.09 -0.72 -1.10 -0.87 0.00 0.00 176.83 175.74 1mmv s GLN 478 N -2.61 0.50 0.22 4.77 -0.21 -1.26 -0.85 119.66 120.22 1mmv s GLN 478 Ca -0.05 -0.80 -0.08 0.00 0.02 0.00 0.00 55.36 54.45 1mmv s GLN 478 Cb 0.08 -0.14 0.19 0.00 1.00 0.00 0.00 33.01 34.13 1mmv s GLN 478 CO 0.82 0.01 1.86 -0.07 -2.12 0.00 0.00 175.29 175.79 1mmv h LEU 479 N 4.32 1.02 -8.03 2.90 3.38 -1.23 -3.39 115.31 114.28 1mmv h LEU 479 Ca -0.35 -0.08 -0.67 0.00 0.09 0.00 0.00 57.88 56.88 1mmv h LEU 479 Cb 1.20 -0.26 -0.35 0.00 0.09 0.00 0.00 40.66 41.34 1mmv h LEU 479 CO 0.44 0.80 -0.83 -0.63 0.09 0.00 0.00 178.44 178.31 1mmv s ILE 480 N -5.93 2.17 0.03 1.22 1.01 -1.26 -4.86 121.20 113.58 1mmv s ILE 480 Ca -0.13 -1.10 -0.20 0.00 0.00 0.00 0.00 60.65 59.21 1mmv s ILE 480 Cb 0.16 -2.02 0.04 0.00 0.01 0.00 0.00 42.46 40.66 1mmv s ILE 480 CO 0.81 0.38 0.46 -0.13 0.00 0.00 0.00 174.94 176.46 1mmv s ARG 481 N 1.25 0.94 0.19 2.79 0.52 -1.26 -4.84 118.95 118.54 1mmv s ARG 481 Ca 0.01 -0.24 -0.17 0.00 -0.52 0.00 0.00 55.73 54.82 1mmv s ARG 481 Cb -0.15 0.42 -0.08 0.00 0.52 0.00 0.00 34.95 35.67 1mmv s ARG 481 CO -0.10 -0.32 0.65 0.71 0.02 0.00 0.00 175.30 176.26 1mmv s TYR 482 N -2.18 3.62 0.68 -0.53 4.12 -1.26 -0.59 117.35 121.20 1mmv s TYR 482 Ca -0.07 1.23 -0.11 0.00 0.02 0.00 0.00 57.07 58.15 1mmv s TYR 482 Cb -0.01 -2.50 -0.00 0.00 -1.52 0.00 0.00 41.96 37.92 1mmv s TYR 482 CO 0.00 0.37 1.06 0.00 0.02 0.00 0.00 175.55 177.00 1mmv s ALA 483 N -1.51 2.80 -0.02 3.71 0.00 -0.02 -4.51 121.76 122.19 1mmv s ALA 483 Ca 0.41 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.34 1mmv s ALA 483 Cb -0.16 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 19.86 1mmv s ALA 483 CO 0.20 -1.08 -0.01 0.20 0.00 0.00 0.00 175.76 175.07 1mmv s GLY 484 N -3.98 0.24 0.04 0.00 0.00 -1.23 -1.83 107.32 100.56 1mmv s GLY 484 Ca 0.57 0.09 0.06 0.00 0.00 0.00 0.00 44.72 45.44 1mmv s GLY 484 CO 0.54 0.43 -0.16 -0.19 0.00 0.00 0.00 173.10 173.72 1mmv s TYR 485 N 0.77 1.43 -0.15 1.90 1.51 0.09 -4.00 117.35 118.91 1mmv s TYR 485 Ca -0.08 -0.36 -0.25 0.00 -1.01 0.00 0.00 57.07 55.36 1mmv s TYR 485 Cb -0.11 -0.85 -0.02 0.00 -0.11 0.00 0.00 41.96 40.87 1mmv s TYR 485 CO -0.01 0.06 0.83 0.15 -1.11 0.00 0.00 175.55 175.47 1mmv s LYS 486 N -1.17 4.33 0.51 -0.62 1.02 -1.26 -0.27 119.74 122.28 1mmv s LYS 486 Ca 0.04 1.03 0.04 0.00 0.02 0.00 0.00 55.97 57.10 1mmv s LYS 486 Cb -0.08 -3.55 0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1mmv s LYS 486 CO 0.01 -0.27 0.71 -0.65 -0.92 0.00 0.00 175.35 174.24 1mmv s GLN 487 N 1.93 2.58 0.14 1.68 -0.21 -0.43 -4.95 119.66 120.40 1mmv s GLN 487 Ca 0.39 -1.02 -0.18 0.00 0.02 0.00 0.00 55.36 54.57 1mmv s GLN 487 Cb -0.17 -2.59 -0.02 0.00 1.00 0.00 0.00 33.01 31.23 1mmv s GLN 487 CO 0.14 -0.60 1.79 -1.35 -2.12 0.00 0.00 175.29 173.15 1mmv h PRO 488 N 0.25 0.38 -0.75 2.91 0.11 -1.97 -1.69 132.00 131.24 1mmv h PRO 488 Ca -0.40 -0.02 0.22 0.00 0.11 0.00 0.00 66.00 65.90 1mmv h PRO 488 Cb 1.29 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1mmv h PRO 488 CO 0.48 0.25 0.81 0.22 -0.21 0.00 0.00 178.00 179.55 1mmv h ASP 489 N 0.39 0.00 0.00 -2.05 1.82 -2.03 -3.43 116.42 111.12 1mmv h ASP 489 Ca 0.11 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 1mmv h ASP 489 Cb -0.03 0.00 0.00 0.00 0.68 0.00 0.00 39.33 39.98 1mmv h ASP 489 CO -0.03 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.21 1mmv n GLY 490 N -1.61 0.94 3.83 -0.78 0.00 -0.63 -5.06 105.19 101.88 1mmv n GLY 490 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1mmv n GLY 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mmv s SER 491 N -1.80 2.39 -0.04 1.61 1.04 -1.26 -4.76 113.70 110.87 1mmv s SER 491 Ca 0.00 0.34 0.07 0.00 0.48 0.00 0.00 55.95 56.84 1mmv s SER 491 Cb 0.00 -0.41 -0.01 0.00 0.10 0.00 0.00 66.02 65.69 1mmv s SER 491 CO 0.00 -3.19 -0.25 -0.89 0.98 0.00 0.00 173.24 169.89 1mmv s THR 492 N -3.65 1.98 -0.20 2.02 2.01 -1.26 -1.32 115.64 115.22 1mmv s THR 492 Ca 0.74 -1.05 -0.08 0.00 0.31 0.00 0.00 61.69 61.61 1mmv s THR 492 Cb -0.05 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 1mmv s THR 492 CO 0.54 0.56 0.08 -0.22 -0.69 0.00 0.00 174.62 174.88 1mmv s LEU 493 N -0.34 3.80 0.00 4.42 0.20 0.63 -4.95 118.68 122.45 1mmv s LEU 493 Ca 0.02 0.04 0.00 0.00 0.69 0.00 0.00 54.13 54.88 1mmv s LEU 493 Cb -0.12 -1.98 0.00 0.00 -0.43 0.00 0.00 46.19 43.66 1mmv s LEU 493 CO 0.02 0.12 0.00 0.61 -0.29 0.00 0.00 176.35 176.81 1mmv n GLY 494 N 3.88 0.08 3.54 7.98 0.00 -1.26 -0.73 105.19 118.68 1mmv n GLY 494 Ca -0.16 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 1mmv n GLY 494 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mmv s ASP 495 N -4.00 6.39 0.58 1.61 -1.08 -0.76 -4.76 116.67 114.65 1mmv s ASP 495 Ca 0.00 -0.10 0.28 0.00 -0.52 0.00 0.00 52.55 52.21 1mmv s ASP 495 Cb 0.00 -2.35 1.69 0.00 -1.46 0.00 0.00 42.92 40.80 1mmv s ASP 495 CO 0.00 -0.78 2.18 -0.65 0.52 0.00 0.00 175.17 176.44 1mmv h PRO 496 N 8.78 0.00 0.00 4.34 0.11 -1.84 -2.18 132.00 141.22 1mmv h PRO 496 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1mmv h PRO 496 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1mmv h PRO 496 CO 0.90 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.69 1mmv h ALA 497 N 1.91 1.00 -0.23 -0.75 0.00 -1.92 -2.92 119.26 116.34 1mmv h ALA 497 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1mmv h ALA 497 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1mmv h ALA 497 CO -0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1mmv n ASN 498 N -3.04 3.03 -0.08 0.00 3.02 -0.82 -4.74 115.26 112.63 1mmv n ASN 498 Ca -0.01 -2.45 -0.07 0.00 -0.03 0.00 0.00 54.58 52.02 1mmv n ASN 498 Cb 0.20 -0.32 -0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1mmv n ASN 498 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1mmv h VAL 499 N 1.41 0.47 -0.61 2.41 2.07 -1.59 0.30 116.25 120.71 1mmv h VAL 499 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1mmv h VAL 499 Cb 0.96 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1mmv h VAL 499 CO 0.07 0.00 0.36 -0.61 0.02 0.00 0.00 177.57 177.41 1mmv h GLN 500 N -0.15 0.83 -0.39 1.57 4.15 -1.85 -2.00 115.11 117.28 1mmv h GLN 500 Ca 0.16 -0.08 -0.14 0.00 0.77 0.00 0.00 58.65 59.36 1mmv h GLN 500 Cb 0.40 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1mmv h GLN 500 CO -0.41 0.61 -0.32 0.35 -1.93 0.00 0.00 178.83 177.14 1mmv h PHE 501 N 0.82 1.06 -0.03 3.99 3.57 -1.79 -2.43 116.94 122.14 1mmv h PHE 501 Ca 0.22 -0.30 0.01 0.00 3.53 0.00 0.00 57.97 61.42 1mmv h PHE 501 Cb 0.00 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.51 1mmv h PHE 501 CO -0.02 1.11 0.04 1.15 -2.23 0.00 0.00 178.31 178.36 1mmv h THR 502 N 0.71 0.60 0.23 4.41 2.02 -0.15 -1.72 112.91 119.00 1mmv h THR 502 Ca 0.07 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.91 1mmv h THR 502 Cb 0.90 0.97 0.03 0.00 -1.74 0.00 0.00 68.15 68.31 1mmv h THR 502 CO 0.08 0.00 -1.57 -0.33 0.37 0.00 0.00 175.52 174.07 1mmv h GLU 503 N 0.00 0.48 0.00 6.66 5.08 -1.05 -3.13 114.58 122.62 1mmv h GLU 503 Ca 0.02 -0.83 -0.02 0.00 -1.00 0.00 0.00 59.36 57.53 1mmv h GLU 503 Cb 0.09 0.31 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1mmv h GLU 503 CO -0.00 1.39 -0.11 0.82 -1.00 0.00 0.00 179.01 180.11 1mmv h ILE 504 N 0.13 0.52 -0.12 3.13 2.04 -0.86 0.84 117.51 123.20 1mmv h ILE 504 Ca -0.28 -0.53 -0.19 0.00 1.00 0.00 0.00 64.86 64.86 1mmv h ILE 504 Cb 2.14 1.35 0.01 0.00 -0.74 0.00 0.00 36.82 39.58 1mmv h ILE 504 CO 0.24 0.11 -0.68 0.00 0.00 0.00 0.00 178.15 177.83 1mmv h ILE 506 N 0.33 1.18 0.00 0.00 2.04 -1.23 0.21 117.51 120.05 1mmv h ILE 506 Ca -0.05 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1mmv h ILE 506 Cb 1.32 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 1mmv h ILE 506 CO 0.14 0.20 0.06 1.67 0.00 0.00 0.00 178.15 180.22 1mmv n GLN 507 N -4.95 0.00 -0.00 2.37 7.27 0.28 -0.38 117.38 121.97 1mmv n GLN 507 Ca -0.08 0.42 0.04 0.00 0.07 0.00 0.00 57.00 57.44 1mmv n GLN 507 Cb 0.21 -1.56 -0.05 0.00 2.41 0.00 0.00 30.24 31.26 1mmv n GLN 507 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 1mmv n GLN 508 N -1.42 3.05 0.00 3.69 -0.06 -0.73 -5.02 117.38 116.89 1mmv n GLN 508 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 57.00 54.98 1mmv n GLN 508 Cb 0.06 -0.96 0.00 0.00 -4.06 0.00 0.00 30.24 25.27 1mmv n GLN 508 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1mmv n GLY 509 N 1.49 2.65 3.40 1.69 0.00 0.49 -5.00 105.19 109.91 1mmv n GLY 509 Ca 0.00 -0.30 -0.44 0.00 0.00 0.00 0.00 46.02 45.28 1mmv n GLY 509 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1mmv n TRP 510 N 0.00 -0.75 -3.55 1.61 -0.00 0.51 -4.89 117.44 110.38 1mmv n TRP 510 Ca 0.00 0.76 -0.39 0.00 -0.00 0.00 0.00 57.50 57.87 1mmv n TRP 510 Cb 0.00 -1.95 -0.05 0.00 -0.00 0.00 0.00 31.31 29.31 1mmv n TRP 510 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1mmv s LYS 511 N -1.19 3.45 0.23 5.87 1.02 -1.26 -4.42 119.74 123.44 1mmv s LYS 511 Ca 0.62 -3.11 -0.32 0.00 0.02 0.00 0.00 55.97 53.19 1mmv s LYS 511 Cb -0.75 -4.12 -0.13 0.00 -0.52 0.00 0.00 37.83 32.31 1mmv s LYS 511 CO 0.59 -1.25 1.57 0.00 -0.92 0.00 0.00 175.35 175.34 1mmv n ALA 512 N 2.70 1.98 1.62 5.17 0.00 -1.26 -4.89 120.51 125.82 1mmv n ALA 512 Ca 0.20 0.41 0.15 0.00 0.00 0.00 0.00 53.44 54.19 1mmv n ALA 512 Cb 0.39 -2.40 0.82 0.00 0.00 0.00 0.00 19.45 18.25 1mmv n ALA 512 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1mmv n PRO 513 N 2.84 0.63 -3.69 0.00 -0.02 -1.26 -4.93 135.00 128.57 1mmv n PRO 513 Ca 0.13 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.40 1mmv n PRO 513 Cb 0.33 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.35 1mmv n PRO 513 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1mmv n ARG 514 N -1.18 -5.05 -3.81 -0.52 5.12 -1.26 -5.00 116.66 104.95 1mmv n ARG 514 Ca 0.18 0.64 -0.24 0.00 -1.93 0.00 0.00 57.85 56.49 1mmv n ARG 514 Cb 0.19 -5.23 -0.03 0.00 -1.16 0.00 0.00 32.46 26.23 1mmv n ARG 514 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1mmv s GLY 515 N -4.33 2.28 0.34 -0.13 0.00 -1.26 -5.03 107.32 99.18 1mmv s GLY 515 Ca 0.02 -1.65 0.18 0.00 0.00 0.00 0.00 44.72 43.27 1mmv s GLY 515 CO 0.81 -1.85 1.56 -0.09 0.00 0.00 0.00 173.10 173.53 1mmv h ARG 516 N 0.97 0.00 -2.02 2.90 2.43 -1.93 -3.38 114.38 113.35 1mmv h ARG 516 Ca -0.39 0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.25 1mmv h ARG 516 Cb 1.28 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 30.43 1mmv h ARG 516 CO 0.60 0.38 -1.12 1.19 -1.51 0.00 0.00 179.97 179.50 1mmv n PHE 517 N -3.26 0.17 -3.18 2.20 3.01 -1.26 -4.18 117.46 110.95 1mmv n PHE 517 Ca 0.02 -3.72 -0.41 0.00 1.01 0.00 0.00 57.45 54.35 1mmv n PHE 517 Cb 0.63 -0.40 -0.07 0.00 -0.01 0.00 0.00 39.48 39.64 1mmv n PHE 517 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1mmv s ASP 518 N -1.90 6.41 0.02 4.37 1.01 -1.26 -4.92 116.67 120.39 1mmv s ASP 518 Ca 0.38 0.22 -0.30 0.00 0.71 0.00 0.00 52.55 53.56 1mmv s ASP 518 Cb 0.26 -2.30 -0.08 0.00 1.01 0.00 0.00 42.92 41.81 1mmv s ASP 518 CO -0.09 -0.48 1.94 -0.69 0.21 0.00 0.00 175.17 176.06 1mmv s VAL 519 N 2.51 3.08 0.66 -1.27 1.01 -1.26 -0.84 120.40 124.29 1mmv s VAL 519 Ca 0.22 0.10 -0.16 0.00 0.00 0.00 0.00 61.98 62.14 1mmv s VAL 519 Cb -0.15 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1mmv s VAL 519 CO 0.13 -0.01 1.18 -0.76 0.00 0.00 0.00 175.10 175.63 1mmv s LEU 520 N 4.56 3.46 0.31 3.92 1.43 0.24 -4.90 118.68 127.69 1mmv s LEU 520 Ca 0.87 2.26 -0.17 0.00 -1.03 0.00 0.00 54.13 56.07 1mmv s LEU 520 Cb -0.41 -4.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.14 1mmv s LEU 520 CO 0.40 -1.85 0.75 -2.16 0.23 0.00 0.00 176.35 173.73 1mmv s PRO 521 N -3.75 4.09 0.38 1.29 0.04 -1.26 -4.78 135.00 131.01 1mmv s PRO 521 Ca 0.73 0.76 -0.25 0.00 0.04 0.00 0.00 61.00 62.28 1mmv s PRO 521 Cb -0.27 -2.53 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 1mmv s PRO 521 CO 0.40 0.20 1.12 -0.51 0.04 0.00 0.00 177.00 178.25 1mmv s LEU 522 N -2.73 4.23 -0.39 -3.56 1.43 0.17 -4.83 118.68 113.00 1mmv s LEU 522 Ca 0.52 2.24 0.03 0.00 -1.03 0.00 0.00 54.13 55.89 1mmv s LEU 522 Cb -0.12 -4.01 0.11 0.00 0.03 0.00 0.00 46.19 42.20 1mmv s LEU 522 CO 0.18 -0.54 0.13 -0.22 0.23 0.00 0.00 176.35 176.13 1mmv s LEU 523 N -2.39 3.89 -0.13 1.79 0.20 -1.26 -1.84 118.68 118.94 1mmv s LEU 523 Ca 0.55 -2.32 -0.07 0.00 0.69 0.00 0.00 54.13 52.98 1mmv s LEU 523 Cb -0.28 -1.40 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 1mmv s LEU 523 CO 0.36 -0.34 0.14 -0.76 -0.29 0.00 0.00 176.35 175.46 1mmv s LEU 524 N 0.69 4.36 -0.16 -0.68 1.43 -0.28 -1.20 118.68 122.85 1mmv s LEU 524 Ca 0.13 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.67 1mmv s LEU 524 Cb -0.21 -2.07 0.02 0.00 0.03 0.00 0.00 46.19 43.95 1mmv s LEU 524 CO -0.08 0.37 -0.19 -1.58 0.23 0.00 0.00 176.35 175.10 1mmv s GLN 525 N -0.81 2.79 -0.05 1.70 0.74 0.30 -0.52 119.66 123.81 1mmv s GLN 525 Ca 0.14 -0.76 0.05 0.00 0.05 0.00 0.00 55.36 54.85 1mmv s GLN 525 Cb -0.12 -2.38 -0.01 0.00 1.10 0.00 0.00 33.01 31.60 1mmv s GLN 525 CO 0.03 -0.15 -0.22 0.00 -0.55 0.00 0.00 175.29 174.40 1mmv s ALA 526 N 1.18 1.93 -1.35 1.58 0.00 -1.26 -0.60 121.76 123.24 1mmv s ALA 526 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1mmv s ALA 526 Cb -0.14 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.37 1mmv s ALA 526 CO -0.09 0.37 0.00 0.09 0.00 0.00 0.00 175.76 176.13 1mmv n ASN 527 N 3.02 -4.26 0.00 0.00 3.02 -1.25 -1.27 115.26 114.52 1mmv n ASN 527 Ca -0.18 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1mmv n ASN 527 Cb 0.52 -3.69 0.00 0.00 -0.61 0.00 0.00 39.78 36.00 1mmv n ASN 527 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mmv n GLY 528 N -0.67 1.98 3.48 7.41 0.00 -0.86 -4.30 105.19 112.23 1mmv n GLY 528 Ca -0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1mmv n GLY 528 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mmv s ASN 529 N -3.36 0.65 0.42 1.61 0.01 -0.40 -4.94 114.94 108.94 1mmv s ASN 529 Ca 0.00 1.13 -0.24 0.00 -0.71 0.00 0.00 52.86 53.04 1mmv s ASN 529 Cb 0.00 -1.72 -0.08 0.00 0.41 0.00 0.00 41.25 39.86 1mmv s ASN 529 CO 0.00 -4.35 1.10 -1.81 -1.51 0.00 0.00 177.10 170.53 1mmv s ASP 530 N -3.05 6.54 0.54 -1.22 -0.00 -1.26 -4.41 116.67 113.81 1mmv s ASP 530 Ca 0.68 2.15 -0.21 0.00 -0.00 0.00 0.00 52.55 55.17 1mmv s ASP 530 Cb -0.19 -2.59 -0.05 0.00 -0.00 0.00 0.00 42.92 40.09 1mmv s ASP 530 CO 0.60 -0.65 1.26 -2.16 -0.00 0.00 0.00 175.17 174.23 1mmv s PRO 531 N -2.55 3.25 0.11 8.23 0.04 -1.26 -4.74 135.00 138.08 1mmv s PRO 531 Ca 0.60 1.99 0.10 0.00 0.04 0.00 0.00 61.00 63.73 1mmv s PRO 531 Cb -0.25 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 1mmv s PRO 531 CO 0.31 -1.03 -0.26 -1.21 0.04 0.00 0.00 177.00 174.85 1mmv s GLU 532 N -2.98 1.54 0.34 4.56 2.02 0.32 -4.85 118.70 119.66 1mmv s GLU 532 Ca 0.71 -1.27 -0.06 0.00 0.02 0.00 0.00 54.97 54.37 1mmv s GLU 532 Cb -0.34 -1.95 -0.05 0.00 0.10 0.00 0.00 34.13 31.89 1mmv s GLU 532 CO 0.40 0.47 0.64 -0.51 0.02 0.00 0.00 175.26 176.28 1mmv s LEU 533 N -1.88 3.95 -0.15 1.80 1.43 -1.26 -1.12 118.68 121.45 1mmv s LEU 533 Ca 0.14 0.85 -0.25 0.00 -1.03 0.00 0.00 54.13 53.84 1mmv s LEU 533 Cb -0.10 -3.70 0.06 0.00 0.03 0.00 0.00 46.19 42.48 1mmv s LEU 533 CO 0.06 -0.30 0.63 -0.36 0.23 0.00 0.00 176.35 176.62 1mmv s PHE 534 N -2.24 -0.65 -0.26 0.29 0.40 -0.76 -4.97 117.98 109.79 1mmv s PHE 534 Ca 0.46 1.37 -0.09 0.00 -0.60 0.00 0.00 56.93 58.08 1mmv s PHE 534 Cb -0.10 0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.69 1mmv s PHE 534 CO 0.32 -0.46 0.11 -1.14 0.70 0.00 0.00 175.22 174.75 1mmv s GLN 535 N -0.43 3.73 0.12 0.44 2.00 -1.26 -0.66 119.66 123.59 1mmv s GLN 535 Ca -0.06 -0.44 -0.31 0.00 -2.00 0.00 0.00 55.36 52.55 1mmv s GLN 535 Cb -0.03 -3.44 -0.10 0.00 0.80 0.00 0.00 33.01 30.24 1mmv s GLN 535 CO 0.05 -0.20 1.74 0.42 -0.50 0.00 0.00 175.29 176.80 1mmv s ILE 536 N 1.66 2.66 -0.37 -2.34 1.01 -1.26 -4.81 121.20 117.76 1mmv s ILE 536 Ca 0.06 0.22 -0.40 0.00 0.00 0.00 0.00 60.65 60.53 1mmv s ILE 536 Cb -0.15 -3.14 -0.16 0.00 0.01 0.00 0.00 42.46 39.01 1mmv s ILE 536 CO 0.06 0.00 1.92 -2.65 0.00 0.00 0.00 174.94 174.28 1mmv n PRO 537 N 5.36 0.78 -0.38 2.79 -0.02 -1.26 -4.74 135.00 137.53 1mmv n PRO 537 Ca 0.17 0.26 0.30 0.00 -2.02 0.00 0.00 63.50 62.20 1mmv n PRO 537 Cb 0.39 -2.01 0.57 0.00 -0.02 0.00 0.00 33.50 32.42 1mmv n PRO 537 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1mmv h PRO 538 N 8.67 0.22 0.00 0.52 0.11 -1.95 1.21 132.00 140.78 1mmv h PRO 538 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1mmv h PRO 538 Cb 1.34 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1mmv h PRO 538 CO 1.00 0.15 0.00 -0.85 -0.21 0.00 0.00 178.00 178.09 1mmv n GLU 539 N -4.76 0.09 0.05 1.05 0.00 -1.26 -1.91 120.64 113.89 1mmv n GLU 539 Ca 0.32 0.41 0.11 0.00 0.00 0.00 0.00 57.16 58.00 1mmv n GLU 539 Cb 1.16 -1.69 -0.07 0.00 0.00 0.00 0.00 31.44 30.83 1mmv n GLU 539 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1mmv n LEU 540 N -1.86 0.46 -4.45 -1.84 4.77 0.42 -4.78 117.00 109.72 1mmv n LEU 540 Ca 0.02 0.16 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 1mmv n LEU 540 Cb 0.14 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 1mmv n LEU 540 CO 0.13 -0.09 0.80 -0.69 -1.33 0.00 0.00 177.39 176.21 1mmv s VAL 541 N -3.42 4.46 -0.12 4.08 1.01 -0.80 -4.81 120.40 120.79 1mmv s VAL 541 Ca -0.04 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 1mmv s VAL 541 Cb 0.12 -4.70 -0.02 0.00 0.00 0.00 0.00 36.38 31.78 1mmv s VAL 541 CO 0.84 -1.45 1.14 -0.22 0.00 0.00 0.00 175.10 175.41 1mmv s LEU 542 N 3.61 4.22 0.19 3.92 2.96 -1.26 -5.00 118.68 127.32 1mmv s LEU 542 Ca 0.24 1.64 0.10 0.00 -0.22 0.00 0.00 54.13 55.90 1mmv s LEU 542 Cb -0.14 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1mmv s LEU 542 CO 0.04 -0.61 -0.21 -1.61 -1.32 0.00 0.00 176.35 172.65 1mmv s GLU 543 N 2.62 1.41 -0.14 1.98 2.02 -1.26 -1.32 118.70 124.02 1mmv s GLU 543 Ca 0.52 -1.49 0.01 0.00 0.02 0.00 0.00 54.97 54.02 1mmv s GLU 543 Cb -0.21 -1.58 0.02 0.00 0.10 0.00 0.00 34.13 32.47 1mmv s GLU 543 CO 0.17 0.33 -0.14 0.08 0.02 0.00 0.00 175.26 175.71 1mmv s VAL 544 N -1.96 1.51 0.21 2.63 1.01 0.12 -4.89 120.40 119.03 1mmv s VAL 544 Ca 0.19 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1mmv s VAL 544 Cb -0.06 -1.41 -0.08 0.00 0.00 0.00 0.00 36.38 34.82 1mmv s VAL 544 CO 0.09 0.45 1.10 -2.16 0.00 0.00 0.00 175.10 174.58 1mmv s PRO 545 N 1.38 4.61 -0.31 2.72 0.04 -1.26 -1.63 135.00 140.55 1mmv s PRO 545 Ca 0.02 1.75 -0.15 0.00 0.04 0.00 0.00 61.00 62.65 1mmv s PRO 545 Cb -0.13 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.13 1mmv s PRO 545 CO -0.08 0.12 0.38 0.42 0.04 0.00 0.00 177.00 177.88 1mmv s ILE 546 N -0.53 5.16 0.12 0.56 -1.09 0.15 -4.83 121.20 120.74 1mmv s ILE 546 Ca 0.48 0.34 0.05 0.00 -2.23 0.00 0.00 60.65 59.28 1mmv s ILE 546 Cb -0.30 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1mmv s ILE 546 CO 0.37 0.02 -0.12 0.00 -1.23 0.00 0.00 174.94 173.98 1mmv s ARG 547 N 2.08 0.99 -0.07 2.79 3.03 -1.26 -4.20 118.95 122.30 1mmv s ARG 547 Ca 0.14 -1.28 -0.06 0.00 2.03 0.00 0.00 55.73 56.56 1mmv s ARG 547 Cb -0.16 -0.71 -0.04 0.00 -1.03 0.00 0.00 34.95 33.01 1mmv s ARG 547 CO 0.11 0.12 0.18 -1.58 -1.13 0.00 0.00 175.30 172.99 1mmv s HIS 548 N -2.59 3.59 -1.44 5.89 2.46 -1.26 -4.23 115.29 117.70 1mmv s HIS 548 Ca 0.10 0.50 0.00 0.00 0.47 0.00 0.00 55.06 56.14 1mmv s HIS 548 Cb -0.02 -1.93 0.00 0.00 -0.13 0.00 0.00 32.58 30.50 1mmv s HIS 548 CO 0.01 0.70 0.57 -0.35 -2.47 0.00 0.00 174.74 173.20 1mmv n PRO 549 N 1.59 0.79 0.00 2.88 -0.04 -1.26 -3.96 135.00 135.00 1mmv n PRO 549 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1mmv n PRO 549 Cb 0.54 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 1mmv n PRO 549 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1mmv n LYS 550 N -0.16 0.00 -3.03 0.54 5.02 -1.26 -5.02 118.16 114.25 1mmv n LYS 550 Ca 0.00 0.00 -0.45 0.00 -2.02 0.00 0.00 58.31 55.84 1mmv n LYS 550 Cb 0.11 -0.18 -0.02 0.00 -0.02 0.00 0.00 35.03 34.92 1mmv n LYS 550 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1mmv s PHE 551 N -1.09 3.35 -1.32 2.13 2.99 -1.25 -4.84 117.98 117.94 1mmv s PHE 551 Ca 0.00 -1.66 0.01 0.00 0.00 0.00 0.00 56.93 55.28 1mmv s PHE 551 Cb 0.00 -4.17 0.04 0.00 0.00 0.00 0.00 43.02 38.89 1mmv s PHE 551 CO 0.00 -1.35 0.88 -0.25 -0.00 0.00 0.00 175.22 174.49 1mmv n ASP 552 N 5.75 0.00 0.08 1.36 9.92 -1.26 -0.33 116.55 132.07 1mmv n ASP 552 Ca 0.23 0.33 0.13 0.00 -0.53 0.00 0.00 54.79 54.95 1mmv n ASP 552 Cb 0.47 -0.34 0.30 0.00 -0.64 0.00 0.00 41.12 40.91 1mmv n ASP 552 CO 0.00 0.00 0.00 -2.67 0.13 0.00 0.00 177.20 174.66 1mmv n TRP 553 N -1.34 0.72 -0.18 1.24 4.27 -1.26 -4.00 117.44 116.89 1mmv n TRP 553 Ca 0.00 0.21 -0.03 0.00 -3.89 0.00 0.00 57.50 53.79 1mmv n TRP 553 Cb 0.01 -0.79 0.07 0.00 -1.36 0.00 0.00 31.31 29.24 1mmv n TRP 553 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 1mmv h PHE 554 N 0.00 0.50 -0.77 -2.67 3.57 -1.05 -1.31 116.94 115.21 1mmv h PHE 554 Ca 0.00 0.02 0.22 0.00 3.53 0.00 0.00 57.97 61.74 1mmv h PHE 554 Cb 0.73 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 1mmv h PHE 554 CO 0.00 0.23 0.61 1.57 -2.23 0.00 0.00 178.31 178.49 1mmv h LYS 555 N 0.53 0.00 0.00 1.11 2.10 -1.73 0.19 116.57 118.76 1mmv h LYS 555 Ca 0.25 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.89 1mmv h LYS 555 Cb 0.17 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.49 1mmv h LYS 555 CO -0.18 0.00 -0.05 -0.44 -2.00 0.00 0.00 179.45 176.79 1mmv h ASP 556 N 0.00 0.00 0.20 7.07 3.32 -1.48 -1.50 116.42 124.03 1mmv h ASP 556 Ca 0.36 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.41 1mmv h ASP 556 Cb 1.58 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.13 1mmv h ASP 556 CO -0.00 0.05 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.46 1mmv h LEU 557 N 0.00 0.00 -1.07 1.55 3.38 -0.73 -3.46 115.31 114.98 1mmv h LEU 557 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1mmv h LEU 557 Cb 0.38 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.24 1mmv h LEU 557 CO 0.01 0.04 -0.52 0.61 0.09 0.00 0.00 178.44 178.66 1mmv n GLY 558 N -0.94 -0.16 3.87 0.83 0.00 -0.56 -5.02 105.19 103.21 1mmv n GLY 558 Ca -0.02 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1mmv n GLY 558 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mmv s LEU 559 N -5.61 4.18 0.14 0.99 1.43 -1.26 -5.04 118.68 113.51 1mmv s LEU 559 Ca 0.34 0.18 -0.22 0.00 -1.03 0.00 0.00 54.13 53.41 1mmv s LEU 559 Cb -0.15 -2.81 0.06 0.00 0.03 0.00 0.00 46.19 43.33 1mmv s LEU 559 CO 0.54 0.17 0.57 -1.59 0.23 0.00 0.00 176.35 176.27 1mmv s LYS 560 N -2.46 1.22 0.08 1.70 -2.85 -1.26 -0.68 119.74 115.49 1mmv s LYS 560 Ca 0.33 -0.46 -0.08 0.00 -1.00 0.00 0.00 55.97 54.76 1mmv s LYS 560 Cb -0.13 0.56 -0.00 0.00 -2.06 0.00 0.00 37.83 36.20 1mmv s LYS 560 CO 0.26 -0.52 0.17 -0.46 0.10 0.00 0.00 175.35 174.90 1mmv s TRP 561 N -3.58 0.17 0.35 1.78 -0.11 -0.65 -4.94 118.94 111.96 1mmv s TRP 561 Ca 0.00 -0.59 -0.19 0.00 1.22 0.00 0.00 56.10 56.55 1mmv s TRP 561 Cb -0.00 -0.09 -0.10 0.00 -1.50 0.00 0.00 33.47 31.78 1mmv s TRP 561 CO -0.11 -0.51 0.83 1.52 -4.62 0.00 0.00 176.95 174.05 1mmv s TYR 562 N -3.69 3.41 -0.33 5.86 -0.85 -1.26 0.13 117.35 120.61 1mmv s TYR 562 Ca 0.04 1.42 0.22 0.00 -0.52 0.00 0.00 57.07 58.23 1mmv s TYR 562 Cb 0.04 -2.69 0.18 0.00 0.38 0.00 0.00 41.96 39.88 1mmv s TYR 562 CO -0.10 0.06 1.38 0.78 -1.52 0.00 0.00 175.55 176.15 1mmv h GLY 563 N 2.34 0.00 -7.25 5.49 0.00 -1.55 -3.45 103.07 98.66 1mmv h GLY 563 Ca -0.48 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.11 1mmv h GLY 563 CO 0.64 0.00 -0.32 -2.27 0.00 0.00 0.00 176.54 174.59 1mmv s LEU 564 N -5.95 5.76 -0.03 3.11 2.96 -1.26 -4.52 118.68 118.74 1mmv s LEU 564 Ca 0.04 -1.60 -0.30 0.00 -0.22 0.00 0.00 54.13 52.05 1mmv s LEU 564 Cb 0.07 -2.14 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 1mmv s LEU 564 CO 0.72 -0.71 0.98 -2.16 -1.32 0.00 0.00 176.35 173.86 1mmv s PRO 565 N 1.55 4.51 -0.35 0.98 0.04 -1.26 -4.70 135.00 135.78 1mmv s PRO 565 Ca 0.04 1.39 0.02 0.00 0.04 0.00 0.00 61.00 62.49 1mmv s PRO 565 Cb -0.26 -3.49 0.15 0.00 0.04 0.00 0.00 34.50 30.94 1mmv s PRO 565 CO 0.04 -0.13 0.33 0.00 0.04 0.00 0.00 177.00 177.27 1mmv s ALA 566 N 1.32 -0.20 0.04 8.56 0.00 -1.26 -2.90 121.76 127.31 1mmv s ALA 566 Ca 0.50 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 51.20 1mmv s ALA 566 Cb -0.20 -1.91 -0.07 0.00 0.00 0.00 0.00 23.12 20.94 1mmv s ALA 566 CO 0.25 -2.02 1.57 0.08 0.00 0.00 0.00 175.76 175.64 1mmv s VAL 567 N 1.62 3.28 0.00 0.00 1.01 -0.69 -0.67 120.40 124.95 1mmv s VAL 567 Ca 0.15 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.82 1mmv s VAL 567 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1mmv s VAL 567 CO -0.11 -0.00 0.40 -1.54 0.00 0.00 0.00 175.10 173.84 1mmv n SER 568 N 5.59 0.80 -1.23 3.32 3.41 -0.03 -1.81 113.62 123.66 1mmv n SER 568 Ca 0.15 -1.00 0.12 0.00 -0.26 0.00 0.00 58.87 57.88 1mmv n SER 568 Cb 0.42 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.63 1mmv n SER 568 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1mmv n ASN 569 N -0.00 3.64 -4.95 4.04 6.94 -1.22 -4.45 115.26 119.26 1mmv n ASN 569 Ca 0.00 -2.00 -0.23 0.00 -0.02 0.00 0.00 54.58 52.33 1mmv n ASN 569 Cb 0.05 -0.33 0.04 0.00 -2.36 0.00 0.00 39.78 37.17 1mmv n ASN 569 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1mmv s MET 570 N -1.33 2.67 -0.16 -3.83 -1.94 -1.26 -4.35 119.30 109.09 1mmv s MET 570 Ca 0.43 -0.47 -0.01 0.00 -1.71 0.00 0.00 55.69 53.93 1mmv s MET 570 Cb 0.24 -2.40 -0.01 0.00 2.01 0.00 0.00 34.83 34.67 1mmv s MET 570 CO 0.32 -0.70 -0.12 -1.17 -0.01 0.00 0.00 175.02 173.34 1mmv s LEU 571 N -4.85 2.66 -0.26 -0.03 0.20 0.39 -4.30 118.68 112.50 1mmv s LEU 571 Ca 0.55 -0.40 -0.15 0.00 0.69 0.00 0.00 54.13 54.81 1mmv s LEU 571 Cb -0.10 -1.62 -0.04 0.00 -0.43 0.00 0.00 46.19 44.00 1mmv s LEU 571 CO 0.41 0.08 0.38 -0.22 -0.29 0.00 0.00 176.35 176.71 1mmv s LEU 572 N 0.85 4.06 -0.21 -0.68 2.96 -0.65 0.34 118.68 125.35 1mmv s LEU 572 Ca -0.04 0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 54.18 1mmv s LEU 572 Cb -0.15 -2.45 -0.01 0.00 0.50 0.00 0.00 46.19 44.07 1mmv s LEU 572 CO 0.00 -0.17 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.13 1mmv s GLU 573 N 1.93 3.43 -0.04 1.98 2.12 -0.23 -0.32 118.70 127.56 1mmv s GLU 573 Ca 0.16 -0.61 0.01 0.00 0.36 0.00 0.00 54.97 54.90 1mmv s GLU 573 Cb -0.15 -3.00 0.02 0.00 0.26 0.00 0.00 34.13 31.26 1mmv s GLU 573 CO 0.09 -0.13 -0.06 0.42 -0.54 0.00 0.00 175.26 175.05 1mmv s ILE 574 N 1.31 0.61 -1.76 -3.70 1.01 -0.37 -2.14 121.20 116.16 1mmv s ILE 574 Ca 0.04 -0.18 -0.18 0.00 0.00 0.00 0.00 60.65 60.33 1mmv s ILE 574 Cb -0.14 -0.62 0.17 0.00 0.01 0.00 0.00 42.46 41.88 1mmv s ILE 574 CO -0.01 0.24 0.59 0.61 0.00 0.00 0.00 174.94 176.36 1mmv n GLY 575 N 3.95 -0.37 2.91 6.18 0.00 -1.26 0.34 105.19 116.94 1mmv n GLY 575 Ca -0.25 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1mmv n GLY 575 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mmv n GLY 576 N -1.41 3.03 3.80 -0.02 0.00 -1.26 -3.50 105.19 105.82 1mmv n GLY 576 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1mmv n GLY 576 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mmv s LEU 577 N 0.00 4.07 -0.13 0.99 1.43 0.15 -5.02 118.68 120.17 1mmv s LEU 577 Ca 0.00 1.86 0.03 0.00 -1.03 0.00 0.00 54.13 54.99 1mmv s LEU 577 Cb 0.00 -4.32 0.01 0.00 0.03 0.00 0.00 46.19 41.90 1mmv s LEU 577 CO 0.00 -0.40 -0.21 -1.61 0.23 0.00 0.00 176.35 174.36 1mmv s GLU 578 N -2.74 3.06 -0.44 1.70 2.02 -1.26 -1.23 118.70 119.81 1mmv s GLU 578 Ca 0.59 -0.84 -0.04 0.00 0.02 0.00 0.00 54.97 54.69 1mmv s GLU 578 Cb -0.16 -2.43 0.12 0.00 0.10 0.00 0.00 34.13 31.76 1mmv s GLU 578 CO 0.21 0.05 0.26 -0.06 0.02 0.00 0.00 175.26 175.73 1mmv s PHE 579 N 0.68 3.54 -0.25 1.61 0.40 0.56 -0.12 117.98 124.41 1mmv s PHE 579 Ca -0.10 -2.31 0.28 0.00 -0.60 0.00 0.00 56.93 54.20 1mmv s PHE 579 Cb -0.16 -3.30 1.14 0.00 0.51 0.00 0.00 43.02 41.21 1mmv s PHE 579 CO 0.01 -0.97 1.82 0.66 0.70 0.00 0.00 175.22 177.45 1mmv h SER 580 N 8.07 0.00 -3.37 1.36 4.64 -1.81 -1.73 113.55 120.71 1mmv h SER 580 Ca -0.14 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.59 1mmv h SER 580 Cb 1.05 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.74 1mmv h SER 580 CO 0.74 0.00 -0.76 0.00 -0.87 0.00 0.00 176.83 175.94 1mmv s ALA 581 N -3.46 1.70 -0.40 5.18 0.00 -1.16 -4.64 121.76 118.98 1mmv s ALA 581 Ca 0.03 -1.48 0.10 0.00 0.00 0.00 0.00 51.96 50.61 1mmv s ALA 581 Cb 0.09 -1.52 0.35 0.00 0.00 0.00 0.00 23.12 22.04 1mmv s ALA 581 CO 0.46 -1.44 0.91 0.00 0.00 0.00 0.00 175.76 175.69 1mmv n PRO 583 N 0.24 2.21 -4.13 0.00 -0.04 -1.20 -4.68 135.00 127.40 1mmv n PRO 583 Ca 0.16 0.78 -0.11 0.00 -0.04 0.00 0.00 63.50 64.29 1mmv n PRO 583 Cb 0.69 -2.43 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1mmv n PRO 583 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1mmv s PHE 584 N -0.52 0.81 0.08 0.54 -0.12 -0.75 -1.22 117.98 116.80 1mmv s PHE 584 Ca 0.62 -0.77 -0.06 0.00 -0.05 0.00 0.00 56.93 56.66 1mmv s PHE 584 Cb -0.58 -0.47 -0.01 0.00 -0.63 0.00 0.00 43.02 41.32 1mmv s PHE 584 CO 0.55 -0.13 0.13 -1.54 -0.05 0.00 0.00 175.22 174.18 1mmv s SER 585 N -2.53 0.23 0.00 1.98 1.04 0.54 -1.70 113.70 113.26 1mmv s SER 585 Ca 0.04 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1mmv s SER 585 Cb 0.00 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.42 1mmv s SER 585 CO -0.03 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.10 1mmv n GLY 586 N -0.02 3.54 3.39 7.32 0.00 -1.14 -1.84 105.19 116.45 1mmv n GLY 586 Ca -0.14 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 1mmv n GLY 586 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1mmv s TRP 587 N 2.61 0.19 0.50 1.61 -2.14 -1.26 -4.50 118.94 115.95 1mmv s TRP 587 Ca 0.00 -0.54 -0.17 0.00 2.66 0.00 0.00 56.10 58.05 1mmv s TRP 587 Cb 0.00 0.11 -0.08 0.00 -3.10 0.00 0.00 33.47 30.40 1mmv s TRP 587 CO 0.00 -0.78 0.97 0.71 -2.66 0.00 0.00 176.95 175.19 1mmv s TYR 588 N -3.92 3.44 -0.14 1.66 1.51 -1.26 -4.89 117.35 113.75 1mmv s TYR 588 Ca 0.13 1.46 -0.04 0.00 -1.01 0.00 0.00 57.07 57.61 1mmv s TYR 588 Cb 0.02 -2.78 -0.03 0.00 -0.11 0.00 0.00 41.96 39.05 1mmv s TYR 588 CO -0.02 -0.34 -0.00 1.41 -1.11 0.00 0.00 175.55 175.49 1mmv s MET 589 N -3.99 3.55 0.24 -0.62 -2.45 -1.26 -1.39 119.30 113.39 1mmv s MET 589 Ca 0.59 -0.44 -0.15 0.00 -1.25 0.00 0.00 55.69 54.44 1mmv s MET 589 Cb -0.10 -2.96 0.30 0.00 1.25 0.00 0.00 34.83 33.32 1mmv s MET 589 CO 0.30 0.38 1.56 0.78 1.05 0.00 0.00 175.02 179.09 1mmv h GLY 590 N 6.25 0.28 0.97 2.11 0.00 -0.12 -1.74 103.07 110.82 1mmv h GLY 590 Ca -0.38 0.44 0.13 0.00 0.00 0.00 0.00 47.33 47.52 1mmv h GLY 590 CO 0.62 -0.26 0.38 -0.91 0.00 0.00 0.00 176.54 176.38 1mmv h THR 591 N -0.02 0.60 -0.90 4.70 1.35 -1.93 -2.35 112.91 114.36 1mmv h THR 591 Ca 0.37 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 66.31 1mmv h THR 591 Cb 0.63 0.72 -0.07 0.00 -1.73 0.00 0.00 68.15 67.70 1mmv h THR 591 CO -0.95 0.00 0.55 -0.33 -0.25 0.00 0.00 175.52 174.54 1mmv h GLU 592 N 0.00 0.94 0.00 4.72 5.08 -1.72 0.64 114.58 124.24 1mmv h GLU 592 Ca 0.22 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.38 1mmv h GLU 592 Cb 0.98 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1mmv h GLU 592 CO -0.00 0.62 -0.92 0.82 -1.00 0.00 0.00 179.01 178.53 1mmv h ILE 593 N 0.97 0.65 -0.21 3.13 2.04 -1.61 -1.76 117.51 120.73 1mmv h ILE 593 Ca 0.41 -1.79 -0.08 0.00 1.00 0.00 0.00 64.86 64.39 1mmv h ILE 593 Cb 0.25 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1mmv h ILE 593 CO -0.20 0.22 -0.21 1.23 0.00 0.00 0.00 178.15 179.19 1mmv h GLY 594 N -1.00 0.42 0.00 5.37 0.00 -1.48 0.96 103.07 107.34 1mmv h GLY 594 Ca -0.21 -0.31 -0.19 0.00 0.00 0.00 0.00 47.33 46.62 1mmv h GLY 594 CO -0.13 0.29 -1.45 -0.62 0.00 0.00 0.00 176.54 174.62 1mmv n VAL 595 N -4.16 1.50 -0.01 4.60 0.31 0.17 -4.00 118.33 116.74 1mmv n VAL 595 Ca -0.00 -0.04 -0.03 0.00 -0.01 0.00 0.00 64.34 64.25 1mmv n VAL 595 Cb 0.36 -2.16 -0.02 0.00 -0.91 0.00 0.00 33.84 31.11 1mmv n VAL 595 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1mmv h ARG 596 N -1.00 -0.09 -0.44 5.55 2.47 -1.47 -2.66 114.38 116.74 1mmv h ARG 596 Ca -0.29 0.01 -0.10 0.00 -1.26 0.00 0.00 59.98 58.34 1mmv h ARG 596 Cb 1.16 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 29.48 1mmv h ARG 596 CO -0.17 0.08 -0.12 -0.44 0.56 0.00 0.00 179.97 179.87 1mmv h ASP 597 N -1.01 0.80 0.23 7.04 3.32 -1.16 -1.90 116.42 123.74 1mmv h ASP 597 Ca -0.01 -0.25 -0.35 0.00 0.02 0.00 0.00 57.03 56.44 1mmv h ASP 597 Cb 0.20 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1mmv h ASP 597 CO 0.02 0.94 -1.79 1.88 -1.72 0.00 0.00 179.24 178.57 1mmv h TYR 598 N 0.73 0.57 0.00 4.55 0.99 -1.01 -2.27 116.97 120.54 1mmv h TYR 598 Ca 0.12 -0.42 0.00 0.00 2.00 0.00 0.00 58.73 60.43 1mmv h TYR 598 Cb 0.62 -0.02 0.00 0.00 1.00 0.00 0.00 36.73 38.33 1mmv h TYR 598 CO 0.03 1.63 -1.57 0.00 -0.00 0.00 0.00 178.16 178.25 1mmv n ASP 600 N -1.94 2.12 -0.04 0.00 9.92 -0.71 -4.56 116.55 121.33 1mmv n ASP 600 Ca -0.01 1.17 0.02 0.00 -0.53 0.00 0.00 54.79 55.44 1mmv n ASP 600 Cb 0.43 -1.37 0.36 0.00 -0.64 0.00 0.00 41.12 39.89 1mmv n ASP 600 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 1mmv h ASN 601 N 2.93 0.56 -0.09 -2.24 -1.24 -1.93 -1.58 115.58 111.99 1mmv h ASN 601 Ca -0.43 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.54 1mmv h ASN 601 Cb 1.31 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 40.22 1mmv h ASN 601 CO 0.66 0.45 0.00 -1.20 -1.29 0.00 0.00 177.43 176.06 1mmv n SER 602 N -4.42 0.86 0.00 1.15 7.64 -1.26 -4.53 113.62 113.06 1mmv n SER 602 Ca 0.04 -1.59 0.00 0.00 1.01 0.00 0.00 58.87 58.33 1mmv n SER 602 Cb 0.10 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1mmv n SER 602 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1mmv n ARG 603 N -0.21 2.54 0.04 1.43 5.12 -0.62 -4.33 116.66 120.64 1mmv n ARG 603 Ca 0.15 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 56.12 1mmv n ARG 603 Cb 0.20 0.00 0.25 0.00 -1.16 0.00 0.00 32.46 31.75 1mmv n ARG 603 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1mmv n TYR 604 N 0.00 0.22 -3.18 -1.55 4.02 -0.85 -4.69 117.16 111.12 1mmv n TYR 604 Ca 0.00 0.10 -0.12 0.00 -0.01 0.00 0.00 57.90 57.87 1mmv n TYR 604 Cb 0.00 -0.67 0.00 0.00 -0.02 0.00 0.00 39.34 38.65 1mmv n TYR 604 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1mmv n ASN 605 N -1.72 -1.99 -1.03 7.72 5.15 -0.91 -4.85 115.26 117.63 1mmv n ASN 605 Ca 0.01 -0.44 0.12 0.00 -0.60 0.00 0.00 54.58 53.66 1mmv n ASN 605 Cb 0.09 -0.68 0.16 0.00 -0.53 0.00 0.00 39.78 38.82 1mmv n ASN 605 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1mmv n ILE 606 N -1.61 0.27 -0.06 -1.44 -5.35 -0.09 -4.70 119.36 106.38 1mmv n ILE 606 Ca -0.13 -0.63 -0.10 0.00 -0.27 0.00 0.00 62.75 61.62 1mmv n ILE 606 Cb 0.29 1.22 -0.04 0.00 -1.74 0.00 0.00 39.64 39.36 1mmv n ILE 606 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1mmv h LEU 607 N 4.44 -1.23 -0.39 7.28 3.38 -1.85 -2.29 115.31 124.64 1mmv h LEU 607 Ca 0.00 0.18 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1mmv h LEU 607 Cb 0.97 0.53 -0.07 0.00 0.09 0.00 0.00 40.66 42.18 1mmv h LEU 607 CO 0.00 -0.38 -0.05 -0.33 0.09 0.00 0.00 178.44 177.78 1mmv h GLU 608 N -0.38 0.05 0.01 1.13 5.08 -1.99 0.25 114.58 118.73 1mmv h GLU 608 Ca 0.12 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1mmv h GLU 608 Cb 0.58 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 1mmv h GLU 608 CO -0.46 0.03 -0.26 0.93 -1.00 0.00 0.00 179.01 178.25 1mmv h GLU 609 N 0.05 -0.39 -0.93 2.33 5.08 -1.83 0.52 114.58 119.41 1mmv h GLU 609 Ca 0.19 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1mmv h GLU 609 Cb 0.29 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 1mmv h GLU 609 CO -0.36 -0.26 0.62 0.28 -1.00 0.00 0.00 179.01 178.28 1mmv h VAL 610 N -0.40 1.24 -0.05 3.13 2.07 -0.94 -2.38 116.25 118.91 1mmv h VAL 610 Ca 0.06 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.15 1mmv h VAL 610 Cb 0.48 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1mmv h VAL 610 CO -0.22 0.23 0.02 0.00 0.02 0.00 0.00 177.57 177.62 1mmv h ALA 611 N 1.42 0.06 -0.02 1.67 0.00 0.27 -2.49 119.26 120.16 1mmv h ALA 611 Ca 0.34 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.29 1mmv h ALA 611 Cb -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 1mmv h ALA 611 CO -0.07 -0.46 -0.33 0.87 0.00 0.00 0.00 179.25 179.25 1mmv h LYS 612 N 0.04 -0.46 0.00 0.00 1.57 -0.48 -0.18 116.57 117.07 1mmv h LYS 612 Ca 0.02 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1mmv h LYS 612 Cb 0.01 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1mmv h LYS 612 CO -0.03 -0.30 0.04 1.63 -0.57 0.00 0.00 179.45 180.22 1mmv n LYS 613 N -5.42 0.13 0.01 3.15 5.02 -0.94 0.97 118.16 121.10 1mmv n LYS 613 Ca -0.05 0.63 0.11 0.00 -2.02 0.00 0.00 58.31 56.98 1mmv n LYS 613 Cb 0.33 -1.97 0.03 0.00 -0.02 0.00 0.00 35.03 33.40 1mmv n LYS 613 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1mmv n MET 614 N -2.22 0.19 -3.47 1.97 2.81 -0.17 -4.99 117.12 111.23 1mmv n MET 614 Ca -0.01 -0.01 -0.18 0.00 -1.81 0.00 0.00 57.70 55.68 1mmv n MET 614 Cb 0.07 -1.55 0.07 0.00 -0.71 0.00 0.00 33.22 31.10 1mmv n MET 614 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1mmv n ASP 615 N -1.79 -2.81 -4.70 7.83 2.03 0.27 -5.02 116.55 112.37 1mmv n ASP 615 Ca 0.03 -0.70 -0.28 0.00 0.52 0.00 0.00 54.79 54.35 1mmv n ASP 615 Cb 0.40 -4.81 -0.07 0.00 -0.72 0.00 0.00 41.12 35.91 1mmv n ASP 615 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1mmv s LEU 616 N -6.26 3.47 -0.51 -2.67 0.05 -1.22 -5.03 118.68 106.50 1mmv s LEU 616 Ca 0.10 -0.25 -0.26 0.00 0.05 0.00 0.00 54.13 53.77 1mmv s LEU 616 Cb -0.02 -2.15 -0.05 0.00 -2.05 0.00 0.00 46.19 41.92 1mmv s LEU 616 CO 0.76 0.13 2.19 -0.62 -0.55 0.00 0.00 176.35 178.26 1mmv s ASP 617 N -2.67 4.83 -0.01 1.48 2.15 -1.26 -4.77 116.67 116.43 1mmv s ASP 617 Ca 0.27 0.90 0.15 0.00 0.43 0.00 0.00 52.55 54.30 1mmv s ASP 617 Cb -0.11 -2.51 0.43 0.00 -0.30 0.00 0.00 42.92 40.43 1mmv s ASP 617 CO 0.19 -2.61 1.35 0.23 -0.17 0.00 0.00 175.17 174.16 1mmv n MET 618 N 9.03 2.19 -0.06 4.34 2.81 -1.26 -4.24 117.12 129.93 1mmv n MET 618 Ca 0.30 -1.75 -0.13 0.00 -1.81 0.00 0.00 57.70 54.31 1mmv n MET 618 Cb 0.53 -1.41 -0.07 0.00 -0.71 0.00 0.00 33.22 31.57 1mmv n MET 618 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1mmv h ARG 619 N 2.81 0.33 -5.74 0.03 3.08 -2.05 -3.44 114.38 109.41 1mmv h ARG 619 Ca 0.00 -0.15 -0.68 0.00 0.07 0.00 0.00 59.98 59.22 1mmv h ARG 619 Cb 0.69 -0.01 -0.29 0.00 0.08 0.00 0.00 29.97 30.44 1mmv h ARG 619 CO 0.02 0.66 -0.83 -1.59 -1.07 0.00 0.00 179.97 177.15 1mmv s LYS 620 N -4.53 2.87 0.43 0.04 -2.85 -1.26 -5.02 119.74 109.42 1mmv s LYS 620 Ca -0.14 -0.81 0.11 0.00 -1.00 0.00 0.00 55.97 54.13 1mmv s LYS 620 Cb 0.05 -2.35 0.98 0.00 -2.06 0.00 0.00 37.83 34.46 1mmv s LYS 620 CO 0.74 0.33 2.03 1.79 0.10 0.00 0.00 175.35 180.35 1mmv h THR 621 N 5.17 1.00 0.00 3.79 1.35 -1.90 -2.55 112.91 119.77 1mmv h THR 621 Ca -0.30 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1mmv h THR 621 Cb 1.20 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 1mmv h THR 621 CO 0.50 0.08 0.00 -1.54 -0.25 0.00 0.00 175.52 174.31 1mmv n SER 622 N -4.48 0.00 0.04 5.36 3.41 -1.26 -0.92 113.62 115.77 1mmv n SER 622 Ca 0.05 -0.12 0.13 0.00 -0.26 0.00 0.00 58.87 58.68 1mmv n SER 622 Cb 0.21 -0.11 0.37 0.00 -0.26 0.00 0.00 64.21 64.42 1mmv n SER 622 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1mmv n SER 623 N -1.11 0.49 -3.60 4.04 3.41 -0.96 -4.93 113.62 110.95 1mmv n SER 623 Ca 0.06 0.25 -0.24 0.00 -0.26 0.00 0.00 58.87 58.68 1mmv n SER 623 Cb 0.05 -0.23 0.08 0.00 -0.26 0.00 0.00 64.21 63.84 1mmv n SER 623 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1mmv n LEU 624 N -1.84 -3.40 -0.05 1.04 4.77 -0.10 -4.91 117.00 112.52 1mmv n LEU 624 Ca 0.05 -0.54 -0.04 0.00 -0.03 0.00 0.00 56.01 55.45 1mmv n LEU 624 Cb 0.39 -3.03 0.18 0.00 -2.33 0.00 0.00 43.42 38.62 1mmv n LEU 624 CO 0.32 0.65 0.81 4.11 -1.33 0.00 0.00 177.39 181.95 1mmv h TRP 625 N -2.70 0.70 -0.87 -1.77 5.08 -1.84 -1.15 115.95 113.40 1mmv h TRP 625 Ca -0.57 -0.12 -0.02 0.00 1.08 0.00 0.00 58.89 59.26 1mmv h TRP 625 Cb 1.37 -0.18 -0.04 0.00 -3.00 0.00 0.00 29.16 27.31 1mmv h TRP 625 CO 0.50 0.74 0.46 0.87 -1.28 0.00 0.00 178.44 179.73 1mmv h LYS 626 N 0.58 1.22 -0.24 0.12 1.57 -1.90 0.17 116.57 118.08 1mmv h LYS 626 Ca 0.10 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1mmv h LYS 626 Cb 0.56 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1mmv h LYS 626 CO 0.04 0.90 -0.18 -0.44 -0.57 0.00 0.00 179.45 179.20 1mmv h ASP 627 N 1.22 0.58 -0.17 0.86 5.19 -1.84 0.31 116.42 122.57 1mmv h ASP 627 Ca 0.30 -0.45 -0.01 0.00 -0.62 0.00 0.00 57.03 56.26 1mmv h ASP 627 Cb 0.05 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 1mmv h ASP 627 CO -0.05 0.90 0.08 1.56 -3.12 0.00 0.00 179.24 178.61 1mmv h GLN 628 N 0.26 0.26 -0.36 3.56 4.20 -0.95 -2.07 115.11 120.01 1mmv h GLN 628 Ca 0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1mmv h GLN 628 Cb 0.71 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1mmv h GLN 628 CO 0.05 0.32 0.15 0.00 -0.67 0.00 0.00 178.83 178.67 1mmv h ALA 629 N 0.93 1.60 0.14 3.87 0.00 -0.65 -2.88 119.26 122.26 1mmv h ALA 629 Ca 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1mmv h ALA 629 Cb 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1mmv h ALA 629 CO -0.01 0.32 -0.07 1.25 0.00 0.00 0.00 179.25 180.75 1mmv h LEU 630 N 0.50 -0.16 -0.23 0.00 5.85 -0.47 -2.18 115.31 118.62 1mmv h LEU 630 Ca 0.12 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.74 1mmv h LEU 630 Cb 0.09 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 1mmv h LEU 630 CO -0.01 0.07 -0.17 0.58 -0.34 0.00 0.00 178.44 178.56 1mmv h VAL 631 N -0.39 0.52 -0.69 1.05 2.07 -1.19 -1.73 116.25 115.90 1mmv h VAL 631 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 1mmv h VAL 631 Cb 0.31 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 1mmv h VAL 631 CO 0.03 0.00 0.40 -0.33 0.02 0.00 0.00 177.57 177.69 1mmv h GLU 632 N -0.17 0.72 -0.70 1.57 4.39 -1.51 0.11 114.58 118.99 1mmv h GLU 632 Ca 0.13 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.80 1mmv h GLU 632 Cb 0.37 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 1mmv h GLU 632 CO -0.34 0.47 0.46 0.82 -1.16 0.00 0.00 179.01 179.27 1mmv h ILE 633 N 0.74 1.16 0.00 3.13 2.04 -0.82 -0.91 117.51 122.84 1mmv h ILE 633 Ca 0.30 -0.31 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 1mmv h ILE 633 Cb 0.15 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1mmv h ILE 633 CO -0.17 0.17 -0.50 0.78 0.00 0.00 0.00 178.15 178.43 1mmv h ASN 634 N 0.91 0.00 -0.02 1.72 4.21 -0.39 -2.69 115.58 119.32 1mmv h ASN 634 Ca 0.26 0.00 -0.15 0.00 1.21 0.00 0.00 56.30 57.62 1mmv h ASN 634 Cb -0.06 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 1mmv h ASN 634 CO -0.06 0.47 -0.48 0.40 -1.29 0.00 0.00 177.43 176.46 1mmv h ILE 635 N 0.00 1.31 -0.02 2.81 2.04 -0.07 -2.92 117.51 120.66 1mmv h ILE 635 Ca -0.01 -1.69 -0.00 0.00 1.00 0.00 0.00 64.86 64.15 1mmv h ILE 635 Cb 1.37 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 39.11 1mmv h ILE 635 CO 0.06 0.53 -0.00 0.00 0.00 0.00 0.00 178.15 178.74 1mmv h ALA 636 N 1.01 0.03 -0.10 1.87 0.00 -1.14 -0.89 119.26 120.05 1mmv h ALA 636 Ca 0.02 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1mmv h ALA 636 Cb 1.01 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1mmv h ALA 636 CO 0.09 -0.29 -0.23 0.28 0.00 0.00 0.00 179.25 179.10 1mmv h VAL 637 N -0.28 0.44 -0.57 0.00 2.07 -1.50 0.28 116.25 116.69 1mmv h VAL 637 Ca 0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1mmv h VAL 637 Cb 0.34 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1mmv h VAL 637 CO 0.00 0.00 0.35 -0.07 0.02 0.00 0.00 177.57 177.87 1mmv h LEU 638 N -0.31 0.68 -0.06 2.57 3.38 -1.54 -2.04 115.31 117.99 1mmv h LEU 638 Ca 0.09 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1mmv h LEU 638 Cb 0.44 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1mmv h LEU 638 CO -0.28 0.54 -0.05 0.22 0.09 0.00 0.00 178.44 178.96 1mmv h TYR 639 N 0.77 -0.13 0.52 1.13 3.20 -0.42 -1.19 116.97 120.85 1mmv h TYR 639 Ca 0.20 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1mmv h TYR 639 Cb -0.02 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1mmv h TYR 639 CO -0.02 -0.08 -0.42 0.77 -1.64 0.00 0.00 178.16 176.77 1mmv h SER 640 N -0.07 -1.10 -0.67 -2.11 0.02 -0.27 -0.42 113.55 108.93 1mmv h SER 640 Ca 0.04 0.08 0.14 0.00 -0.84 0.00 0.00 61.79 61.21 1mmv h SER 640 Cb 0.13 0.35 -0.12 0.00 0.14 0.00 0.00 62.40 62.90 1mmv h SER 640 CO -0.10 -0.58 -0.02 -0.26 -1.14 0.00 0.00 176.83 174.73 1mmv h PHE 641 N -0.91 -0.09 -0.42 3.45 -1.00 -1.32 0.70 116.94 117.36 1mmv h PHE 641 Ca -0.07 0.05 -0.05 0.00 2.81 0.00 0.00 57.97 60.71 1mmv h PHE 641 Cb 0.76 0.14 -0.02 0.00 3.61 0.00 0.00 35.95 40.44 1mmv h PHE 641 CO -0.16 -0.20 0.03 1.96 -1.61 0.00 0.00 178.31 178.33 1mmv h GLN 642 N 0.10 0.66 -0.40 1.51 4.20 -1.10 0.01 115.11 120.09 1mmv h GLN 642 Ca 0.35 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.85 1mmv h GLN 642 Cb 0.58 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1mmv h GLN 642 CO -0.59 0.65 -0.00 0.77 -0.67 0.00 0.00 178.83 178.99 1mmv h SER 643 N 0.63 0.70 -0.01 1.46 0.02 0.84 -2.45 113.55 114.73 1mmv h SER 643 Ca 0.13 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1mmv h SER 643 Cb 0.34 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1mmv h SER 643 CO 0.01 0.84 0.00 0.47 -1.14 0.00 0.00 176.83 177.01 1mmv n ASP 644 N -4.44 0.10 -2.05 3.07 8.00 -0.40 -4.89 116.55 115.95 1mmv n ASP 644 Ca -0.01 -1.70 -0.19 0.00 0.71 0.00 0.00 54.79 53.60 1mmv n ASP 644 Cb 0.29 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.36 1mmv n ASP 644 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mmv n LYS 645 N -0.59 -1.49 -3.49 -1.24 5.02 -0.80 -4.99 118.16 110.58 1mmv n LYS 645 Ca 0.08 0.97 -0.37 0.00 -2.02 0.00 0.00 58.31 56.97 1mmv n LYS 645 Cb 0.05 -5.49 -0.07 0.00 -0.02 0.00 0.00 35.03 29.51 1mmv n LYS 645 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1mmv s VAL 646 N -2.91 5.28 0.29 -0.18 1.01 -0.07 -4.37 120.40 119.45 1mmv s VAL 646 Ca 0.00 0.63 -0.29 0.00 0.00 0.00 0.00 61.98 62.32 1mmv s VAL 646 Cb 0.00 -3.67 -0.13 0.00 0.00 0.00 0.00 36.38 32.58 1mmv s VAL 646 CO 0.00 0.37 1.23 0.41 0.00 0.00 0.00 175.10 177.10 1mmv n THR 647 N 3.66 1.68 -3.60 3.92 -1.04 0.38 -4.28 114.28 114.99 1mmv n THR 647 Ca -0.11 -0.42 -0.09 0.00 -2.04 0.00 0.00 64.05 61.40 1mmv n THR 647 Cb 0.52 -1.33 -0.06 0.00 -1.82 0.00 0.00 70.33 67.64 1mmv n THR 647 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1mmv s ILE 648 N -0.79 0.00 -0.01 12.58 2.07 -1.26 -4.51 121.20 129.29 1mmv s ILE 648 Ca 0.60 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 59.90 1mmv s ILE 648 Cb -0.64 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 40.93 1mmv s ILE 648 CO 0.58 0.00 -0.17 0.54 -1.91 0.00 0.00 174.94 173.98 1mmv s VAL 649 N -0.70 1.37 0.52 4.00 0.11 -0.49 -4.97 120.40 120.25 1mmv s VAL 649 Ca 0.01 -0.77 -0.10 0.00 -2.93 0.00 0.00 61.98 58.19 1mmv s VAL 649 Cb -0.02 -1.14 -0.05 0.00 -1.53 0.00 0.00 36.38 33.64 1mmv s VAL 649 CO -0.03 0.37 0.91 1.51 -3.33 0.00 0.00 175.10 174.53 1mmv s ASP 650 N -0.46 6.37 0.54 3.54 -4.77 -1.26 0.64 116.67 121.26 1mmv s ASP 650 Ca 0.07 1.26 0.21 0.00 -3.30 0.00 0.00 52.55 50.79 1mmv s ASP 650 Cb -0.07 -2.39 1.46 0.00 -1.09 0.00 0.00 42.92 40.83 1mmv s ASP 650 CO -0.00 -0.65 2.17 1.12 0.70 0.00 0.00 175.17 178.51 1mmv h HIS 651 N 0.35 0.00 0.33 2.11 2.07 -1.97 -1.17 115.15 116.87 1mmv h HIS 651 Ca -0.46 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.05 1mmv h HIS 651 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 1mmv h HIS 651 CO 0.63 0.02 -0.16 0.45 -3.07 0.00 0.00 177.93 175.80 1mmv h HIS 652 N 0.00 -0.41 -0.64 6.12 3.86 -1.96 -2.27 115.15 119.84 1mmv h HIS 652 Ca -0.00 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1mmv h HIS 652 Cb 0.04 0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.61 1mmv h HIS 652 CO 0.00 -0.07 0.41 1.03 0.86 0.00 0.00 177.93 180.15 1mmv h SER 653 N -0.83 0.67 -0.63 2.45 0.87 -1.89 -1.78 113.55 112.41 1mmv h SER 653 Ca -0.05 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 1mmv h SER 653 Cb 0.52 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 1mmv h SER 653 CO 0.07 0.47 0.26 0.00 -0.53 0.00 0.00 176.83 177.10 1mmv h ALA 654 N 1.27 0.81 -0.16 6.23 0.00 -1.27 -1.73 119.26 124.41 1mmv h ALA 654 Ca 0.25 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 1mmv h ALA 654 Cb -0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1mmv h ALA 654 CO -0.09 0.43 -0.57 1.79 0.00 0.00 0.00 179.25 180.80 1mmv h THR 655 N 0.88 1.33 -0.69 0.00 1.35 -1.24 -1.70 112.91 112.83 1mmv h THR 655 Ca 0.21 -1.84 -0.03 0.00 -0.55 0.00 0.00 66.41 64.20 1mmv h THR 655 Cb 0.20 1.82 -0.03 0.00 -1.73 0.00 0.00 68.15 68.41 1mmv h THR 655 CO -0.02 0.57 0.31 -0.08 -0.25 0.00 0.00 175.52 176.04 1mmv h GLU 656 N 0.39 1.02 -0.44 4.72 4.81 -1.14 -1.26 114.58 122.67 1mmv h GLU 656 Ca 0.00 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 1mmv h GLU 656 Cb 1.11 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 1mmv h GLU 656 CO 0.10 0.82 0.16 0.77 -0.73 0.00 0.00 179.01 180.13 1mmv h SER 657 N 0.98 0.63 -0.83 1.04 0.02 -1.15 -2.44 113.55 111.79 1mmv h SER 657 Ca 0.23 -0.19 0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1mmv h SER 657 Cb 0.16 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.49 1mmv h SER 657 CO -0.02 0.65 0.54 0.15 -1.14 0.00 0.00 176.83 177.00 1mmv h PHE 658 N 0.57 1.01 -0.44 3.45 3.57 -0.94 0.22 116.94 124.38 1mmv h PHE 658 Ca 0.14 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.70 1mmv h PHE 658 Cb 0.23 -0.34 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 1mmv h PHE 658 CO 0.01 0.60 0.22 0.82 -2.23 0.00 0.00 178.31 177.73 1mmv h ILE 659 N 1.06 0.97 -0.26 1.41 1.08 -0.99 0.40 117.51 121.19 1mmv h ILE 659 Ca 0.32 -0.15 -0.00 0.00 -0.39 0.00 0.00 64.86 64.64 1mmv h ILE 659 Cb -0.04 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.19 1mmv h ILE 659 CO -0.10 0.08 0.16 0.50 -0.69 0.00 0.00 178.15 178.10 1mmv h LYS 660 N 0.44 0.35 -0.74 2.37 3.64 -0.84 -1.46 116.57 120.32 1mmv h LYS 660 Ca 0.19 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.59 1mmv h LYS 660 Cb 0.09 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 1mmv h LYS 660 CO -0.13 0.27 0.45 1.25 -2.27 0.00 0.00 179.45 179.01 1mmv h HIS 661 N 0.32 0.83 -0.26 1.91 2.76 0.03 -0.70 115.15 120.03 1mmv h HIS 661 Ca 0.09 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1mmv h HIS 661 Cb 0.01 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.67 1mmv h HIS 661 CO -0.05 0.43 0.07 1.98 -1.30 0.00 0.00 177.93 179.07 1mmv h MET 662 N 0.84 0.17 -0.87 5.26 4.05 0.34 0.17 114.93 124.88 1mmv h MET 662 Ca 0.31 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.70 1mmv h MET 662 Cb 0.11 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 30.83 1mmv h MET 662 CO -0.15 0.11 0.47 0.93 0.23 0.00 0.00 176.91 178.50 1mmv h GLU 663 N 0.18 1.23 0.05 0.39 5.08 -0.75 0.76 114.58 121.51 1mmv h GLU 663 Ca 0.12 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1mmv h GLU 663 Cb 0.10 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1mmv h GLU 663 CO -0.14 0.91 -0.02 -0.91 -1.00 0.00 0.00 179.01 177.85 1mmv h ASN 664 N 1.23 -0.05 -0.65 1.42 2.35 -0.48 -2.53 115.58 116.86 1mmv h ASN 664 Ca 0.31 -0.17 0.05 0.00 -0.55 0.00 0.00 56.30 55.93 1mmv h ASN 664 Cb 0.05 0.01 -0.05 0.00 0.05 0.00 0.00 38.32 38.38 1mmv h ASN 664 CO -0.05 0.14 0.37 -0.33 -1.65 0.00 0.00 177.43 175.92 1mmv h GLU 665 N -0.25 0.69 -0.93 0.81 4.39 -0.36 -1.09 114.58 117.84 1mmv h GLU 665 Ca -0.01 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1mmv h GLU 665 Cb 0.22 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 1mmv h GLU 665 CO 0.01 0.46 0.55 1.88 -1.16 0.00 0.00 179.01 180.74 1mmv h TYR 666 N 0.71 1.23 0.00 4.33 -1.99 -0.76 0.30 116.97 120.80 1mmv h TYR 666 Ca 0.28 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.00 1mmv h TYR 666 Cb 0.12 -0.40 0.00 0.00 2.00 0.00 0.00 36.73 38.45 1mmv h TYR 666 CO -0.07 0.83 -0.32 2.89 -0.00 0.00 0.00 178.16 181.49 1mmv n ARG 667 N -4.35 0.25 -0.01 4.88 1.85 -0.96 -1.69 116.66 116.63 1mmv n ARG 667 Ca 0.10 0.13 0.05 0.00 -1.00 0.00 0.00 57.85 57.13 1mmv n ARG 667 Cb 0.07 -1.71 -0.08 0.00 -1.05 0.00 0.00 32.46 29.69 1mmv n ARG 667 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1mmv n ARG 669 N -1.86 1.86 -0.67 0.00 0.63 1.00 -5.01 116.66 112.60 1mmv n ARG 669 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1mmv n ARG 669 Cb 0.27 -0.84 0.00 0.00 0.45 0.00 0.00 32.46 32.35 1mmv n ARG 669 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1mmv n GLY 670 N 1.74 0.63 0.00 5.14 0.00 -0.68 -4.47 105.19 107.54 1mmv n GLY 670 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1mmv n GLY 670 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mmv n GLY 671 N -2.55 0.95 3.11 -0.02 0.00 -1.17 -0.72 105.19 104.80 1mmv n GLY 671 Ca 0.00 -1.34 0.02 0.00 0.00 0.00 0.00 46.02 44.70 1mmv n GLY 671 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mmv s PRO 673 N 2.80 4.16 -0.08 0.00 0.04 -1.26 -4.67 135.00 135.98 1mmv s PRO 673 Ca 0.13 2.50 -0.06 0.00 0.04 0.00 0.00 61.00 63.61 1mmv s PRO 673 Cb -0.12 -3.10 0.03 0.00 0.04 0.00 0.00 34.50 31.35 1mmv s PRO 673 CO -0.25 -0.67 0.21 0.00 0.04 0.00 0.00 177.00 176.33 1mmv s ALA 674 N 0.97 -0.50 -0.63 8.56 0.00 -0.52 -4.16 121.76 125.49 1mmv s ALA 674 Ca 0.71 0.71 -0.15 0.00 0.00 0.00 0.00 51.96 53.23 1mmv s ALA 674 Cb -0.47 -0.43 0.16 0.00 0.00 0.00 0.00 23.12 22.38 1mmv s ALA 674 CO 0.34 -0.13 0.58 0.34 0.00 0.00 0.00 175.76 176.89 1mmv s ASP 675 N 0.52 6.33 0.25 0.00 -1.08 0.14 -3.48 116.67 119.34 1mmv s ASP 675 Ca -0.03 -2.12 -0.04 0.00 -0.52 0.00 0.00 52.55 49.83 1mmv s ASP 675 Cb -0.05 -2.19 0.49 0.00 -1.46 0.00 0.00 42.92 39.71 1mmv s ASP 675 CO -0.03 -0.74 1.68 -0.25 0.52 0.00 0.00 175.17 176.35 1mmv h TRP 676 N 8.45 0.29 -0.88 -5.34 7.01 -1.90 0.13 115.95 123.70 1mmv h TRP 676 Ca -0.15 0.04 0.15 0.00 2.11 0.00 0.00 58.89 61.04 1mmv h TRP 676 Cb 1.08 -0.01 -0.07 0.00 -2.10 0.00 0.00 29.16 28.06 1mmv h TRP 676 CO 0.82 -0.09 0.57 0.28 -2.79 0.00 0.00 178.44 177.23 1mmv h VAL 677 N 0.27 0.81 0.00 2.65 2.07 -1.92 -1.87 116.25 118.25 1mmv h VAL 677 Ca 0.43 -0.22 -0.25 0.00 0.82 0.00 0.00 66.70 67.48 1mmv h VAL 677 Cb 0.74 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1mmv h VAL 677 CO -0.52 0.12 -1.83 0.79 0.02 0.00 0.00 177.57 176.14 1mmv n TRP 678 N -4.56 0.63 -0.07 1.57 7.02 -0.38 -4.43 117.44 117.22 1mmv n TRP 678 Ca 0.18 0.22 -0.14 0.00 -1.02 0.00 0.00 57.50 56.73 1mmv n TRP 678 Cb 0.51 -1.05 -0.03 0.00 -2.42 0.00 0.00 31.31 28.32 1mmv n TRP 678 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1mmv h ILE 679 N 0.00 1.28 -2.90 -0.99 1.08 -0.31 -3.44 117.51 112.23 1mmv h ILE 679 Ca -0.30 -1.72 -0.54 0.00 -0.39 0.00 0.00 64.86 61.91 1mmv h ILE 679 Cb 1.86 1.62 -0.00 0.00 -3.07 0.00 0.00 36.82 37.22 1mmv h ILE 679 CO 0.05 0.56 0.84 -0.69 -0.69 0.00 0.00 178.15 178.22 1mmv s VAL 680 N -4.14 3.73 0.68 1.67 1.01 -0.75 -4.93 120.40 117.67 1mmv s VAL 680 Ca -0.10 1.10 -0.17 0.00 0.00 0.00 0.00 61.98 62.81 1mmv s VAL 680 Cb 0.10 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1mmv s VAL 680 CO 0.89 -0.01 0.90 -2.65 0.00 0.00 0.00 175.10 174.23 1mmv n PRO 681 N 5.47 0.60 0.00 2.72 -0.02 -1.26 -4.88 135.00 137.63 1mmv n PRO 681 Ca 0.13 0.25 0.08 0.00 -2.02 0.00 0.00 63.50 61.94 1mmv n PRO 681 Cb 0.44 -2.15 0.43 0.00 -0.02 0.00 0.00 33.50 32.20 1mmv n PRO 681 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1mmv n PRO 682 N -1.43 0.40 -3.87 0.52 -0.02 -1.26 -4.27 135.00 125.08 1mmv n PRO 682 Ca 0.13 0.05 -0.11 0.00 -2.02 0.00 0.00 63.50 61.55 1mmv n PRO 682 Cb 0.49 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.38 1mmv n PRO 682 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mmv s MET 683 N -2.18 0.59 -1.03 -0.52 0.23 -1.26 -4.90 119.30 110.24 1mmv s MET 683 Ca 0.20 -0.54 -0.01 0.00 -1.03 0.00 0.00 55.69 54.31 1mmv s MET 683 Cb 0.10 0.25 0.01 0.00 -1.53 0.00 0.00 34.83 33.65 1mmv s MET 683 CO 0.19 -0.16 0.04 0.43 -2.03 0.00 0.00 175.02 173.50 1mmv n SER 684 N 1.02 -3.78 -0.31 -1.18 7.64 -1.26 -4.87 113.62 110.87 1mmv n SER 684 Ca -0.20 0.16 -0.08 0.00 1.01 0.00 0.00 58.87 59.75 1mmv n SER 684 Cb 0.57 -3.21 -0.07 0.00 -1.01 0.00 0.00 64.21 60.48 1mmv n SER 684 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mmv n GLY 685 N -0.83 -2.13 0.00 0.23 0.00 -1.26 -1.41 105.19 99.79 1mmv n GLY 685 Ca -0.13 0.92 0.09 0.00 0.00 0.00 0.00 46.02 46.91 1mmv n GLY 685 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mmv n SER 686 N -4.84 0.00 -0.74 1.61 3.41 -1.26 -2.35 113.62 109.45 1mmv n SER 686 Ca 0.01 0.15 0.12 0.00 -0.26 0.00 0.00 58.87 58.90 1mmv n SER 686 Cb 0.19 -0.35 0.33 0.00 -0.26 0.00 0.00 64.21 64.12 1mmv n SER 686 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1mmv n ILE 687 N -1.35 0.17 -4.04 -1.33 -5.35 -0.50 -4.81 119.36 102.15 1mmv n ILE 687 Ca 0.08 -0.43 -0.31 0.00 -0.27 0.00 0.00 62.75 61.82 1mmv n ILE 687 Cb 0.17 0.76 -0.06 0.00 -1.74 0.00 0.00 39.64 38.77 1mmv n ILE 687 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1mmv s THR 688 N -1.83 4.70 0.34 7.28 -4.23 -0.99 -5.04 115.64 115.88 1mmv s THR 688 Ca 0.34 -0.62 0.05 0.00 -1.18 0.00 0.00 61.69 60.29 1mmv s THR 688 Cb 0.20 -3.24 0.15 0.00 1.34 0.00 0.00 72.50 70.95 1mmv s THR 688 CO 0.30 0.19 1.87 1.55 -0.54 0.00 0.00 174.62 177.98 1mmv h PRO 689 N 3.48 0.45 -0.08 3.99 0.13 -1.87 -3.08 132.00 135.02 1mmv h PRO 689 Ca -0.47 -0.11 0.02 0.00 -0.87 0.00 0.00 66.00 64.58 1mmv h PRO 689 Cb 1.17 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1mmv h PRO 689 CO 0.66 0.53 0.07 -0.39 -0.23 0.00 0.00 178.00 178.64 1mmv h VAL 690 N 0.43 0.73 -1.00 1.56 -1.51 -1.89 -1.66 116.25 112.92 1mmv h VAL 690 Ca 0.09 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.60 1mmv h VAL 690 Cb 0.38 0.95 -0.06 0.00 -2.13 0.00 0.00 31.29 30.43 1mmv h VAL 690 CO 0.02 0.00 0.65 0.15 -1.23 0.00 0.00 177.57 177.16 1mmv h PHE 691 N 0.00 1.22 -0.19 5.19 3.57 -1.73 -1.59 116.94 123.41 1mmv h PHE 691 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1mmv h PHE 691 Cb 0.18 -0.41 0.00 0.00 2.79 0.00 0.00 35.95 38.51 1mmv h PHE 691 CO 0.00 0.69 0.00 0.72 -2.23 0.00 0.00 178.31 177.49 1mmv n HIS 692 N -4.45 0.25 -3.54 0.41 8.25 -0.63 -4.82 115.22 110.68 1mmv n HIS 692 Ca 0.14 -0.12 -0.40 0.00 -0.26 0.00 0.00 57.72 57.07 1mmv n HIS 692 Cb 0.12 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.12 1mmv n HIS 692 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1mmv s GLN 693 N -1.75 3.45 0.40 -0.41 2.00 -0.60 -0.80 119.66 121.94 1mmv s GLN 693 Ca 0.30 -0.67 -0.26 0.00 -2.00 0.00 0.00 55.36 52.73 1mmv s GLN 693 Cb 0.16 -3.79 -0.09 0.00 0.80 0.00 0.00 33.01 30.10 1mmv s GLN 693 CO 0.24 -0.46 1.25 -1.21 -0.50 0.00 0.00 175.29 174.61 1mmv s GLU 694 N 1.71 4.03 0.04 1.67 2.02 -0.67 -4.98 118.70 122.51 1mmv s GLU 694 Ca 0.06 2.03 0.03 0.00 0.02 0.00 0.00 54.97 57.11 1mmv s GLU 694 Cb -0.17 -2.75 -0.02 0.00 0.10 0.00 0.00 34.13 31.28 1mmv s GLU 694 CO 0.10 -0.40 -0.09 -1.64 0.02 0.00 0.00 175.26 173.25 1mmv s MET 695 N -2.22 0.60 -0.19 1.61 -1.94 -1.26 -4.65 119.30 111.25 1mmv s MET 695 Ca 0.56 -0.73 -0.04 0.00 -1.71 0.00 0.00 55.69 53.77 1mmv s MET 695 Cb -0.35 -0.45 -0.02 0.00 2.01 0.00 0.00 34.83 36.02 1mmv s MET 695 CO 0.45 0.09 -0.04 -0.51 -0.01 0.00 0.00 175.02 175.01 1mmv s LEU 696 N -1.43 3.05 -0.16 -0.03 1.43 -1.26 -4.90 118.68 115.38 1mmv s LEU 696 Ca -0.07 -0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1mmv s LEU 696 Cb -0.09 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 1mmv s LEU 696 CO 0.01 0.06 0.03 0.21 0.23 0.00 0.00 176.35 176.89 1mmv s ASN 697 N 1.03 5.41 0.06 2.29 3.04 -1.23 -1.44 114.94 124.11 1mmv s ASN 697 Ca 0.01 0.05 -0.26 0.00 0.04 0.00 0.00 52.86 52.69 1mmv s ASN 697 Cb -0.15 -1.88 0.08 0.00 -1.54 0.00 0.00 41.25 37.77 1mmv s ASN 697 CO 0.01 0.20 0.69 -0.72 -3.04 0.00 0.00 177.10 174.23 1mmv s TYR 698 N 0.20 -0.53 -0.22 0.43 -0.85 -1.26 -4.96 117.35 110.16 1mmv s TYR 698 Ca 0.02 0.52 -0.13 0.00 -0.52 0.00 0.00 57.07 56.97 1mmv s TYR 698 Cb -0.13 0.51 -0.05 0.00 0.38 0.00 0.00 41.96 42.68 1mmv s TYR 698 CO 0.01 -0.71 0.25 1.03 -1.52 0.00 0.00 175.55 174.61 1mmv s ARG 699 N -2.89 4.11 0.16 -3.49 0.52 -1.26 -4.81 118.95 111.29 1mmv s ARG 699 Ca -0.01 -0.09 0.11 0.00 -0.52 0.00 0.00 55.73 55.22 1mmv s ARG 699 Cb -0.01 -3.54 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1mmv s ARG 699 CO -0.06 0.03 -0.25 -0.51 0.02 0.00 0.00 175.30 174.53 1mmv s LEU 700 N 1.14 2.38 0.18 2.53 1.43 -1.26 -2.96 118.68 122.11 1mmv s LEU 700 Ca 0.12 -0.81 0.09 0.00 -1.03 0.00 0.00 54.13 52.51 1mmv s LEU 700 Cb -0.14 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 1mmv s LEU 700 CO 0.06 0.13 -0.12 0.42 0.23 0.00 0.00 176.35 177.06 1mmv s THR 701 N -1.41 3.03 0.82 5.49 -4.23 -1.26 -4.19 115.64 113.89 1mmv s THR 701 Ca 0.17 -1.71 -0.13 0.00 -1.18 0.00 0.00 61.69 58.83 1mmv s THR 701 Cb -0.09 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.35 1mmv s THR 701 CO 0.08 -0.10 1.16 -2.65 -0.54 0.00 0.00 174.62 172.56 1mmv n PRO 702 N 0.12 0.14 -3.87 3.99 -0.02 -1.26 -5.01 135.00 129.08 1mmv n PRO 702 Ca -0.11 0.12 -0.09 0.00 -2.02 0.00 0.00 63.50 61.40 1mmv n PRO 702 Cb 0.55 -2.40 -0.05 0.00 -0.02 0.00 0.00 33.50 31.58 1mmv n PRO 702 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1mmv s SER 703 N -2.12 -0.11 -0.19 2.55 1.04 -0.91 -3.93 113.70 110.03 1mmv s SER 703 Ca 0.72 -0.71 -0.07 0.00 0.48 0.00 0.00 55.95 56.37 1mmv s SER 703 Cb -0.29 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1mmv s SER 703 CO 0.52 -1.01 0.06 -0.36 0.98 0.00 0.00 173.24 173.44 1mmv s PHE 704 N -3.94 3.22 0.32 5.02 0.40 -1.26 -1.06 117.98 120.68 1mmv s PHE 704 Ca 0.15 0.01 0.09 0.00 -0.60 0.00 0.00 56.93 56.58 1mmv s PHE 704 Cb 0.01 -2.10 -0.06 0.00 0.51 0.00 0.00 43.02 41.37 1mmv s PHE 704 CO 0.00 0.08 -0.10 -1.21 0.70 0.00 0.00 175.22 174.69 1mmv s GLU 705 N 0.56 1.72 0.56 0.44 0.41 0.15 -4.92 118.70 117.62 1mmv s GLU 705 Ca 0.03 -1.87 -0.06 0.00 -0.41 0.00 0.00 54.97 52.66 1mmv s GLU 705 Cb -0.13 -1.57 -0.01 0.00 -1.78 0.00 0.00 34.13 30.65 1mmv s GLU 705 CO 0.01 0.14 0.87 0.71 -0.49 0.00 0.00 175.26 176.50 1mmv s TYR 706 N -2.70 3.37 0.01 1.61 1.51 -1.26 -0.46 117.35 119.42 1mmv s TYR 706 Ca 0.31 0.73 -0.18 0.00 -1.01 0.00 0.00 57.07 56.92 1mmv s TYR 706 Cb 0.02 -2.60 0.03 0.00 -0.11 0.00 0.00 41.96 39.30 1mmv s TYR 706 CO 0.15 -0.65 0.40 1.14 -1.11 0.00 0.00 175.55 175.48 1mmv s GLN 707 N -4.92 0.83 0.44 -0.62 -2.07 -1.26 -4.72 119.66 107.34 1mmv s GLN 707 Ca 0.52 -0.22 -0.25 0.00 -1.82 0.00 0.00 55.36 53.60 1mmv s GLN 707 Cb -0.10 0.37 -0.09 0.00 -1.09 0.00 0.00 33.01 32.10 1mmv s GLN 707 CO 0.45 -0.26 1.22 -2.30 -1.32 0.00 0.00 175.29 173.08 1mmv n PRO 708 N 0.87 1.77 -1.80 9.60 -0.02 -1.26 -4.90 135.00 139.26 1mmv n PRO 708 Ca -0.20 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.51 1mmv n PRO 708 Cb 0.58 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1mmv n PRO 708 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1mmv s ASP 709 N -0.63 6.24 0.35 2.55 1.01 -1.26 -4.88 116.67 120.05 1mmv s ASP 709 Ca 0.63 3.02 0.05 0.00 0.71 0.00 0.00 52.55 56.96 1mmv s ASP 709 Cb -0.51 -2.67 0.69 0.00 1.01 0.00 0.00 42.92 41.45 1mmv s ASP 709 CO 0.57 -0.94 1.95 1.55 0.21 0.00 0.00 175.17 178.51 1mmv h PRO 710 N 2.86 0.79 0.00 8.23 0.13 -1.91 -2.42 132.00 139.68 1mmv h PRO 710 Ca -0.51 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1mmv h PRO 710 Cb 1.24 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1mmv h PRO 710 CO 0.63 0.52 0.00 -2.67 -0.23 0.00 0.00 178.00 176.26 1mmv n TRP 711 N -4.48 0.00 0.91 1.56 2.14 -1.26 0.17 117.44 116.48 1mmv n TRP 711 Ca 0.11 0.00 0.10 0.00 2.07 0.00 0.00 57.50 59.78 1mmv n TRP 711 Cb 0.22 -0.36 -0.00 0.00 -0.81 0.00 0.00 31.31 30.36 1mmv n TRP 711 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 1mmv n ASN 712 N -1.36 1.93 0.00 -0.67 3.02 -0.91 -4.54 115.26 112.74 1mmv n ASN 712 Ca 0.03 -1.47 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 1mmv n ASN 712 Cb 0.07 0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 1mmv n ASN 712 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1mmv n THR 713 N -0.02 0.00 -2.02 3.41 -1.04 -0.22 -5.06 114.28 109.33 1mmv n THR 713 Ca 0.09 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.67 1mmv n THR 713 Cb 0.43 0.27 -0.02 0.00 -1.82 0.00 0.00 70.33 69.19 1mmv n THR 713 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1mmv s HIS 714 N -0.93 2.97 -0.71 -1.42 5.04 0.13 -4.98 115.29 115.39 1mmv s HIS 714 Ca 0.00 1.18 -0.07 0.00 -1.54 0.00 0.00 55.06 54.63 1mmv s HIS 714 Cb 0.00 -3.80 0.19 0.00 0.04 0.00 0.00 32.58 29.01 1mmv s HIS 714 CO 0.00 -2.42 0.58 0.14 -2.34 0.00 0.00 174.74 170.70 1mmv s VAL 715 N -0.56 4.51 -1.05 0.89 -7.23 -1.26 -5.00 120.40 110.70 1mmv s VAL 715 Ca 0.55 -2.76 0.00 0.00 -1.81 0.00 0.00 61.98 57.95 1mmv s VAL 715 Cb -0.42 -3.86 0.00 0.00 0.56 0.00 0.00 36.38 32.66 1mmv s VAL 715 CO 0.49 -0.94 0.26 0.79 -0.31 0.00 0.00 175.10 175.40