#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h73 n PRO 318 N 0.00 0.85 -1.97 3.23 -0.04 -1.26 -4.91 135.00 130.89 3h73 n PRO 318 Ca 0.00 0.35 -0.41 0.00 -0.04 0.00 0.00 63.50 63.39 3h73 n PRO 318 Cb 0.00 -2.41 -0.02 0.00 -0.04 0.00 0.00 33.50 31.03 3h73 n PRO 318 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3h73 s GLU 319 N -3.37 4.24 0.00 0.54 0.41 -1.26 -2.27 118.70 116.99 3h73 s GLU 319 Ca 0.79 2.35 0.00 0.00 -0.41 0.00 0.00 54.97 57.70 3h73 s GLU 319 Cb -0.37 -3.09 0.00 0.00 -1.78 0.00 0.00 34.13 28.90 3h73 s GLU 319 CO 0.44 -0.44 0.00 0.41 -0.49 0.00 0.00 175.26 175.18 3h73 n GLY 320 N 2.00 2.87 3.77 -1.39 0.00 -1.26 -5.03 105.19 106.15 3h73 n GLY 320 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3h73 n GLY 320 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h73 s ALA 321 N -2.13 3.19 -0.00 4.61 0.00 -0.96 -4.68 121.76 121.78 3h73 s ALA 321 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.83 3h73 s ALA 321 Cb 0.00 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.79 3h73 s ALA 321 CO 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 175.76 175.42 3h73 s ALA 322 N -1.43 0.04 -0.26 0.00 0.00 -1.26 -4.86 121.76 113.98 3h73 s ALA 322 Ca 0.54 0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.55 3h73 s ALA 322 Cb -0.28 -0.06 0.13 0.00 0.00 0.00 0.00 23.12 22.91 3h73 s ALA 322 CO 0.36 -0.02 0.34 -1.17 0.00 0.00 0.00 175.76 175.27 3h73 s LEU 323 N 0.23 -0.50 0.98 0.00 2.96 -1.26 -2.63 118.68 118.46 3h73 s LEU 323 Ca -0.02 -0.22 -0.12 0.00 -0.22 0.00 0.00 54.13 53.55 3h73 s LEU 323 Cb -0.03 0.86 0.12 0.00 0.50 0.00 0.00 46.19 47.65 3h73 s LEU 323 CO -0.01 -0.34 0.79 0.35 -1.32 0.00 0.00 176.35 175.83 3h73 n THR 324 N 5.34 0.00 -2.05 3.68 -2.24 -0.36 -4.96 114.28 113.70 3h73 n THR 324 Ca -0.02 -0.14 -0.32 0.00 -2.27 0.00 0.00 64.05 61.29 3h73 n THR 324 Cb 0.49 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 3h73 n THR 324 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3h73 s GLU 325 N -4.18 3.52 -0.03 -0.78 2.12 -1.26 -4.65 118.70 113.45 3h73 s GLU 325 Ca 0.63 0.99 -0.34 0.00 0.36 0.00 0.00 54.97 56.61 3h73 s GLU 325 Cb -0.22 -2.07 -0.12 0.00 0.26 0.00 0.00 34.13 31.98 3h73 s GLU 325 CO 0.63 -0.63 1.84 1.17 -0.54 0.00 0.00 175.26 177.73 3h73 n LYS 326 N -2.21 2.26 -3.97 4.30 4.81 -1.26 -4.78 118.16 117.31 3h73 n LYS 326 Ca 0.07 0.83 -0.34 0.00 -0.87 0.00 0.00 58.31 58.00 3h73 n LYS 326 Cb 0.54 -2.67 -0.14 0.00 0.02 0.00 0.00 35.03 32.77 3h73 n LYS 326 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3h73 s THR 327 N 3.57 2.86 -0.10 3.15 2.01 -0.68 -4.95 115.64 121.49 3h73 s THR 327 Ca 0.90 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 61.63 3h73 s THR 327 Cb -0.66 -2.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.41 3h73 s THR 327 CO 0.48 0.24 1.01 -1.81 -0.69 0.00 0.00 174.62 173.85 3h73 s ASP 328 N 1.33 7.25 -0.25 3.53 1.01 -1.26 0.87 116.67 129.15 3h73 s ASP 328 Ca 0.01 1.54 -0.07 0.00 0.71 0.00 0.00 52.55 54.74 3h73 s ASP 328 Cb -0.16 -2.56 -0.16 0.00 1.01 0.00 0.00 42.92 41.05 3h73 s ASP 328 CO -0.05 -0.44 -0.18 -0.38 0.21 0.00 0.00 175.17 174.33 3h73 n ILE 329 N 4.53 1.54 -3.93 0.77 2.08 0.24 -4.84 119.36 119.75 3h73 n ILE 329 Ca 0.09 -0.47 -0.30 0.00 0.56 0.00 0.00 62.75 62.62 3h73 n ILE 329 Cb 0.49 -1.67 -0.15 0.00 -0.75 0.00 0.00 39.64 37.55 3h73 n ILE 329 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 3h73 s PHE 330 N -2.51 2.53 -0.22 1.39 0.08 -0.83 -5.01 117.98 113.41 3h73 s PHE 330 Ca -0.35 -1.94 -0.19 0.00 0.12 0.00 0.00 56.93 54.57 3h73 s PHE 330 Cb 0.11 -1.79 -0.03 0.00 -0.57 0.00 0.00 43.02 40.74 3h73 s PHE 330 CO 0.58 -0.81 0.56 -1.21 -0.10 0.00 0.00 175.22 174.24 3h73 s GLU 331 N 1.35 4.17 0.71 0.44 2.02 -1.26 -1.18 118.70 124.93 3h73 s GLU 331 Ca -0.02 0.47 -0.09 0.00 0.02 0.00 0.00 54.97 55.36 3h73 s GLU 331 Cb -0.19 -3.59 0.05 0.00 0.10 0.00 0.00 34.13 30.50 3h73 s GLU 331 CO -0.09 -0.24 1.04 -1.54 0.02 0.00 0.00 175.26 174.46 3h73 s SER 332 N 1.27 5.01 1.09 -0.19 1.04 -1.26 -4.87 113.70 115.79 3h73 s SER 332 Ca 0.25 0.70 -0.12 0.00 0.48 0.00 0.00 55.95 57.26 3h73 s SER 332 Cb -0.16 -1.40 0.17 0.00 0.10 0.00 0.00 66.02 64.73 3h73 s SER 332 CO 0.10 -1.52 0.75 0.61 0.98 0.00 0.00 173.24 174.15 3h73 n GLY 333 N -2.96 -2.14 3.19 7.32 0.00 -0.20 -4.69 105.19 105.72 3h73 n GLY 333 Ca 0.07 -1.56 -0.22 0.00 0.00 0.00 0.00 46.02 44.31 3h73 n GLY 333 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h73 s ARG 334 N -4.66 1.04 -1.40 1.61 0.52 -1.15 -0.01 118.95 114.88 3h73 s ARG 334 Ca 0.46 -0.88 -0.08 0.00 -0.52 0.00 0.00 55.73 54.70 3h73 s ARG 334 Cb -0.03 -1.11 0.05 0.00 0.52 0.00 0.00 34.95 34.37 3h73 s ARG 334 CO 0.34 0.27 0.58 0.09 0.02 0.00 0.00 175.30 176.60 3h73 n ASN 335 N 1.68 -4.75 0.00 0.23 3.02 0.74 -1.10 115.26 115.08 3h73 n ASN 335 Ca -0.19 -0.38 0.00 0.00 -0.03 0.00 0.00 54.58 53.99 3h73 n ASN 335 Cb 0.54 -3.87 0.00 0.00 -0.61 0.00 0.00 39.78 35.84 3h73 n ASN 335 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h73 n GLY 336 N -1.35 0.47 3.84 7.41 0.00 -1.26 -5.04 105.19 109.26 3h73 n GLY 336 Ca -0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 3h73 n GLY 336 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h73 s LYS 337 N -0.17 3.03 0.71 1.61 1.02 -0.26 -5.08 119.74 120.61 3h73 s LYS 337 Ca 0.00 -0.88 -0.12 0.00 0.02 0.00 0.00 55.97 54.99 3h73 s LYS 337 Cb 0.00 -2.69 0.03 0.00 -0.52 0.00 0.00 37.83 34.65 3h73 s LYS 337 CO 0.00 0.46 1.09 -2.14 -0.92 0.00 0.00 175.35 173.84 3h73 s PRO 338 N -3.42 2.59 0.24 -1.68 0.02 -1.26 -2.96 135.00 128.53 3h73 s PRO 338 Ca 0.32 1.22 -0.03 0.00 0.02 0.00 0.00 61.00 62.53 3h73 s PRO 338 Cb -0.09 -1.93 0.05 0.00 0.02 0.00 0.00 34.50 32.54 3h73 s PRO 338 CO 0.25 -1.39 0.33 0.27 -0.33 0.00 0.00 177.00 176.13 3h73 n ASN 339 N -3.01 0.13 0.31 2.53 2.04 0.73 -4.65 115.26 113.35 3h73 n ASN 339 Ca 0.09 -1.19 0.19 0.00 -0.44 0.00 0.00 54.58 53.24 3h73 n ASN 339 Cb 0.53 -0.24 1.05 0.00 -2.53 0.00 0.00 39.78 38.58 3h73 n ASN 339 CO 0.00 0.00 0.00 0.07 -0.44 0.00 0.00 177.26 176.89 3h73 h LYS 340 N 0.00 0.00 -0.19 -3.83 2.10 -1.92 0.43 116.57 113.16 3h73 h LYS 340 Ca -0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 3h73 h LYS 340 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 3h73 h LYS 340 CO 0.09 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.29 3h73 n ASP 341 N -3.42 2.72 0.00 7.07 8.00 -1.26 -4.93 116.55 124.72 3h73 n ASP 341 Ca -0.02 -1.88 0.00 0.00 0.71 0.00 0.00 54.79 53.60 3h73 n ASP 341 Cb 0.12 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 3h73 n ASP 341 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h73 n GLY 342 N 1.35 0.46 3.55 0.44 0.00 0.14 -5.04 105.19 106.09 3h73 n GLY 342 Ca 0.17 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 3h73 n GLY 342 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h73 s ILE 343 N -2.00 4.20 -0.06 -0.61 -1.09 -1.26 -4.71 121.20 115.67 3h73 s ILE 343 Ca 0.00 -0.25 -0.16 0.00 -2.23 0.00 0.00 60.65 58.01 3h73 s ILE 343 Cb 0.00 -2.86 -0.30 0.00 -1.58 0.00 0.00 42.46 37.72 3h73 s ILE 343 CO 0.00 0.49 0.72 0.11 -1.23 0.00 0.00 174.94 175.03 3h73 h LYS 344 N 6.66 0.33 -4.33 2.79 1.57 -1.35 0.21 116.57 122.45 3h73 h LYS 344 Ca -0.33 -0.57 -0.18 0.00 -1.87 0.00 0.00 60.65 57.69 3h73 h LYS 344 Cb 1.18 0.21 -0.17 0.00 0.08 0.00 0.00 32.23 33.53 3h73 h LYS 344 CO 0.65 1.27 -0.70 0.45 -0.57 0.00 0.00 179.45 180.56 3h73 s SER 345 N -7.16 0.65 -0.00 0.86 0.15 -0.32 -1.03 113.70 106.85 3h73 s SER 345 Ca -0.16 -0.81 0.03 0.00 0.70 0.00 0.00 55.95 55.70 3h73 s SER 345 Cb 0.04 0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.46 3h73 s SER 345 CO 0.83 -0.43 -0.08 -0.31 1.20 0.00 0.00 173.24 174.44 3h73 s TYR 346 N -2.87 0.75 0.28 3.44 2.02 -1.12 -0.91 117.35 118.94 3h73 s TYR 346 Ca 0.00 -0.17 -0.14 0.00 -0.37 0.00 0.00 57.07 56.39 3h73 s TYR 346 Cb 0.00 -0.48 0.01 0.00 -0.40 0.00 0.00 41.96 41.09 3h73 s TYR 346 CO -0.05 -0.01 0.57 1.03 -1.57 0.00 0.00 175.55 175.51 3h73 s ARG 347 N -0.34 1.71 -0.74 -0.62 0.52 -0.87 -0.65 118.95 117.97 3h73 s ARG 347 Ca 0.02 -1.26 -0.00 0.00 -0.52 0.00 0.00 55.73 53.97 3h73 s ARG 347 Cb -0.04 0.52 0.00 0.00 0.52 0.00 0.00 34.95 35.95 3h73 s ARG 347 CO -0.00 -0.74 0.69 -0.89 0.02 0.00 0.00 175.30 174.38 3h73 n ILE 348 N -0.43 -9.95 -2.27 1.52 2.08 -1.26 0.17 119.36 109.22 3h73 n ILE 348 Ca -0.03 -0.20 -0.35 0.00 0.56 0.00 0.00 62.75 62.73 3h73 n ILE 348 Cb 0.61 -6.80 0.00 0.00 -0.75 0.00 0.00 39.64 32.70 3h73 n ILE 348 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 3h73 s PRO 349 N -3.06 3.37 -0.08 0.38 0.04 -1.26 -4.06 135.00 130.33 3h73 s PRO 349 Ca 0.01 1.59 -0.03 0.00 0.04 0.00 0.00 61.00 62.60 3h73 s PRO 349 Cb -0.00 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.57 3h73 s PRO 349 CO 0.76 -0.83 0.16 0.00 0.04 0.00 0.00 177.00 177.13 3h73 s ALA 350 N -1.80 -0.22 -0.10 8.56 0.00 -0.50 -4.24 121.76 123.46 3h73 s ALA 350 Ca 0.72 0.63 0.02 0.00 0.00 0.00 0.00 51.96 53.33 3h73 s ALA 350 Cb -0.23 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 3h73 s ALA 350 CO 0.27 -0.40 -0.18 -1.17 0.00 0.00 0.00 175.76 174.28 3h73 s LEU 351 N 1.85 2.47 -0.04 0.00 2.96 -1.26 0.27 118.68 124.92 3h73 s LEU 351 Ca -0.02 -0.39 -0.00 0.00 -0.22 0.00 0.00 54.13 53.50 3h73 s LEU 351 Cb -0.12 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 45.08 3h73 s LEU 351 CO -0.06 0.20 0.00 -0.22 -1.32 0.00 0.00 176.35 174.95 3h73 s LEU 352 N 0.11 0.91 -0.35 -0.68 2.96 0.17 -4.73 118.68 117.07 3h73 s LEU 352 Ca -0.09 -0.04 -0.16 0.00 -0.22 0.00 0.00 54.13 53.63 3h73 s LEU 352 Cb -0.15 -0.30 -0.01 0.00 0.50 0.00 0.00 46.19 46.23 3h73 s LEU 352 CO 0.05 -0.14 0.38 -0.75 -1.32 0.00 0.00 176.35 174.58 3h73 s LYS 353 N 1.39 3.52 0.65 1.98 2.47 -1.26 -0.36 119.74 128.13 3h73 s LYS 353 Ca -0.04 -0.43 -0.07 0.00 -1.56 0.00 0.00 55.97 53.86 3h73 s LYS 353 Cb -0.13 -3.82 0.03 0.00 -1.46 0.00 0.00 37.83 32.44 3h73 s LYS 353 CO -0.03 -0.57 0.98 0.95 0.16 0.00 0.00 175.35 176.84 3h73 s THR 354 N 2.06 3.22 0.57 3.43 -4.23 -0.13 -4.93 115.64 115.64 3h73 s THR 354 Ca 0.12 0.03 0.26 0.00 -1.18 0.00 0.00 61.69 60.92 3h73 s THR 354 Cb -0.16 -3.33 0.33 0.00 1.34 0.00 0.00 72.50 70.68 3h73 s THR 354 CO 0.12 -0.37 2.20 -2.24 -0.54 0.00 0.00 174.62 173.79 3h73 h ASP 355 N -0.40 0.00 0.28 3.99 2.03 -1.95 0.25 116.42 120.62 3h73 h ASP 355 Ca -0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 3h73 h ASP 355 Cb 1.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 3h73 h ASP 355 CO 0.61 0.00 -0.00 0.29 -1.03 0.00 0.00 179.24 179.11 3h73 n LYS 356 N -4.04 0.72 -0.25 4.15 5.02 -1.26 -4.88 118.16 117.62 3h73 n LYS 356 Ca -0.02 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3h73 n LYS 356 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 3h73 n LYS 356 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h73 n GLY 357 N 1.15 1.19 3.76 0.72 0.00 0.88 -5.04 105.19 107.86 3h73 n GLY 357 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 3h73 n GLY 357 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h73 s THR 358 N -2.78 2.97 -0.19 2.61 2.01 -1.26 -4.71 115.64 114.31 3h73 s THR 358 Ca 0.00 0.50 -0.03 0.00 0.31 0.00 0.00 61.69 62.47 3h73 s THR 358 Cb 0.00 -3.06 -0.01 0.00 0.01 0.00 0.00 72.50 69.44 3h73 s THR 358 CO 0.00 -0.24 -0.07 -0.76 -0.69 0.00 0.00 174.62 172.86 3h73 s LEU 359 N -4.66 2.86 -0.21 4.42 1.43 -0.02 -0.96 118.68 121.54 3h73 s LEU 359 Ca 0.71 -0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 3h73 s LEU 359 Cb -0.24 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 3h73 s LEU 359 CO 0.39 0.05 -0.03 -0.63 0.23 0.00 0.00 176.35 176.36 3h73 s ILE 360 N 1.03 3.55 -0.27 -0.59 1.01 0.51 -0.91 121.20 125.54 3h73 s ILE 360 Ca 0.00 -0.44 -0.06 0.00 0.00 0.00 0.00 60.65 60.15 3h73 s ILE 360 Cb -0.15 -2.61 0.01 0.00 0.01 0.00 0.00 42.46 39.72 3h73 s ILE 360 CO -0.01 0.43 0.04 0.00 0.00 0.00 0.00 174.94 175.40 3h73 s ALA 361 N 1.24 2.98 0.22 9.38 0.00 -0.28 -0.66 121.76 134.64 3h73 s ALA 361 Ca 0.03 -1.38 0.06 0.00 0.00 0.00 0.00 51.96 50.67 3h73 s ALA 361 Cb -0.14 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.94 3h73 s ALA 361 CO -0.01 -0.79 0.20 0.20 0.00 0.00 0.00 175.76 175.36 3h73 s GLY 362 N 1.48 1.49 0.04 0.00 0.00 0.14 -0.97 107.32 109.50 3h73 s GLY 362 Ca 0.03 -1.33 -0.28 0.00 0.00 0.00 0.00 44.72 43.14 3h73 s GLY 362 CO 0.01 -1.36 1.00 0.00 0.00 0.00 0.00 173.10 172.75 3h73 s ALA 363 N -2.00 -1.84 -0.17 3.20 0.00 -0.55 -1.40 121.76 119.01 3h73 s ALA 363 Ca 0.32 0.67 -0.22 0.00 0.00 0.00 0.00 51.96 52.73 3h73 s ALA 363 Cb -0.09 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.45 3h73 s ALA 363 CO 0.25 -0.87 0.66 -0.51 0.00 0.00 0.00 175.76 175.29 3h73 s ASP 364 N -2.71 6.77 -0.76 0.00 1.11 0.13 -2.34 116.67 118.87 3h73 s ASP 364 Ca 0.10 0.94 -0.16 0.00 0.18 0.00 0.00 52.55 53.61 3h73 s ASP 364 Cb -0.00 -2.37 0.18 0.00 1.07 0.00 0.00 42.92 41.79 3h73 s ASP 364 CO -0.03 -0.25 0.76 -0.70 1.18 0.00 0.00 175.17 176.13 3h73 s GLU 365 N 1.69 3.42 -0.85 8.23 2.12 0.40 -2.04 118.70 131.66 3h73 s GLU 365 Ca 0.31 -2.09 -0.19 0.00 0.36 0.00 0.00 54.97 53.37 3h73 s GLU 365 Cb -0.16 -4.45 0.13 0.00 0.26 0.00 0.00 34.13 29.91 3h73 s GLU 365 CO 0.12 -1.39 1.02 1.03 -0.54 0.00 0.00 175.26 175.50 3h73 s ARG 366 N 1.07 3.49 0.10 4.30 0.52 -0.09 -1.66 118.95 126.68 3h73 s ARG 366 Ca 0.16 -1.71 -0.26 0.00 -0.52 0.00 0.00 55.73 53.41 3h73 s ARG 366 Cb -0.15 -4.71 -0.12 0.00 0.52 0.00 0.00 34.95 30.49 3h73 s ARG 366 CO -0.05 -1.69 1.68 -0.09 0.02 0.00 0.00 175.30 175.17 3h73 h ARG 367 N 8.81 -0.31 0.00 3.54 2.43 -1.71 -0.83 114.38 126.31 3h73 h ARG 367 Ca 0.06 0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.09 3h73 h ARG 367 Cb 1.04 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 3h73 h ARG 367 CO 1.07 -0.21 -1.00 -0.07 -1.51 0.00 0.00 179.97 178.24 3h73 h LEU 368 N -0.33 0.00 -7.87 3.80 3.38 -1.90 -1.59 115.31 110.80 3h73 h LEU 368 Ca 0.01 0.00 0.29 0.00 0.09 0.00 0.00 57.88 58.27 3h73 h LEU 368 Cb 0.32 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 3h73 h LEU 368 CO -0.05 0.65 0.81 -1.38 0.09 0.00 0.00 178.44 178.56 3h73 s HIS 369 N -2.88 0.03 -1.92 1.13 -3.43 -1.25 -4.90 115.29 102.06 3h73 s HIS 369 Ca 0.00 -0.22 0.27 0.00 -0.80 0.00 0.00 55.06 54.32 3h73 s HIS 369 Cb 0.08 0.60 0.97 0.00 -1.43 0.00 0.00 32.58 32.79 3h73 s HIS 369 CO 0.79 -0.44 1.69 0.43 -2.00 0.00 0.00 174.74 175.21 3h73 n SER 370 N -1.04 0.99 -4.68 7.38 7.64 -1.26 -4.57 113.62 118.08 3h73 n SER 370 Ca 0.01 -0.98 -0.30 0.00 1.01 0.00 0.00 58.87 58.61 3h73 n SER 370 Cb 0.59 0.05 0.15 0.00 -1.01 0.00 0.00 64.21 64.00 3h73 n SER 370 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3h73 s SER 371 N -2.36 3.13 -0.46 6.43 0.01 -1.26 -4.89 113.70 114.31 3h73 s SER 371 Ca 0.29 1.83 -0.06 0.00 1.31 0.00 0.00 55.95 59.32 3h73 s SER 371 Cb 0.20 -2.42 -0.13 0.00 0.21 0.00 0.00 66.02 63.88 3h73 s SER 371 CO 0.46 -2.91 3.22 0.47 0.41 0.00 0.00 173.24 174.89 3h73 n ASP 372 N -4.09 6.30 -1.99 2.44 8.00 -1.26 -4.79 116.55 121.17 3h73 n ASP 372 Ca 0.09 -2.73 0.00 0.00 0.71 0.00 0.00 54.79 52.86 3h73 n ASP 372 Cb 0.53 -1.39 0.01 0.00 -0.02 0.00 0.00 41.12 40.25 3h73 n ASP 372 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 3h73 n TRP 373 N 2.19 -0.47 -0.93 1.24 2.14 -1.26 -4.42 117.44 115.93 3h73 n TRP 373 Ca 0.51 -0.35 0.00 0.00 2.07 0.00 0.00 57.50 59.74 3h73 n TRP 373 Cb 0.67 0.16 0.00 0.00 -0.81 0.00 0.00 31.31 31.33 3h73 n TRP 373 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3h73 n GLY 374 N -0.32 -1.10 3.47 -1.67 0.00 -1.25 -4.77 105.19 99.55 3h73 n GLY 374 Ca 0.01 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 3h73 n GLY 374 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h73 s ASP 375 N -4.00 6.23 -0.10 1.61 2.15 -1.26 -4.47 116.67 116.83 3h73 s ASP 375 Ca 0.00 -0.78 0.03 0.00 0.43 0.00 0.00 52.55 52.23 3h73 s ASP 375 Cb 0.00 -2.41 0.01 0.00 -0.30 0.00 0.00 42.92 40.21 3h73 s ASP 375 CO 0.00 -1.33 -0.19 -0.63 -0.17 0.00 0.00 175.17 172.85 3h73 s ILE 376 N 3.92 1.68 -0.06 4.11 1.01 -1.26 -2.71 121.20 127.89 3h73 s ILE 376 Ca 0.24 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 60.09 3h73 s ILE 376 Cb -0.16 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 3h73 s ILE 376 CO 0.13 0.48 0.04 -0.83 0.00 0.00 0.00 174.94 174.76 3h73 s GLY 377 N 0.61 1.94 -0.37 6.18 0.00 -0.66 -4.26 107.32 110.75 3h73 s GLY 377 Ca -0.14 -0.82 -0.22 0.00 0.00 0.00 0.00 44.72 43.54 3h73 s GLY 377 CO 0.04 -0.63 0.71 1.06 0.00 0.00 0.00 173.10 174.28 3h73 s MET 378 N -1.23 3.66 0.20 2.90 1.00 -0.02 -0.45 119.30 125.36 3h73 s MET 378 Ca 0.17 0.12 0.04 0.00 0.00 0.00 0.00 55.69 56.02 3h73 s MET 378 Cb -0.12 -3.83 -0.05 0.00 0.00 0.00 0.00 34.83 30.84 3h73 s MET 378 CO 0.07 -0.83 -0.03 0.14 0.00 0.00 0.00 175.02 174.37 3h73 s VAL 379 N 2.92 1.03 0.08 -6.03 -7.23 -0.99 0.00 120.40 110.18 3h73 s VAL 379 Ca 0.28 -2.04 -0.09 0.00 -1.81 0.00 0.00 61.98 58.32 3h73 s VAL 379 Cb -0.14 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.63 3h73 s VAL 379 CO 0.16 -0.46 0.20 0.27 -0.31 0.00 0.00 175.10 174.96 3h73 s ILE 380 N -3.42 0.13 0.08 -0.62 -5.25 0.40 -1.48 121.20 111.04 3h73 s ILE 380 Ca 0.25 -1.08 0.07 0.00 -0.99 0.00 0.00 60.65 58.89 3h73 s ILE 380 Cb 0.05 -1.22 -0.03 0.00 2.95 0.00 0.00 42.46 44.21 3h73 s ILE 380 CO 0.06 -0.60 -0.17 -0.13 -1.79 0.00 0.00 174.94 172.31 3h73 s ARG 381 N -3.51 1.00 -0.00 0.37 0.52 -0.14 -0.45 118.95 116.74 3h73 s ARG 381 Ca 0.02 -1.02 0.07 0.00 -0.52 0.00 0.00 55.73 54.29 3h73 s ARG 381 Cb 0.03 -1.12 -0.03 0.00 0.52 0.00 0.00 34.95 34.35 3h73 s ARG 381 CO -0.09 0.26 -0.22 1.03 0.02 0.00 0.00 175.30 176.30 3h73 s ARG 382 N -1.69 2.13 -0.08 3.54 0.52 -1.26 -1.13 118.95 120.98 3h73 s ARG 382 Ca 0.03 -0.92 0.02 0.00 -0.52 0.00 0.00 55.73 54.33 3h73 s ARG 382 Cb -0.10 -2.14 0.01 0.00 0.52 0.00 0.00 34.95 33.25 3h73 s ARG 382 CO 0.03 0.56 -0.12 0.45 0.02 0.00 0.00 175.30 176.24 3h73 s SER 383 N -0.94 1.96 0.00 0.23 0.15 -0.09 -0.58 113.70 114.43 3h73 s SER 383 Ca 0.12 -0.32 0.17 0.00 0.70 0.00 0.00 55.95 56.61 3h73 s SER 383 Cb -0.10 -0.88 0.35 0.00 -1.71 0.00 0.00 66.02 63.68 3h73 s SER 383 CO 0.01 0.01 1.26 -0.62 1.20 0.00 0.00 173.24 175.11 3h73 n GLU 384 N 4.04 2.29 -1.77 5.44 1.02 -1.26 -0.84 120.64 129.55 3h73 n GLU 384 Ca -0.21 -2.05 -0.13 0.00 -0.02 0.00 0.00 57.16 54.76 3h73 n GLU 384 Cb 0.51 -1.38 0.07 0.00 -0.02 0.00 0.00 31.44 30.62 3h73 n GLU 384 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3h73 n ASP 385 N 1.02 3.59 -3.34 1.62 5.68 -1.26 -4.94 116.55 118.92 3h73 n ASP 385 Ca 0.15 -3.49 -0.24 0.00 -0.50 0.00 0.00 54.79 50.71 3h73 n ASP 385 Cb 0.49 -0.40 0.05 0.00 -1.14 0.00 0.00 41.12 40.12 3h73 n ASP 385 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3h73 n ASN 386 N -0.73 -6.05 0.00 -1.12 5.15 -1.26 -2.81 115.26 108.43 3h73 n ASN 386 Ca 0.32 -0.43 0.00 0.00 -0.60 0.00 0.00 54.58 53.87 3h73 n ASN 386 Cb 0.89 -4.83 0.00 0.00 -0.53 0.00 0.00 39.78 35.31 3h73 n ASN 386 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h73 n GLY 387 N -1.73 0.69 0.27 8.20 0.00 -1.26 -4.97 105.19 106.38 3h73 n GLY 387 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 3h73 n GLY 387 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3h73 h LYS 388 N 4.16 -0.59 -6.08 1.61 1.63 -1.93 -3.45 116.57 111.91 3h73 h LYS 388 Ca 0.00 0.04 -0.55 0.00 -0.85 0.00 0.00 60.65 59.29 3h73 h LYS 388 Cb 0.00 0.13 -0.18 0.00 -0.60 0.00 0.00 32.23 31.59 3h73 h LYS 388 CO 0.00 -0.29 -0.79 0.95 -3.45 0.00 0.00 179.45 175.87 3h73 s THR 389 N -4.82 1.95 0.03 1.00 -4.23 -1.26 -5.10 115.64 103.20 3h73 s THR 389 Ca -0.14 -1.96 0.04 0.00 -1.18 0.00 0.00 61.69 58.45 3h73 s THR 389 Cb 0.02 -1.92 -0.02 0.00 1.34 0.00 0.00 72.50 71.92 3h73 s THR 389 CO 0.52 -0.28 -0.12 0.26 -0.54 0.00 0.00 174.62 174.45 3h73 s TRP 390 N -1.99 1.08 0.39 3.99 0.52 -1.26 -4.33 118.94 117.34 3h73 s TRP 390 Ca 0.17 -0.33 -0.07 0.00 0.02 0.00 0.00 56.10 55.89 3h73 s TRP 390 Cb -0.06 -0.65 0.09 0.00 -1.15 0.00 0.00 33.47 31.70 3h73 s TRP 390 CO 0.08 0.01 0.54 0.41 0.02 0.00 0.00 176.95 178.00 3h73 n GLY 391 N 2.03 -1.24 3.78 0.98 0.00 0.25 -4.96 105.19 106.03 3h73 n GLY 391 Ca -0.18 -1.69 -0.31 0.00 0.00 0.00 0.00 46.02 43.84 3h73 n GLY 391 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h73 s ASP 392 N -2.96 4.68 0.32 1.61 1.01 -1.26 -4.59 116.67 115.47 3h73 s ASP 392 Ca 0.30 1.65 -0.29 0.00 0.71 0.00 0.00 52.55 54.92 3h73 s ASP 392 Cb -0.01 -2.41 -0.11 0.00 1.01 0.00 0.00 42.92 41.40 3h73 s ASP 392 CO 0.21 -1.90 1.51 -0.13 0.21 0.00 0.00 175.17 175.08 3h73 s ARG 393 N -4.99 4.16 -0.19 8.23 0.52 -1.26 -4.62 118.95 120.80 3h73 s ARG 393 Ca 0.60 2.51 0.01 0.00 -0.52 0.00 0.00 55.73 58.32 3h73 s ARG 393 Cb -0.16 -3.02 0.02 0.00 0.52 0.00 0.00 34.95 32.31 3h73 s ARG 393 CO 0.56 -0.53 -0.17 0.08 0.02 0.00 0.00 175.30 175.25 3h73 s VAL 394 N -0.47 2.22 -0.23 3.52 1.01 0.41 -4.97 120.40 121.89 3h73 s VAL 394 Ca 0.58 -0.94 -0.17 0.00 0.00 0.00 0.00 61.98 61.45 3h73 s VAL 394 Cb -0.46 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 3h73 s VAL 394 CO 0.53 0.48 0.47 -0.89 0.00 0.00 0.00 175.10 175.68 3h73 s THR 395 N 1.30 5.13 -0.14 3.92 2.01 -1.26 -0.45 115.64 126.14 3h73 s THR 395 Ca 0.04 0.81 -0.25 0.00 0.31 0.00 0.00 61.69 62.60 3h73 s THR 395 Cb -0.14 -3.79 -0.23 0.00 0.01 0.00 0.00 72.50 68.36 3h73 s THR 395 CO -0.11 0.16 0.66 0.40 -0.69 0.00 0.00 174.62 175.04 3h73 h ILE 396 N 5.23 1.55 -2.86 1.82 2.04 -0.78 -3.42 117.51 121.09 3h73 h ILE 396 Ca -0.32 -2.17 -0.14 0.00 1.00 0.00 0.00 64.86 63.22 3h73 h ILE 396 Cb 1.15 2.94 -0.25 0.00 -0.74 0.00 0.00 36.82 39.92 3h73 h ILE 396 CO 0.71 0.53 -0.31 -0.89 0.00 0.00 0.00 178.15 178.19 3h73 s THR 397 N -2.14 -0.00 -0.37 -0.27 2.01 -1.13 -4.69 115.64 109.06 3h73 s THR 397 Ca -0.17 0.02 0.05 0.00 0.31 0.00 0.00 61.69 61.90 3h73 s THR 397 Cb -0.02 -0.50 0.17 0.00 0.01 0.00 0.00 72.50 72.15 3h73 s THR 397 CO 0.60 0.01 0.50 0.21 -0.69 0.00 0.00 174.62 175.25 3h73 s ASN 398 N 0.35 -0.30 0.39 3.53 3.84 -0.27 -0.84 114.94 121.63 3h73 s ASN 398 Ca -0.01 -0.91 -0.27 0.00 0.21 0.00 0.00 52.86 51.88 3h73 s ASN 398 Cb -0.03 1.35 -0.09 0.00 -0.55 0.00 0.00 41.25 41.92 3h73 s ASN 398 CO -0.01 -0.24 1.34 -0.76 -2.79 0.00 0.00 177.10 174.64 3h73 s LEU 399 N 1.90 4.26 0.47 3.21 1.43 -1.26 -3.84 118.68 124.86 3h73 s LEU 399 Ca 0.15 2.75 -0.22 0.00 -1.03 0.00 0.00 54.13 55.78 3h73 s LEU 399 Cb -0.10 -3.82 -0.07 0.00 0.03 0.00 0.00 46.19 42.23 3h73 s LEU 399 CO -0.11 -0.82 1.13 0.00 0.23 0.00 0.00 176.35 176.77 3h73 s ARG 400 N -2.14 3.72 0.81 1.70 1.70 -1.20 -4.81 118.95 118.73 3h73 s ARG 400 Ca 0.55 1.65 -0.12 0.00 -0.47 0.00 0.00 55.73 57.34 3h73 s ARG 400 Cb -0.40 -2.29 0.08 0.00 -0.57 0.00 0.00 34.95 31.77 3h73 s ARG 400 CO 0.53 -0.55 1.13 0.16 -1.08 0.00 0.00 175.30 175.49 3h73 s ASP 401 N -1.56 4.41 -0.49 -2.89 -4.77 -1.26 -4.36 116.67 105.75 3h73 s ASP 401 Ca 0.65 1.03 -0.26 0.00 -3.30 0.00 0.00 52.55 50.67 3h73 s ASP 401 Cb -0.25 -1.66 0.03 0.00 -1.09 0.00 0.00 42.92 39.95 3h73 s ASP 401 CO 0.30 -1.99 1.01 0.21 0.70 0.00 0.00 175.17 175.40 3h73 s ASN 402 N -4.22 6.50 0.34 2.11 3.84 0.74 -4.90 114.94 119.34 3h73 s ASN 402 Ca 0.61 0.13 0.24 0.00 0.21 0.00 0.00 52.86 54.05 3h73 s ASN 402 Cb -0.13 -2.48 1.23 0.00 -0.55 0.00 0.00 41.25 39.32 3h73 s ASN 402 CO 0.52 -1.17 1.73 1.55 -2.79 0.00 0.00 177.10 176.94 3h73 h PRO 403 N 9.20 0.00 -0.15 0.43 0.13 -1.94 -2.18 132.00 137.50 3h73 h PRO 403 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 3h73 h PRO 403 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3h73 h PRO 403 CO 1.08 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.48 3h73 n LYS 404 N -2.34 1.66 -1.84 0.86 4.76 -1.26 -5.00 118.16 115.01 3h73 n LYS 404 Ca -0.01 -1.69 -0.41 0.00 -2.87 0.00 0.00 58.31 53.33 3h73 n LYS 404 Cb 0.09 -1.33 -0.01 0.00 -1.84 0.00 0.00 35.03 31.93 3h73 n LYS 404 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h73 s ALA 405 N -1.27 3.65 0.22 7.82 0.00 -0.82 -4.81 121.76 126.56 3h73 s ALA 405 Ca 0.23 1.53 -0.03 0.00 0.00 0.00 0.00 51.96 53.68 3h73 s ALA 405 Cb 0.15 -3.61 0.22 0.00 0.00 0.00 0.00 23.12 19.88 3h73 s ALA 405 CO 0.21 -0.96 1.63 0.77 0.00 0.00 0.00 175.76 177.41 3h73 h SER 406 N 4.04 0.71 -3.70 0.00 0.02 -1.94 -3.39 113.55 109.28 3h73 h SER 406 Ca -0.49 -0.27 -0.66 0.00 -0.84 0.00 0.00 61.79 59.54 3h73 h SER 406 Cb 1.23 -0.19 -0.39 0.00 0.14 0.00 0.00 62.40 63.18 3h73 h SER 406 CO 0.72 0.94 -0.74 -0.62 -1.14 0.00 0.00 176.83 176.00 3h73 s ASP 407 N -6.78 4.67 0.56 3.07 -1.08 -1.26 -4.99 116.67 110.86 3h73 s ASP 407 Ca -0.09 -1.99 0.27 0.00 -0.52 0.00 0.00 52.55 50.22 3h73 s ASP 407 Cb 0.13 -1.58 1.51 0.00 -1.46 0.00 0.00 42.92 41.52 3h73 s ASP 407 CO 0.83 -0.35 2.04 1.55 0.52 0.00 0.00 175.17 179.76 3h73 h PRO 408 N 7.66 0.00 0.00 4.34 0.13 -1.93 -0.42 132.00 141.78 3h73 h PRO 408 Ca -0.07 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 3h73 h PRO 408 Cb 1.02 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 3h73 h PRO 408 CO 0.51 0.00 -0.01 0.77 -0.23 0.00 0.00 178.00 179.04 3h73 h SER 409 N 0.00 0.00 0.00 1.44 0.02 -1.97 -2.65 113.55 110.39 3h73 h SER 409 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3h73 h SER 409 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.27 3h73 h SER 409 CO -0.00 0.01 -0.28 2.30 -1.14 0.00 0.00 176.83 177.71 3h73 n ILE 410 N -3.11 0.52 -1.27 3.27 -5.35 -0.67 -3.80 119.36 108.95 3h73 n ILE 410 Ca -0.01 -0.62 -0.28 0.00 -0.27 0.00 0.00 62.75 61.56 3h73 n ILE 410 Cb 0.18 0.38 0.14 0.00 -1.74 0.00 0.00 39.64 38.60 3h73 n ILE 410 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h73 n GLY 411 N -0.38 5.06 3.07 3.28 0.00 -0.26 -3.29 105.19 112.67 3h73 n GLY 411 Ca 0.04 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 3h73 n GLY 411 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h73 s SER 412 N -1.52 -0.04 0.56 1.61 0.15 -1.26 -0.19 113.70 113.02 3h73 s SER 412 Ca 0.60 -0.02 -0.21 0.00 0.70 0.00 0.00 55.95 57.02 3h73 s SER 412 Cb 0.49 0.24 -0.04 0.00 -1.71 0.00 0.00 66.02 65.00 3h73 s SER 412 CO 0.06 -0.24 1.33 -2.65 1.20 0.00 0.00 173.24 172.94 3h73 n PRO 413 N 2.07 1.56 -4.80 5.44 -0.02 -1.26 -3.67 135.00 134.32 3h73 n PRO 413 Ca -0.19 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.54 3h73 n PRO 413 Cb 0.57 -2.55 -0.13 0.00 -0.02 0.00 0.00 33.50 31.37 3h73 n PRO 413 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h73 s VAL 414 N -1.31 3.14 -0.04 -1.45 1.01 0.16 -4.64 120.40 117.26 3h73 s VAL 414 Ca 0.74 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 62.12 3h73 s VAL 414 Cb -0.41 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 3h73 s VAL 414 CO 0.48 0.56 -0.24 0.20 0.00 0.00 0.00 175.10 176.10 3h73 s ASN 415 N -0.22 2.90 -0.12 3.32 0.01 -1.26 -0.29 114.94 119.27 3h73 s ASN 415 Ca 0.01 -0.47 -0.28 0.00 -0.71 0.00 0.00 52.86 51.41 3h73 s ASN 415 Cb -0.13 -0.63 0.07 0.00 0.41 0.00 0.00 41.25 40.97 3h73 s ASN 415 CO 0.03 0.26 0.68 -0.51 -1.51 0.00 0.00 177.10 176.04 3h73 s ILE 416 N -0.29 0.00 0.04 0.60 2.07 -0.93 -4.61 121.20 118.09 3h73 s ILE 416 Ca 0.01 -0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 3h73 s ILE 416 Cb -0.12 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.49 3h73 s ILE 416 CO 0.02 -0.01 0.00 0.47 -1.91 0.00 0.00 174.94 173.51 3h73 n ASP 417 N 1.54 -8.79 -4.51 4.50 8.00 -1.26 -1.30 116.55 114.74 3h73 n ASP 417 Ca -0.17 1.63 -0.24 0.00 0.71 0.00 0.00 54.79 56.71 3h73 n ASP 417 Cb 0.56 -4.79 -0.09 0.00 -0.02 0.00 0.00 41.12 36.78 3h73 n ASP 417 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h73 s MET 418 N -0.78 1.81 -0.07 -1.24 0.23 -1.26 -3.08 119.30 114.92 3h73 s MET 418 Ca 0.00 -1.67 0.03 0.00 -1.03 0.00 0.00 55.69 53.01 3h73 s MET 418 Cb 0.00 -1.87 0.01 0.00 -1.53 0.00 0.00 34.83 31.44 3h73 s MET 418 CO 0.00 0.34 -0.15 0.08 -2.03 0.00 0.00 175.02 173.26 3h73 s VAL 419 N -2.42 1.33 0.08 5.16 1.01 0.88 -2.06 120.40 124.38 3h73 s VAL 419 Ca 0.30 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.71 3h73 s VAL 419 Cb -0.05 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 3h73 s VAL 419 CO 0.16 0.40 0.04 -0.76 0.00 0.00 0.00 175.10 174.94 3h73 s LEU 420 N 0.52 3.64 -0.22 3.92 1.43 -0.50 -1.23 118.68 126.24 3h73 s LEU 420 Ca -0.14 -0.08 -0.28 0.00 -1.03 0.00 0.00 54.13 52.60 3h73 s LEU 420 Cb -0.16 -2.34 0.14 0.00 0.03 0.00 0.00 46.19 43.86 3h73 s LEU 420 CO 0.04 0.18 1.08 0.54 0.23 0.00 0.00 176.35 178.42 3h73 s VAL 421 N -1.34 0.00 -0.04 -1.59 0.11 -0.96 -0.51 120.40 116.07 3h73 s VAL 421 Ca 0.27 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.39 3h73 s VAL 421 Cb -0.12 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.72 3h73 s VAL 421 CO 0.20 0.00 -0.24 -1.58 -3.33 0.00 0.00 175.10 170.15 3h73 s GLN 422 N -0.59 2.23 -0.34 1.54 0.74 -1.26 -0.51 119.66 121.47 3h73 s GLN 422 Ca 0.02 -0.85 -0.29 0.00 0.05 0.00 0.00 55.36 54.29 3h73 s GLN 422 Cb -0.02 -1.98 0.02 0.00 1.10 0.00 0.00 33.01 32.13 3h73 s GLN 422 CO -0.03 0.41 1.14 0.34 -0.55 0.00 0.00 175.29 176.60 3h73 s ASP 423 N -0.28 6.82 0.45 6.67 -1.08 -0.14 -4.85 116.67 124.27 3h73 s ASP 423 Ca 0.01 0.98 0.30 0.00 -0.52 0.00 0.00 52.55 53.33 3h73 s ASP 423 Cb -0.12 -2.54 1.61 0.00 -1.46 0.00 0.00 42.92 40.41 3h73 s ASP 423 CO 0.02 -0.99 1.93 1.55 0.52 0.00 0.00 175.17 178.19 3h73 h PRO 424 N 8.58 0.00 0.00 4.34 0.13 -1.95 0.33 132.00 143.44 3h73 h PRO 424 Ca -0.22 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.68 3h73 h PRO 424 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 3h73 h PRO 424 CO 1.05 0.00 -1.41 -1.91 -0.23 0.00 0.00 178.00 175.50 3h73 n GLU 425 N -2.58 0.55 0.16 0.86 2.13 -1.26 -4.47 120.64 116.03 3h73 n GLU 425 Ca -0.02 0.46 0.12 0.00 0.66 0.00 0.00 57.16 58.39 3h73 n GLU 425 Cb 0.08 -1.65 0.16 0.00 0.27 0.00 0.00 31.44 30.29 3h73 n GLU 425 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 3h73 h THR 426 N -1.00 0.00 0.00 6.31 1.35 -1.98 -3.47 112.91 114.13 3h73 h THR 426 Ca -0.34 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 3h73 h THR 426 Cb 1.21 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 3h73 h THR 426 CO -0.21 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.35 3h73 n LYS 427 N -2.80 -0.30 -2.37 4.72 4.76 0.12 -4.99 118.16 117.30 3h73 n LYS 427 Ca 0.03 0.07 -0.41 0.00 -2.87 0.00 0.00 58.31 55.14 3h73 n LYS 427 Cb 0.51 -3.41 -0.04 0.00 -1.84 0.00 0.00 35.03 30.26 3h73 n LYS 427 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3h73 s ARG 428 N -0.50 4.54 -0.15 1.97 3.52 -1.25 -4.73 118.95 122.36 3h73 s ARG 428 Ca 0.00 1.91 -0.04 0.00 -0.13 0.00 0.00 55.73 57.47 3h73 s ARG 428 Cb 0.00 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.18 3h73 s ARG 428 CO 0.00 0.05 -0.00 0.42 -0.81 0.00 0.00 175.30 174.96 3h73 s ILE 429 N -0.85 4.24 0.03 4.11 1.01 -0.56 -0.96 121.20 128.21 3h73 s ILE 429 Ca 0.48 -0.24 0.05 0.00 0.00 0.00 0.00 60.65 60.93 3h73 s ILE 429 Cb -0.34 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 3h73 s ILE 429 CO 0.42 0.51 -0.11 -0.36 0.00 0.00 0.00 174.94 175.40 3h73 s PHE 430 N 0.09 2.75 -0.18 3.97 0.08 0.34 -0.98 117.98 124.05 3h73 s PHE 430 Ca 0.02 -0.13 -0.01 0.00 0.12 0.00 0.00 56.93 56.93 3h73 s PHE 430 Cb -0.13 -1.54 0.05 0.00 -0.57 0.00 0.00 43.02 40.83 3h73 s PHE 430 CO 0.02 0.33 -0.04 0.45 -0.10 0.00 0.00 175.22 175.88 3h73 s SER 431 N -1.49 3.00 -0.15 1.36 0.15 0.02 -2.25 113.70 114.33 3h73 s SER 431 Ca 0.17 -0.76 -0.02 0.00 0.70 0.00 0.00 55.95 56.04 3h73 s SER 431 Cb -0.11 -0.92 -0.02 0.00 -1.71 0.00 0.00 66.02 63.26 3h73 s SER 431 CO 0.07 -0.21 -0.08 -0.63 1.20 0.00 0.00 173.24 173.59 3h73 s ILE 432 N 1.62 3.40 0.17 6.45 1.01 -0.37 -1.15 121.20 132.33 3h73 s ILE 432 Ca -0.01 -0.53 -0.07 0.00 0.00 0.00 0.00 60.65 60.05 3h73 s ILE 432 Cb -0.16 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.82 3h73 s ILE 432 CO -0.07 0.50 0.24 -0.72 0.00 0.00 0.00 174.94 174.88 3h73 s TYR 433 N 0.51 0.55 0.51 3.97 -0.85 -0.67 -0.08 117.35 121.28 3h73 s TYR 433 Ca -0.06 -0.90 -0.12 0.00 -0.52 0.00 0.00 57.07 55.47 3h73 s TYR 433 Cb -0.15 -0.16 -0.06 0.00 0.38 0.00 0.00 41.96 41.97 3h73 s TYR 433 CO 0.03 -0.69 0.91 -0.51 -1.52 0.00 0.00 175.55 173.78 3h73 s ASP 434 N -3.00 6.46 -0.01 -0.18 1.01 -0.42 -0.64 116.67 119.89 3h73 s ASP 434 Ca 0.20 1.33 0.01 0.00 0.71 0.00 0.00 52.55 54.81 3h73 s ASP 434 Cb 0.04 -2.42 0.01 0.00 1.01 0.00 0.00 42.92 41.56 3h73 s ASP 434 CO 0.02 -0.60 -0.02 -0.32 0.21 0.00 0.00 175.17 174.45 3h73 s MET 435 N -4.36 0.28 0.01 8.23 1.75 -0.33 -2.19 119.30 122.69 3h73 s MET 435 Ca 0.54 -0.05 0.01 0.00 -1.25 0.00 0.00 55.69 54.94 3h73 s MET 435 Cb -0.10 -0.33 -0.01 0.00 2.84 0.00 0.00 34.83 37.23 3h73 s MET 435 CO 0.38 0.00 -0.04 -0.06 -0.65 0.00 0.00 175.02 174.65 3h73 s PHE 436 N 0.28 0.36 1.13 4.11 0.08 0.60 -0.89 117.98 123.66 3h73 s PHE 436 Ca -0.03 -0.25 -0.18 0.00 0.12 0.00 0.00 56.93 56.59 3h73 s PHE 436 Cb -0.05 -0.23 0.26 0.00 -0.57 0.00 0.00 43.02 42.43 3h73 s PHE 436 CO -0.01 -0.06 1.17 -1.25 -0.10 0.00 0.00 175.22 174.97 3h73 s PRO 437 N -0.69 -0.66 -0.11 0.24 0.04 -1.26 0.37 135.00 132.92 3h73 s PRO 437 Ca -0.05 -0.15 -0.40 0.00 0.04 0.00 0.00 61.00 60.44 3h73 s PRO 437 Cb -0.05 -1.67 -0.18 0.00 0.04 0.00 0.00 34.50 32.64 3h73 s PRO 437 CO -0.00 -3.33 1.36 -1.91 0.04 0.00 0.00 177.00 173.16 3h73 n GLU 438 N -4.47 0.52 -2.91 4.56 2.13 -0.12 -4.12 120.64 116.23 3h73 n GLU 438 Ca 0.14 0.19 0.00 0.00 0.66 0.00 0.00 57.16 58.14 3h73 n GLU 438 Cb 0.59 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.54 3h73 n GLU 438 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h73 n GLY 439 N 2.70 -0.27 2.16 8.31 0.00 -1.21 -4.68 105.19 112.21 3h73 n GLY 439 Ca 0.23 -1.19 -0.24 0.00 0.00 0.00 0.00 46.02 44.81 3h73 n GLY 439 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h73 n LYS 440 N 0.00 2.31 0.00 1.61 5.02 -1.26 -4.21 118.16 121.62 3h73 n LYS 440 Ca 0.00 -3.08 0.00 0.00 -2.02 0.00 0.00 58.31 53.21 3h73 n LYS 440 Cb 0.00 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 3h73 n LYS 440 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h73 n GLY 441 N -1.11 3.06 0.31 0.72 0.00 -1.26 -1.63 105.19 105.29 3h73 n GLY 441 Ca 0.58 -0.11 0.21 0.00 0.00 0.00 0.00 46.02 46.70 3h73 n GLY 441 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3h73 h ILE 442 N 0.00 0.00 -0.35 -0.61 2.10 -1.97 -1.26 117.51 115.43 3h73 h ILE 442 Ca 0.00 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.73 3h73 h ILE 442 Cb 0.00 1.21 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 3h73 h ILE 442 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.56 3h73 n PHE 443 N -3.09 0.46 -1.75 2.19 3.01 -0.64 -4.04 117.46 113.59 3h73 n PHE 443 Ca -0.02 -0.23 0.05 0.00 1.01 0.00 0.00 57.45 58.27 3h73 n PHE 443 Cb 0.17 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.74 3h73 n PHE 443 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3h73 n GLY 444 N 1.31 3.17 3.78 1.37 0.00 -0.48 -4.89 105.19 109.46 3h73 n GLY 444 Ca 0.17 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 3h73 n GLY 444 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h73 s MET 445 N -1.73 4.30 0.60 1.61 -1.94 -1.22 -4.73 119.30 116.19 3h73 s MET 445 Ca 0.28 1.45 -0.16 0.00 -1.71 0.00 0.00 55.69 55.55 3h73 s MET 445 Cb 0.28 -2.61 -0.03 0.00 2.01 0.00 0.00 34.83 34.48 3h73 s MET 445 CO -0.05 -0.01 1.08 0.45 -0.01 0.00 0.00 175.02 176.48 3h73 s SER 446 N -1.59 5.62 0.19 3.03 0.15 -1.26 -4.97 113.70 114.86 3h73 s SER 446 Ca 0.55 1.89 0.01 0.00 0.70 0.00 0.00 55.95 59.11 3h73 s SER 446 Cb -0.21 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 61.66 3h73 s SER 446 CO 0.26 -1.28 1.46 -1.28 1.20 0.00 0.00 173.24 173.60 3h73 h SER 447 N 0.43 0.37 -3.07 5.45 0.87 -1.99 -3.44 113.55 112.17 3h73 h SER 447 Ca -0.47 -0.25 -0.67 0.00 -1.23 0.00 0.00 61.79 59.18 3h73 h SER 447 Cb 1.23 -0.11 -0.11 0.00 -0.44 0.00 0.00 62.40 62.97 3h73 h SER 447 CO 0.57 0.97 -0.57 -1.10 -0.53 0.00 0.00 176.83 176.17 3h73 s GLN 448 N -3.56 3.13 0.56 2.24 -1.52 -1.26 -5.09 119.66 114.15 3h73 s GLN 448 Ca -0.05 -0.38 -0.18 0.00 -1.95 0.00 0.00 55.36 52.81 3h73 s GLN 448 Cb 0.11 -2.91 -0.05 0.00 -0.22 0.00 0.00 33.01 29.93 3h73 s GLN 448 CO 0.82 0.69 1.07 0.21 -0.25 0.00 0.00 175.29 177.84 3h73 s LYS 449 N -1.32 3.43 -0.11 2.91 2.20 -1.26 -5.06 119.74 120.53 3h73 s LYS 449 Ca 0.18 1.35 -0.02 0.00 -0.36 0.00 0.00 55.97 57.13 3h73 s LYS 449 Cb -0.12 -2.04 0.04 0.00 -1.51 0.00 0.00 37.83 34.20 3h73 s LYS 449 CO 0.08 -0.74 0.01 -1.21 -0.36 0.00 0.00 175.35 173.12 3h73 s GLU 450 N -3.65 0.68 0.11 4.03 2.02 -1.26 -5.10 118.70 115.53 3h73 s GLU 450 Ca 0.67 -0.06 -0.34 0.00 0.02 0.00 0.00 54.97 55.25 3h73 s GLU 450 Cb -0.18 -1.34 -0.14 0.00 0.10 0.00 0.00 34.13 32.57 3h73 s GLU 450 CO 0.30 -0.40 1.59 0.39 0.02 0.00 0.00 175.26 177.16 3h73 n GLU 451 N 5.11 2.00 -0.03 1.61 -0.58 -1.26 -4.73 120.64 122.76 3h73 n GLU 451 Ca -0.08 0.72 -0.01 0.00 -0.42 0.00 0.00 57.16 57.37 3h73 n GLU 451 Cb 0.49 -2.48 -0.13 0.00 -0.57 0.00 0.00 31.44 28.75 3h73 n GLU 451 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h73 n ALA 452 N 3.79 1.97 -2.31 0.62 0.00 -1.26 -4.64 120.51 118.68 3h73 n ALA 452 Ca 0.18 -0.83 -0.11 0.00 0.00 0.00 0.00 53.44 52.68 3h73 n ALA 452 Cb 0.27 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 18.99 3h73 n ALA 452 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3h73 s TYR 453 N -2.90 0.80 -0.03 0.00 1.51 -1.26 -0.71 117.35 114.77 3h73 s TYR 453 Ca -0.07 -0.84 0.00 0.00 -1.01 0.00 0.00 57.07 55.15 3h73 s TYR 453 Cb 0.09 -0.48 0.02 0.00 -0.11 0.00 0.00 41.96 41.49 3h73 s TYR 453 CO 0.84 -0.16 -0.00 0.21 -1.11 0.00 0.00 175.55 175.33 3h73 s LYS 454 N -3.37 0.28 -0.32 -0.62 2.20 -0.53 -4.88 119.74 112.49 3h73 s LYS 454 Ca 0.07 0.06 -0.20 0.00 -0.36 0.00 0.00 55.97 55.54 3h73 s LYS 454 Cb 0.02 -0.44 -0.01 0.00 -1.51 0.00 0.00 37.83 35.90 3h73 s LYS 454 CO -0.04 -0.11 0.62 0.21 -0.36 0.00 0.00 175.35 175.66 3h73 s LYS 455 N 0.88 3.82 -0.29 4.03 2.20 -1.26 -1.85 119.74 127.27 3h73 s LYS 455 Ca -0.09 0.18 0.01 0.00 -0.36 0.00 0.00 55.97 55.72 3h73 s LYS 455 Cb -0.12 -3.76 0.06 0.00 -1.51 0.00 0.00 37.83 32.51 3h73 s LYS 455 CO -0.02 -0.62 -0.03 0.42 -0.36 0.00 0.00 175.35 174.74 3h73 s ILE 456 N 2.61 2.57 -1.32 5.43 1.01 0.13 -4.76 121.20 126.86 3h73 s ILE 456 Ca 0.24 -1.64 -0.03 0.00 0.00 0.00 0.00 60.65 59.23 3h73 s ILE 456 Cb -0.15 -2.55 -0.00 0.00 0.01 0.00 0.00 42.46 39.77 3h73 s ILE 456 CO 0.13 -0.16 0.61 -0.67 0.00 0.00 0.00 174.94 174.84 3h73 n ASP 457 N 4.50 -1.44 0.00 3.58 2.03 -1.26 -2.09 116.55 121.86 3h73 n ASP 457 Ca -0.11 -0.91 0.00 0.00 0.52 0.00 0.00 54.79 54.29 3h73 n ASP 457 Cb 0.42 -3.61 0.00 0.00 -0.72 0.00 0.00 41.12 37.21 3h73 n ASP 457 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h73 n GLY 458 N -1.74 2.88 3.86 0.27 0.00 -1.26 -5.03 105.19 104.17 3h73 n GLY 458 Ca -0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 3h73 n GLY 458 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h73 s LYS 459 N -0.12 3.86 -0.23 1.61 -0.14 -0.89 -5.08 119.74 118.76 3h73 s LYS 459 Ca 0.00 0.32 -0.06 0.00 -1.36 0.00 0.00 55.97 54.87 3h73 s LYS 459 Cb 0.00 -2.96 -0.03 0.00 -1.68 0.00 0.00 37.83 33.16 3h73 s LYS 459 CO 0.00 0.52 0.04 0.99 -0.76 0.00 0.00 175.35 176.14 3h73 s THR 460 N -1.44 4.18 0.12 2.17 2.01 -1.26 0.18 115.64 121.61 3h73 s THR 460 Ca 0.36 -0.22 0.10 0.00 0.31 0.00 0.00 61.69 62.24 3h73 s THR 460 Cb -0.14 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 3h73 s THR 460 CO 0.19 0.38 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.94 3h73 s TYR 461 N 1.36 2.38 0.20 4.92 2.02 -0.77 -4.97 117.35 122.48 3h73 s TYR 461 Ca 0.05 -0.35 -0.30 0.00 -0.37 0.00 0.00 57.07 56.10 3h73 s TYR 461 Cb -0.15 -1.28 -0.08 0.00 -0.40 0.00 0.00 41.96 40.05 3h73 s TYR 461 CO 0.02 0.34 0.95 -1.14 -1.57 0.00 0.00 175.55 174.16 3h73 s GLN 462 N -2.04 4.80 0.34 -0.62 0.74 -1.26 -1.45 119.66 120.17 3h73 s GLN 462 Ca 0.15 1.49 -0.14 0.00 0.05 0.00 0.00 55.36 56.90 3h73 s GLN 462 Cb -0.10 -3.31 -0.09 0.00 1.10 0.00 0.00 33.01 30.61 3h73 s GLN 462 CO 0.07 0.41 0.75 0.42 -0.55 0.00 0.00 175.29 176.39 3h73 s ILE 463 N -0.78 4.69 -0.01 -2.34 1.01 0.12 -1.10 121.20 122.78 3h73 s ILE 463 Ca 0.43 0.91 0.05 0.00 0.00 0.00 0.00 60.65 62.04 3h73 s ILE 463 Cb -0.25 -3.63 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 3h73 s ILE 463 CO 0.31 -0.25 -0.15 -0.76 0.00 0.00 0.00 174.94 174.09 3h73 s LEU 464 N -3.15 2.02 -0.05 2.97 1.43 -0.16 -4.16 118.68 117.58 3h73 s LEU 464 Ca 0.54 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 3h73 s LEU 464 Cb -0.10 -0.77 -0.03 0.00 0.03 0.00 0.00 46.19 45.32 3h73 s LEU 464 CO 0.20 0.18 -0.09 -0.31 0.23 0.00 0.00 176.35 176.56 3h73 s TYR 465 N -0.32 2.87 -0.09 0.29 2.02 0.30 -0.75 117.35 121.66 3h73 s TYR 465 Ca 0.05 -0.03 0.04 0.00 -0.37 0.00 0.00 57.07 56.77 3h73 s TYR 465 Cb -0.06 -1.67 -0.00 0.00 -0.40 0.00 0.00 41.96 39.83 3h73 s TYR 465 CO -0.00 0.31 -0.24 0.50 -1.57 0.00 0.00 175.55 174.54 3h73 s ARG 466 N -0.91 2.95 0.30 -0.62 3.52 -1.26 -2.16 118.95 120.76 3h73 s ARG 466 Ca 0.13 -0.88 -0.30 0.00 -0.13 0.00 0.00 55.73 54.55 3h73 s ARG 466 Cb -0.11 -2.27 -0.12 0.00 -1.56 0.00 0.00 34.95 30.89 3h73 s ARG 466 CO 0.02 0.22 1.52 -1.91 -0.81 0.00 0.00 175.30 174.34 3h73 n GLU 467 N 3.41 2.51 -0.08 5.12 0.00 -1.25 -1.79 120.64 128.56 3h73 n GLU 467 Ca -0.19 0.89 0.00 0.00 0.00 0.00 0.00 57.16 57.86 3h73 n GLU 467 Cb 0.53 -2.62 0.00 0.00 0.00 0.00 0.00 31.44 29.35 3h73 n GLU 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h73 n GLY 468 N 1.82 1.35 3.21 8.31 0.00 -1.26 -5.03 105.19 113.59 3h73 n GLY 468 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 3h73 n GLY 468 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h73 s GLU 469 N -0.51 1.80 -0.02 1.61 2.02 -0.74 -5.03 118.70 117.83 3h73 s GLU 469 Ca 0.00 -0.73 0.04 0.00 0.02 0.00 0.00 54.97 54.30 3h73 s GLU 469 Cb 0.00 -1.67 -0.25 0.00 0.10 0.00 0.00 34.13 32.32 3h73 s GLU 469 CO 0.00 0.39 0.76 -0.22 0.02 0.00 0.00 175.26 176.21 3h73 h LYS 470 N 5.82 0.12 -6.88 1.61 3.64 -1.96 -3.41 116.57 115.51 3h73 h LYS 470 Ca -0.37 -0.21 -0.55 0.00 -1.27 0.00 0.00 60.65 58.26 3h73 h LYS 470 Cb 1.15 0.08 0.19 0.00 -0.41 0.00 0.00 32.23 33.24 3h73 h LYS 470 CO 0.48 0.87 -0.14 0.41 -2.27 0.00 0.00 179.45 178.80 3h73 n GLY 471 N 1.63 -1.01 3.44 5.01 0.00 -1.26 -4.98 105.19 108.02 3h73 n GLY 471 Ca -0.17 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 3h73 n GLY 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h73 s ALA 472 N -2.05 3.23 0.76 4.61 0.00 -1.26 -4.67 121.76 122.38 3h73 s ALA 472 Ca 0.67 -1.30 -0.12 0.00 0.00 0.00 0.00 51.96 51.22 3h73 s ALA 472 Cb -0.31 -2.26 0.05 0.00 0.00 0.00 0.00 23.12 20.60 3h73 s ALA 472 CO 0.56 -0.75 1.11 0.71 0.00 0.00 0.00 175.76 177.40 3h73 s TYR 473 N 1.61 3.06 0.02 0.00 1.51 0.07 -3.87 117.35 119.75 3h73 s TYR 473 Ca 0.05 1.02 0.01 0.00 -1.01 0.00 0.00 57.07 57.14 3h73 s TYR 473 Cb -0.16 -3.18 -0.02 0.00 -0.11 0.00 0.00 41.96 38.49 3h73 s TYR 473 CO 0.05 -1.54 -0.05 0.95 -1.11 0.00 0.00 175.55 173.85 3h73 s THR 474 N -3.33 0.36 -0.40 -0.71 -4.23 -0.67 -0.99 115.64 105.67 3h73 s THR 474 Ca 0.60 -0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 60.21 3h73 s THR 474 Cb -0.12 -0.41 0.01 0.00 1.34 0.00 0.00 72.50 73.32 3h73 s THR 474 CO 0.52 -0.25 0.41 -0.63 -0.54 0.00 0.00 174.62 174.14 3h73 s ILE 475 N -0.95 5.11 0.00 2.99 1.01 -0.26 -0.67 121.20 128.43 3h73 s ILE 475 Ca -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.30 3h73 s ILE 475 Cb -0.07 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.42 3h73 s ILE 475 CO -0.00 -0.34 0.00 0.54 0.00 0.00 0.00 174.94 175.14 3h73 n ARG 476 N 5.53 3.59 -1.53 2.79 1.74 -0.43 -4.09 116.66 124.26 3h73 n ARG 476 Ca -0.08 0.00 -0.47 0.00 -0.77 0.00 0.00 57.85 56.53 3h73 n ARG 476 Cb 0.48 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.89 3h73 n ARG 476 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h73 n GLU 477 N 0.00 0.85 -0.96 5.56 4.71 -1.26 -0.66 120.64 128.88 3h73 n GLU 477 Ca 0.00 0.30 0.00 0.00 -0.01 0.00 0.00 57.16 57.45 3h73 n GLU 477 Cb 0.00 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 28.83 3h73 n GLU 477 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3h73 n ASN 478 N 1.66 -5.20 0.00 1.62 3.02 -1.26 -1.79 115.26 113.31 3h73 n ASN 478 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 3h73 n ASN 478 Cb 0.27 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.28 3h73 n ASN 478 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h73 n GLY 479 N 0.42 0.62 3.72 7.41 0.00 0.16 -4.69 105.19 112.83 3h73 n GLY 479 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3h73 n GLY 479 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h73 s THR 480 N -2.27 2.85 -0.09 2.61 2.01 -0.74 -0.47 115.64 119.53 3h73 s THR 480 Ca 0.00 0.60 -0.25 0.00 0.31 0.00 0.00 61.69 62.35 3h73 s THR 480 Cb 0.00 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 3h73 s THR 480 CO 0.00 0.04 0.79 -0.69 -0.69 0.00 0.00 174.62 174.07 3h73 s VAL 481 N 1.20 4.96 -0.01 3.82 1.01 -0.55 -1.31 120.40 129.54 3h73 s VAL 481 Ca 0.69 1.60 0.02 0.00 0.00 0.00 0.00 61.98 64.28 3h73 s VAL 481 Cb -0.41 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 31.82 3h73 s VAL 481 CO 0.31 0.16 -0.03 -0.31 0.00 0.00 0.00 175.10 175.23 3h73 s TYR 482 N 1.30 3.00 0.87 5.22 1.51 0.15 -1.09 117.35 128.31 3h73 s TYR 482 Ca 0.40 0.04 -0.11 0.00 -1.01 0.00 0.00 57.07 56.38 3h73 s TYR 482 Cb -0.18 -1.65 0.11 0.00 -0.11 0.00 0.00 41.96 40.13 3h73 s TYR 482 CO 0.18 0.42 1.09 0.95 -1.11 0.00 0.00 175.55 177.08 3h73 s THR 483 N -1.03 2.81 0.54 -0.71 -4.23 0.93 -1.68 115.64 112.27 3h73 s THR 483 Ca 0.18 0.26 0.24 0.00 -1.18 0.00 0.00 61.69 61.19 3h73 s THR 483 Cb -0.11 -2.68 0.36 0.00 1.34 0.00 0.00 72.50 71.41 3h73 s THR 483 CO 0.08 -0.34 2.06 -0.65 -0.54 0.00 0.00 174.62 175.23 3h73 h PRO 484 N -1.48 0.00 -0.05 3.99 0.11 -1.90 0.83 132.00 133.49 3h73 h PRO 484 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3h73 h PRO 484 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3h73 h PRO 484 CO 0.52 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 3h73 n ASP 485 N -4.28 1.11 0.00 -2.05 5.75 -1.26 -4.89 116.55 110.93 3h73 n ASP 485 Ca 0.05 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.38 3h73 n ASP 485 Cb 0.42 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 3h73 n ASP 485 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h73 n GLY 486 N 1.09 1.24 3.55 6.12 0.00 0.28 -5.09 105.19 112.39 3h73 n GLY 486 Ca 0.19 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 3h73 n GLY 486 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h73 s LYS 487 N -1.69 3.22 0.33 1.61 -0.14 -1.25 -4.84 119.74 116.98 3h73 s LYS 487 Ca 0.00 -0.52 -0.29 0.00 -1.36 0.00 0.00 55.97 53.80 3h73 s LYS 487 Cb 0.00 -2.76 -0.10 0.00 -1.68 0.00 0.00 37.83 33.29 3h73 s LYS 487 CO 0.00 0.46 1.30 0.00 -0.76 0.00 0.00 175.35 176.35 3h73 s ALA 488 N -0.24 3.50 0.11 5.17 0.00 -1.26 -0.05 121.76 128.99 3h73 s ALA 488 Ca 0.04 1.25 0.01 0.00 0.00 0.00 0.00 51.96 53.26 3h73 s ALA 488 Cb -0.13 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.53 3h73 s ALA 488 CO 0.02 -0.63 0.08 0.25 0.00 0.00 0.00 175.76 175.48 3h73 n THR 489 N 0.81 0.00 0.61 0.00 -2.24 -0.25 -4.87 114.28 108.34 3h73 n THR 489 Ca -0.00 -0.45 0.12 0.00 -2.27 0.00 0.00 64.05 61.45 3h73 n THR 489 Cb 0.42 -0.39 0.21 0.00 -2.10 0.00 0.00 70.33 68.47 3h73 n THR 489 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3h73 n ASP 490 N -1.95 3.12 -4.86 3.42 2.03 -1.26 -4.75 116.55 112.31 3h73 n ASP 490 Ca -0.01 -1.95 -0.34 0.00 0.52 0.00 0.00 54.79 53.01 3h73 n ASP 490 Cb 0.13 -0.17 -0.06 0.00 -0.72 0.00 0.00 41.12 40.31 3h73 n ASP 490 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3h73 s TYR 491 N -1.67 3.56 0.01 -0.67 1.51 -1.26 -1.56 117.35 117.27 3h73 s TYR 491 Ca 0.36 0.96 0.00 0.00 -1.01 0.00 0.00 57.07 57.38 3h73 s TYR 491 Cb 0.22 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 3h73 s TYR 491 CO 0.31 0.41 -0.01 0.50 -1.11 0.00 0.00 175.55 175.65 3h73 s ARG 492 N -2.15 0.13 -0.07 -0.62 3.52 -0.03 -1.48 118.95 118.26 3h73 s ARG 492 Ca 0.39 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.78 3h73 s ARG 492 Cb -0.14 -0.00 -0.03 0.00 -1.56 0.00 0.00 34.95 33.22 3h73 s ARG 492 CO 0.19 -0.01 -0.06 0.08 -0.81 0.00 0.00 175.30 174.70 3h73 s VAL 493 N -0.48 3.82 -0.81 7.11 1.01 0.38 0.33 120.40 131.76 3h73 s VAL 493 Ca -0.05 -0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.24 3h73 s VAL 493 Cb -0.03 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.79 3h73 s VAL 493 CO -0.00 0.60 1.53 -0.69 0.00 0.00 0.00 175.10 176.54 3h73 s VAL 494 N -0.83 3.66 -0.33 2.92 1.01 -0.26 -4.35 120.40 122.23 3h73 s VAL 494 Ca 0.13 -0.05 0.23 0.00 0.00 0.00 0.00 61.98 62.28 3h73 s VAL 494 Cb -0.11 -4.64 -0.09 0.00 0.00 0.00 0.00 36.38 31.54 3h73 s VAL 494 CO 0.02 -1.57 0.95 1.33 0.00 0.00 0.00 175.10 175.83 3h73 n VAL 495 N 6.89 0.37 -3.58 2.92 0.24 -1.26 -2.09 118.33 121.82 3h73 n VAL 495 Ca 0.20 -0.44 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 3h73 n VAL 495 Cb 0.50 -0.12 -0.09 0.00 -1.47 0.00 0.00 33.84 32.66 3h73 n VAL 495 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3h73 n ASP 496 N -2.37 3.44 -4.73 -1.34 8.00 -1.26 -5.01 116.55 113.28 3h73 n ASP 496 Ca -0.00 -3.35 -0.39 0.00 0.71 0.00 0.00 54.79 51.76 3h73 n ASP 496 Cb 0.52 -0.70 0.04 0.00 -0.02 0.00 0.00 41.12 40.96 3h73 n ASP 496 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3h73 n PRO 497 N 1.24 1.62 0.00 -0.24 -0.04 -1.26 -4.95 135.00 131.37 3h73 n PRO 497 Ca 0.26 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 64.32 3h73 n PRO 497 Cb 0.39 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 3h73 n PRO 497 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3h73 n VAL 498 N -1.06 0.00 -2.09 0.52 0.24 -1.26 -4.92 118.33 109.76 3h73 n VAL 498 Ca 0.11 -0.28 -0.32 0.00 -2.04 0.00 0.00 64.34 61.81 3h73 n VAL 498 Cb 0.44 1.10 -0.01 0.00 -1.47 0.00 0.00 33.84 33.91 3h73 n VAL 498 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3h73 s LYS 499 N -0.43 3.70 0.27 7.34 1.02 -1.26 -4.92 119.74 125.46 3h73 s LYS 499 Ca 0.00 0.87 -0.30 0.00 0.02 0.00 0.00 55.97 56.56 3h73 s LYS 499 Cb 0.00 -2.10 -0.14 0.00 -0.52 0.00 0.00 37.83 35.08 3h73 s LYS 499 CO 0.00 -0.48 1.24 -2.30 -0.92 0.00 0.00 175.35 172.89 3h73 n PRO 500 N -2.24 1.74 -0.90 -1.68 -0.02 -1.26 0.16 135.00 130.80 3h73 n PRO 500 Ca 0.06 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3h73 n PRO 500 Cb 0.54 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 3h73 n PRO 500 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h73 n ALA 501 N 1.01 0.00 -3.60 3.55 0.00 -1.26 -2.92 120.51 117.30 3h73 n ALA 501 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.27 3h73 n ALA 501 Cb 0.32 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.74 3h73 n ALA 501 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h73 n TYR 502 N -2.17 -2.28 0.31 0.00 4.02 0.12 -1.12 117.16 116.04 3h73 n TYR 502 Ca 0.00 0.79 0.04 0.00 -0.01 0.00 0.00 57.90 58.72 3h73 n TYR 502 Cb 0.29 -4.12 0.18 0.00 -0.02 0.00 0.00 39.34 35.67 3h73 n TYR 502 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3h73 n SER 503 N -2.72 0.00 -0.70 7.72 3.41 -1.15 -1.51 113.62 118.68 3h73 n SER 503 Ca -0.00 0.43 0.13 0.00 -0.26 0.00 0.00 58.87 59.16 3h73 n SER 503 Cb 0.55 -0.45 0.29 0.00 -0.26 0.00 0.00 64.21 64.34 3h73 n SER 503 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3h73 n ASP 504 N -1.45 2.21 -4.74 4.04 5.75 -1.26 -3.28 116.55 117.82 3h73 n ASP 504 Ca 0.02 -1.71 -0.42 0.00 -0.01 0.00 0.00 54.79 52.68 3h73 n ASP 504 Cb 0.09 0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.19 3h73 n ASP 504 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 3h73 s LYS 505 N -2.05 4.19 0.00 0.11 2.20 -0.57 -1.93 119.74 121.69 3h73 s LYS 505 Ca 0.32 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.37 3h73 s LYS 505 Cb 0.20 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 3h73 s LYS 505 CO 0.34 -0.56 0.00 0.41 -0.36 0.00 0.00 175.35 175.18 3h73 n GLY 506 N 2.56 1.28 3.73 5.54 0.00 -0.89 -4.89 105.19 112.53 3h73 n GLY 506 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3h73 n GLY 506 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h73 n ASP 507 N 0.00 3.55 -4.48 1.61 8.00 -0.81 -0.82 116.55 123.61 3h73 n ASP 507 Ca 0.00 1.16 -0.37 0.00 0.71 0.00 0.00 54.79 56.29 3h73 n ASP 507 Cb 0.00 -1.56 -0.12 0.00 -0.02 0.00 0.00 41.12 39.42 3h73 n ASP 507 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3h73 s LEU 508 N -0.61 3.68 0.22 0.64 1.98 0.12 -1.10 118.68 123.60 3h73 s LEU 508 Ca 0.63 -0.22 0.07 0.00 -2.89 0.00 0.00 54.13 51.72 3h73 s LEU 508 Cb -0.53 -1.98 -0.04 0.00 0.66 0.00 0.00 46.19 44.30 3h73 s LEU 508 CO 0.52 -0.07 0.07 -0.31 -1.89 0.00 0.00 176.35 174.67 3h73 s TYR 509 N 1.65 2.92 -0.57 5.38 1.51 0.15 -0.59 117.35 127.80 3h73 s TYR 509 Ca 0.06 -0.13 0.04 0.00 -1.01 0.00 0.00 57.07 56.03 3h73 s TYR 509 Cb -0.16 -1.35 0.16 0.00 -0.11 0.00 0.00 41.96 40.50 3h73 s TYR 509 CO 0.06 0.55 0.38 0.21 -1.11 0.00 0.00 175.55 175.64 3h73 s LYS 510 N -3.39 1.84 1.36 -0.62 2.36 -0.06 -0.85 119.74 120.37 3h73 s LYS 510 Ca 0.30 -2.73 0.00 0.00 -2.55 0.00 0.00 55.97 51.00 3h73 s LYS 510 Cb -0.08 -2.77 0.00 0.00 -1.05 0.00 0.00 37.83 33.93 3h73 s LYS 510 CO 0.21 -1.26 0.00 0.41 1.55 0.00 0.00 175.35 176.26 3h73 n GLY 511 N 2.61 1.66 0.00 5.54 0.00 -0.60 -3.04 105.19 111.36 3h73 n GLY 511 Ca 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3h73 n GLY 511 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3h73 n ASN 512 N 4.98 0.43 -4.60 1.61 6.94 -1.26 -4.97 115.26 118.40 3h73 n ASN 512 Ca 0.00 -1.17 -0.35 0.00 -0.02 0.00 0.00 54.58 53.05 3h73 n ASN 512 Cb 0.00 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 3h73 n ASN 512 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 3h73 s GLN 513 N -0.17 3.91 -0.20 -3.83 -1.52 -1.17 -5.07 119.66 111.61 3h73 s GLN 513 Ca 0.00 -0.38 -0.29 0.00 -1.95 0.00 0.00 55.36 52.74 3h73 s GLN 513 Cb 0.00 -3.21 -0.01 0.00 -0.22 0.00 0.00 33.01 29.57 3h73 s GLN 513 CO 0.00 0.20 1.23 -1.17 -0.25 0.00 0.00 175.29 175.30 3h73 s LEU 514 N 0.56 4.12 -0.24 2.90 2.96 -1.26 -0.88 118.68 126.84 3h73 s LEU 514 Ca 0.03 1.56 -0.01 0.00 -0.22 0.00 0.00 54.13 55.49 3h73 s LEU 514 Cb -0.13 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.88 3h73 s LEU 514 CO 0.01 -0.79 -0.22 0.18 -1.32 0.00 0.00 176.35 174.21 3h73 n LEU 515 N 6.71 2.78 0.00 -0.68 4.77 0.24 -4.97 117.00 125.85 3h73 n LEU 515 Ca 0.14 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3h73 n LEU 515 Cb 0.45 -0.80 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 3h73 n LEU 515 CO 0.56 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 178.06 3h73 n GLY 516 N 2.24 1.58 3.01 -0.72 0.00 -1.00 -4.00 105.19 106.31 3h73 n GLY 516 Ca -0.42 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 3h73 n GLY 516 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3h73 s ASN 517 N 2.00 -0.16 0.00 1.61 2.47 -1.26 0.11 114.94 119.71 3h73 s ASN 517 Ca 0.00 0.34 0.12 0.00 0.42 0.00 0.00 52.86 53.74 3h73 s ASN 517 Cb 0.00 0.30 0.54 0.00 -1.45 0.00 0.00 41.25 40.63 3h73 s ASN 517 CO 0.00 -0.09 1.36 2.30 -3.72 0.00 0.00 177.10 176.95 3h73 n ILE 518 N 3.43 1.06 1.13 -5.21 -5.35 -0.00 -1.95 119.36 112.47 3h73 n ILE 518 Ca -0.17 0.27 0.12 0.00 -0.27 0.00 0.00 62.75 62.69 3h73 n ILE 518 Cb 0.56 -1.06 0.19 0.00 -1.74 0.00 0.00 39.64 37.59 3h73 n ILE 518 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3h73 n TYR 519 N -1.45 0.00 -2.84 4.28 0.53 -1.26 -1.19 117.16 115.23 3h73 n TYR 519 Ca 0.04 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.52 3h73 n TYR 519 Cb 0.13 -0.05 -0.06 0.00 -1.03 0.00 0.00 39.34 38.33 3h73 n TYR 519 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 3h73 s PHE 520 N -2.43 3.95 0.00 -0.72 2.99 -0.82 -0.95 117.98 119.99 3h73 s PHE 520 Ca 0.23 1.80 0.00 0.00 0.00 0.00 0.00 56.93 58.96 3h73 s PHE 520 Cb 0.19 -2.89 0.00 0.00 0.00 0.00 0.00 43.02 40.31 3h73 s PHE 520 CO 0.52 0.47 0.00 0.25 -0.00 0.00 0.00 175.22 176.46 3h73 n THR 521 N 1.49 0.00 -4.22 0.64 -2.24 -1.26 -4.83 114.28 103.85 3h73 n THR 521 Ca -0.03 -0.41 -0.18 0.00 -2.27 0.00 0.00 64.05 61.16 3h73 n THR 521 Cb 0.48 0.94 -0.11 0.00 -2.10 0.00 0.00 70.33 69.54 3h73 n THR 521 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3h73 s THR 522 N -1.03 1.25 -1.81 4.28 -4.23 -1.26 -4.80 115.64 108.05 3h73 s THR 522 Ca 0.00 -1.66 -0.20 0.00 -1.18 0.00 0.00 61.69 58.66 3h73 s THR 522 Cb 0.00 -1.45 0.19 0.00 1.34 0.00 0.00 72.50 72.58 3h73 s THR 522 CO 0.00 -0.41 0.58 0.59 -0.54 0.00 0.00 174.62 174.84 3h73 n ASN 523 N 0.63 -1.84 -4.74 3.99 5.03 -1.26 -4.76 115.26 112.31 3h73 n ASN 523 Ca -0.16 -1.20 -0.37 0.00 0.87 0.00 0.00 54.58 53.72 3h73 n ASN 523 Cb 0.57 -1.88 0.06 0.00 -1.02 0.00 0.00 39.78 37.50 3h73 n ASN 523 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3h73 s LYS 524 N -7.18 2.71 0.00 3.52 1.02 -1.26 -4.84 119.74 113.70 3h73 s LYS 524 Ca 0.72 2.01 0.10 0.00 0.02 0.00 0.00 55.97 58.82 3h73 s LYS 524 Cb -0.41 -1.89 -0.08 0.00 -0.52 0.00 0.00 37.83 34.93 3h73 s LYS 524 CO 1.00 -1.46 0.50 0.25 -0.92 0.00 0.00 175.35 174.71 3h73 n THR 525 N -1.76 0.00 -4.32 2.17 -2.24 -1.26 -4.99 114.28 101.88 3h73 n THR 525 Ca 0.15 -0.30 -0.25 0.00 -2.27 0.00 0.00 64.05 61.38 3h73 n THR 525 Cb 0.48 1.04 -0.08 0.00 -2.10 0.00 0.00 70.33 69.67 3h73 n THR 525 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h73 s SER 526 N -1.80 4.22 0.00 3.42 1.04 -1.26 -4.69 113.70 114.64 3h73 s SER 526 Ca 0.05 -1.00 0.27 0.00 0.48 0.00 0.00 55.95 55.76 3h73 s SER 526 Cb 0.08 -0.54 0.91 0.00 0.10 0.00 0.00 66.02 66.57 3h73 s SER 526 CO 0.37 -0.27 1.67 -2.65 0.98 0.00 0.00 173.24 173.34 3h73 n PRO 527 N -0.99 0.53 -4.71 4.02 -0.02 -1.26 -4.94 135.00 127.64 3h73 n PRO 527 Ca -0.04 -0.25 -0.30 0.00 -2.02 0.00 0.00 63.50 60.89 3h73 n PRO 527 Cb 0.63 -1.49 -0.14 0.00 -0.02 0.00 0.00 33.50 32.47 3h73 n PRO 527 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3h73 s PHE 528 N -2.64 2.37 0.01 6.00 0.08 -1.26 -3.89 117.98 118.64 3h73 s PHE 528 Ca 0.22 -0.37 -0.14 0.00 0.12 0.00 0.00 56.93 56.76 3h73 s PHE 528 Cb 0.19 -1.36 0.02 0.00 -0.57 0.00 0.00 43.02 41.30 3h73 s PHE 528 CO 0.54 0.21 0.29 -0.98 -0.10 0.00 0.00 175.22 175.19 3h73 s ARG 529 N -1.53 0.71 0.91 0.44 1.70 -0.92 -4.22 118.95 116.04 3h73 s ARG 529 Ca 0.13 -0.33 -0.14 0.00 -0.47 0.00 0.00 55.73 54.92 3h73 s ARG 529 Cb -0.10 0.31 0.15 0.00 -0.57 0.00 0.00 34.95 34.73 3h73 s ARG 529 CO 0.04 -0.21 1.20 0.96 -1.08 0.00 0.00 175.30 176.22 3h73 s ILE 530 N -1.81 1.97 0.43 4.99 -4.36 -0.33 -0.54 121.20 121.55 3h73 s ILE 530 Ca -0.10 0.00 -0.25 0.00 -0.26 0.00 0.00 60.65 60.03 3h73 s ILE 530 Cb -0.04 -2.89 -0.08 0.00 1.25 0.00 0.00 42.46 40.70 3h73 s ILE 530 CO 0.01 0.00 1.34 0.00 0.24 0.00 0.00 174.94 176.53 3h73 s ALA 531 N -3.55 3.21 -0.65 2.27 0.00 -1.26 -4.79 121.76 116.99 3h73 s ALA 531 Ca 0.67 1.30 -0.28 0.00 0.00 0.00 0.00 51.96 53.65 3h73 s ALA 531 Cb -0.10 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.53 3h73 s ALA 531 CO 0.52 -0.97 1.27 0.21 0.00 0.00 0.00 175.76 176.79 3h73 s LYS 532 N -2.38 3.33 0.24 0.00 2.20 -1.26 -4.88 119.74 116.99 3h73 s LYS 532 Ca 0.59 0.07 -0.14 0.00 -0.36 0.00 0.00 55.97 56.13 3h73 s LYS 532 Cb -0.39 -4.11 0.05 0.00 -1.51 0.00 0.00 37.83 31.87 3h73 s LYS 532 CO 0.50 -1.94 0.72 -3.47 -0.36 0.00 0.00 175.35 170.81 3h73 n ASP 533 N 9.06 -1.63 -4.73 1.43 2.03 -1.26 -4.60 116.55 116.85 3h73 n ASP 533 Ca 0.07 -2.02 -0.37 0.00 0.52 0.00 0.00 54.79 52.99 3h73 n ASP 533 Cb 0.49 2.69 -0.07 0.00 -0.72 0.00 0.00 41.12 43.51 3h73 n ASP 533 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3h73 s SER 534 N -2.79 6.46 0.31 1.67 0.15 -1.26 -4.36 113.70 113.88 3h73 s SER 534 Ca 0.15 0.54 0.07 0.00 0.70 0.00 0.00 55.95 57.41 3h73 s SER 534 Cb -0.03 -2.19 -0.06 0.00 -1.71 0.00 0.00 66.02 62.03 3h73 s SER 534 CO 0.07 0.10 -0.04 -0.31 1.20 0.00 0.00 173.24 174.26 3h73 s TYR 535 N 0.42 2.10 -0.10 3.44 2.02 -0.07 -4.73 117.35 120.42 3h73 s TYR 535 Ca 0.17 -0.69 -0.00 0.00 -0.37 0.00 0.00 57.07 56.18 3h73 s TYR 535 Cb -0.13 -1.26 0.02 0.00 -0.40 0.00 0.00 41.96 40.20 3h73 s TYR 535 CO 0.04 0.32 -0.08 -1.17 -1.57 0.00 0.00 175.55 173.10 3h73 s LEU 536 N -3.51 1.21 0.33 -1.29 2.96 -1.26 -1.19 118.68 115.93 3h73 s LEU 536 Ca 0.32 -0.28 0.09 0.00 -0.22 0.00 0.00 54.13 54.03 3h73 s LEU 536 Cb 0.05 -0.79 -0.05 0.00 0.50 0.00 0.00 46.19 45.90 3h73 s LEU 536 CO 0.14 -0.10 0.09 0.26 -1.32 0.00 0.00 176.35 175.42 3h73 s TRP 537 N 1.56 2.66 -0.08 5.38 0.52 0.19 -1.71 118.94 127.46 3h73 s TRP 537 Ca 0.02 -0.38 -0.08 0.00 0.02 0.00 0.00 56.10 55.69 3h73 s TRP 537 Cb -0.13 -1.54 0.02 0.00 -1.15 0.00 0.00 33.47 30.67 3h73 s TRP 537 CO -0.06 0.41 0.22 1.41 0.02 0.00 0.00 176.95 178.95 3h73 s MET 538 N -3.79 0.25 0.03 4.98 -2.45 0.71 -1.67 119.30 117.36 3h73 s MET 538 Ca 0.36 0.31 0.04 0.00 -1.25 0.00 0.00 55.69 55.15 3h73 s MET 538 Cb -0.02 0.11 -0.02 0.00 1.25 0.00 0.00 34.83 36.15 3h73 s MET 538 CO 0.21 -0.04 -0.11 -1.12 1.05 0.00 0.00 175.02 175.01 3h73 s SER 539 N 0.16 1.32 0.11 1.11 0.01 -0.30 0.51 113.70 116.62 3h73 s SER 539 Ca -0.00 -0.42 0.03 0.00 1.31 0.00 0.00 55.95 56.87 3h73 s SER 539 Cb -0.02 -0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.10 3h73 s SER 539 CO -0.00 -0.02 -0.09 -0.72 0.41 0.00 0.00 173.24 172.82 3h73 s TYR 540 N -0.86 1.08 -0.04 2.43 -0.85 -1.26 -0.80 117.35 117.06 3h73 s TYR 540 Ca -0.01 -0.74 0.03 0.00 -0.52 0.00 0.00 57.07 55.83 3h73 s TYR 540 Cb -0.07 -0.58 0.01 0.00 0.38 0.00 0.00 41.96 41.69 3h73 s TYR 540 CO 0.01 -0.01 -0.11 0.45 -1.52 0.00 0.00 175.55 174.37 3h73 s SER 541 N -2.79 1.54 0.00 -0.18 0.15 -0.16 -1.02 113.70 111.24 3h73 s SER 541 Ca 0.10 -0.25 0.15 0.00 0.70 0.00 0.00 55.95 56.65 3h73 s SER 541 Cb 0.00 -0.50 0.35 0.00 -1.71 0.00 0.00 66.02 64.16 3h73 s SER 541 CO -0.01 0.07 1.26 0.47 1.20 0.00 0.00 173.24 176.24 3h73 n ASP 542 N 3.41 3.03 -2.51 5.45 8.00 -1.26 -1.49 116.55 131.18 3h73 n ASP 542 Ca -0.20 -1.92 -0.18 0.00 0.71 0.00 0.00 54.79 53.21 3h73 n ASP 542 Cb 0.53 -0.24 0.02 0.00 -0.02 0.00 0.00 41.12 41.41 3h73 n ASP 542 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3h73 n ASP 543 N 0.86 3.32 -2.29 -2.24 5.68 -1.26 -4.96 116.55 115.67 3h73 n ASP 543 Ca 0.14 -3.20 -0.20 0.00 -0.50 0.00 0.00 54.79 51.04 3h73 n ASP 543 Cb 0.46 -0.47 -0.01 0.00 -1.14 0.00 0.00 41.12 39.97 3h73 n ASP 543 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3h73 n ASP 544 N -0.40 -5.63 0.00 -1.12 2.03 -1.26 -2.61 116.55 107.56 3h73 n ASP 544 Ca 0.26 -0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.53 3h73 n ASP 544 Cb 0.78 -4.65 0.00 0.00 -0.72 0.00 0.00 41.12 36.53 3h73 n ASP 544 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h73 n GLY 545 N -1.06 0.77 0.19 0.27 0.00 -1.26 -4.95 105.19 99.14 3h73 n GLY 545 Ca -0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 3h73 n GLY 545 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h73 h LYS 546 N 3.33 0.62 -5.28 1.61 1.57 -1.91 -3.45 116.57 113.05 3h73 h LYS 546 Ca 0.00 -0.39 -0.39 0.00 -1.87 0.00 0.00 60.65 58.00 3h73 h LYS 546 Cb 0.00 0.04 -0.19 0.00 0.08 0.00 0.00 32.23 32.17 3h73 h LYS 546 CO 0.00 1.00 -0.76 0.95 -0.57 0.00 0.00 179.45 180.08 3h73 s THR 547 N -4.09 1.18 0.07 -0.16 -4.23 -1.26 -5.01 115.64 102.14 3h73 s THR 547 Ca -0.12 -1.60 0.05 0.00 -1.18 0.00 0.00 61.69 58.84 3h73 s THR 547 Cb 0.07 -1.38 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 3h73 s THR 547 CO 0.83 -0.41 -0.14 0.26 -0.54 0.00 0.00 174.62 174.62 3h73 s TRP 548 N -2.01 1.19 0.98 3.99 0.52 -1.26 -4.35 118.94 118.00 3h73 s TRP 548 Ca 0.05 -0.46 -0.15 0.00 0.02 0.00 0.00 56.10 55.57 3h73 s TRP 548 Cb -0.06 -0.67 0.18 0.00 -1.15 0.00 0.00 33.47 31.77 3h73 s TRP 548 CO 0.02 0.05 1.18 -1.54 0.02 0.00 0.00 176.95 176.68 3h73 s SER 549 N -1.72 2.90 0.56 2.95 1.04 -0.19 -4.95 113.70 114.29 3h73 s SER 549 Ca -0.02 0.70 -0.18 0.00 0.48 0.00 0.00 55.95 56.93 3h73 s SER 549 Cb -0.10 -1.06 -0.05 0.00 0.10 0.00 0.00 66.02 64.91 3h73 s SER 549 CO 0.02 -2.90 1.10 0.00 0.98 0.00 0.00 173.24 172.44 3h73 s ALA 550 N -3.39 2.69 0.35 5.32 0.00 -1.26 -4.59 121.76 120.88 3h73 s ALA 550 Ca 0.68 0.69 -0.28 0.00 0.00 0.00 0.00 51.96 53.05 3h73 s ALA 550 Cb -0.11 -3.32 -0.12 0.00 0.00 0.00 0.00 23.12 19.58 3h73 s ALA 550 CO 0.54 -0.79 1.42 -2.30 0.00 0.00 0.00 175.76 174.63 3h73 n PRO 551 N -1.52 2.45 -4.80 0.00 -0.02 -1.26 -4.76 135.00 125.08 3h73 n PRO 551 Ca 0.11 0.86 -0.33 0.00 -2.02 0.00 0.00 63.50 62.12 3h73 n PRO 551 Cb 0.52 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.31 3h73 n PRO 551 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3h73 s GLN 552 N -1.81 3.36 -0.63 -0.52 0.74 0.18 -4.91 119.66 116.08 3h73 s GLN 552 Ca 0.56 -0.70 -0.24 0.00 0.05 0.00 0.00 55.36 55.02 3h73 s GLN 552 Cb -0.52 -2.61 0.05 0.00 1.10 0.00 0.00 33.01 31.03 3h73 s GLN 552 CO 0.61 0.21 1.03 0.34 -0.55 0.00 0.00 175.29 176.93 3h73 s ASP 553 N 0.36 6.25 0.00 6.67 2.15 -1.26 -0.21 116.67 130.62 3h73 s ASP 553 Ca -0.11 -0.59 0.26 0.00 0.43 0.00 0.00 52.55 52.54 3h73 s ASP 553 Cb -0.16 -2.46 0.67 0.00 -0.30 0.00 0.00 42.92 40.66 3h73 s ASP 553 CO 0.06 -1.45 1.53 2.30 -0.17 0.00 0.00 175.17 177.44 3h73 n ILE 554 N 6.16 0.00 -0.20 4.11 -5.35 -0.69 -4.55 119.36 118.84 3h73 n ILE 554 Ca 0.00 -0.34 -0.03 0.00 -0.27 0.00 0.00 62.75 62.12 3h73 n ILE 554 Cb 0.47 0.90 0.04 0.00 -1.74 0.00 0.00 39.64 39.31 3h73 n ILE 554 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 3h73 h THR 555 N 3.18 0.30 0.00 7.28 2.02 -1.84 -1.16 112.91 122.69 3h73 h THR 555 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3h73 h THR 555 Cb 0.70 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 3h73 h THR 555 CO 0.00 0.00 0.07 1.55 0.37 0.00 0.00 175.52 177.51 3h73 h PRO 556 N -0.08 0.00 0.00 6.66 0.13 -1.89 0.12 132.00 136.94 3h73 h PRO 556 Ca 0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.35 3h73 h PRO 556 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 3h73 h PRO 556 CO -0.64 0.00 -0.57 0.52 -0.23 0.00 0.00 178.00 177.08 3h73 h MET 557 N 0.00 0.00 0.00 0.86 2.86 -1.52 -3.40 114.93 113.72 3h73 h MET 557 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3h73 h MET 557 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 3h73 h MET 557 CO 0.00 0.15 -0.22 1.33 1.06 0.00 0.00 176.91 179.23 3h73 n VAL 558 N -2.99 0.00 -3.09 -2.22 0.24 -0.64 -4.49 118.33 105.14 3h73 n VAL 558 Ca 0.01 -0.17 -0.41 0.00 -2.04 0.00 0.00 64.34 61.73 3h73 n VAL 558 Cb 0.62 0.71 -0.06 0.00 -1.47 0.00 0.00 33.84 33.64 3h73 n VAL 558 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3h73 s LYS 559 N -0.77 3.83 0.63 7.34 2.20 0.31 -4.69 119.74 128.59 3h73 s LYS 559 Ca 0.00 0.25 -0.14 0.00 -0.36 0.00 0.00 55.97 55.72 3h73 s LYS 559 Cb 0.00 -3.76 -0.02 0.00 -1.51 0.00 0.00 37.83 32.54 3h73 s LYS 559 CO 0.00 -0.65 1.06 0.00 -0.36 0.00 0.00 175.35 175.40 3h73 s ALA 560 N 2.70 2.68 0.52 3.13 0.00 -1.26 -4.86 121.76 124.68 3h73 s ALA 560 Ca 0.26 0.31 0.30 0.00 0.00 0.00 0.00 51.96 52.83 3h73 s ALA 560 Cb -0.15 -3.22 1.73 0.00 0.00 0.00 0.00 23.12 21.48 3h73 s ALA 560 CO 0.13 -1.00 2.19 -0.44 0.00 0.00 0.00 175.76 176.65 3h73 h ASP 561 N 0.02 0.00 1.08 0.00 3.32 -2.01 -2.18 116.42 116.65 3h73 h ASP 561 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3h73 h ASP 561 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3h73 h ASP 561 CO 0.57 0.04 -0.59 4.11 -1.72 0.00 0.00 179.24 181.65 3h73 h TRP 562 N 0.00 0.00 -3.40 4.55 5.08 -1.99 -3.47 115.95 116.72 3h73 h TRP 562 Ca -0.00 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.44 3h73 h TRP 562 Cb 0.13 0.00 0.05 0.00 -3.00 0.00 0.00 29.16 26.34 3h73 h TRP 562 CO 0.00 0.00 0.71 -1.64 -1.28 0.00 0.00 178.44 176.23 3h73 s MET 563 N -3.21 4.32 0.00 0.12 -1.94 -0.82 -4.31 119.30 113.46 3h73 s MET 563 Ca 0.05 2.19 0.00 0.00 -1.71 0.00 0.00 55.69 56.23 3h73 s MET 563 Cb 0.11 -3.14 0.00 0.00 2.01 0.00 0.00 34.83 33.81 3h73 s MET 563 CO 0.72 -0.34 0.00 1.17 -0.01 0.00 0.00 175.02 176.56 3h73 n LYS 564 N 2.40 0.00 -3.16 2.03 4.81 -0.47 -4.93 118.16 118.84 3h73 n LYS 564 Ca 0.06 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.14 3h73 n LYS 564 Cb 0.41 -0.11 -0.06 0.00 0.02 0.00 0.00 35.03 35.30 3h73 n LYS 564 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3h73 s PHE 565 N 0.00 3.66 -0.22 5.64 5.36 -1.24 -4.39 117.98 126.80 3h73 s PHE 565 Ca 0.00 1.32 -0.04 0.00 -0.96 0.00 0.00 56.93 57.26 3h73 s PHE 565 Cb 0.00 -2.57 0.11 0.00 -0.34 0.00 0.00 43.02 40.22 3h73 s PHE 565 CO 0.00 0.38 0.28 -1.17 -1.46 0.00 0.00 175.22 173.24 3h73 s LEU 566 N -1.89 -0.30 0.19 6.12 2.96 -1.26 -1.82 118.68 122.67 3h73 s LEU 566 Ca 0.41 -0.04 -0.05 0.00 -0.22 0.00 0.00 54.13 54.23 3h73 s LEU 566 Cb -0.17 0.65 -0.03 0.00 0.50 0.00 0.00 46.19 47.15 3h73 s LEU 566 CO 0.21 -0.31 0.23 -0.83 -1.32 0.00 0.00 176.35 174.32 3h73 s GLY 567 N 2.41 0.98 0.58 7.98 0.00 -0.65 -4.57 107.32 114.06 3h73 s GLY 567 Ca 0.09 -1.32 -0.10 0.00 0.00 0.00 0.00 44.72 43.38 3h73 s GLY 567 CO -0.13 -1.11 0.98 -1.34 0.00 0.00 0.00 173.10 171.50 3h73 s VAL 568 N -4.07 4.73 -0.70 1.40 -7.23 -1.26 -0.69 120.40 112.57 3h73 s VAL 568 Ca 0.29 0.79 -0.16 0.00 -1.81 0.00 0.00 61.98 61.09 3h73 s VAL 568 Cb 0.05 -3.85 0.17 0.00 0.56 0.00 0.00 36.38 33.30 3h73 s VAL 568 CO 0.08 -1.04 0.68 -0.83 -0.31 0.00 0.00 175.10 173.68 3h73 s GLY 569 N -4.04 2.30 0.23 2.32 0.00 0.32 -4.73 107.32 103.71 3h73 s GLY 569 Ca 0.54 -2.87 -0.29 0.00 0.00 0.00 0.00 44.72 42.11 3h73 s GLY 569 CO 0.50 1.32 0.74 -1.55 0.00 0.00 0.00 173.10 174.11 3h73 n PRO 570 N 4.89 0.54 0.00 2.90 -0.04 -1.26 -4.62 135.00 137.41 3h73 n PRO 570 Ca 0.01 0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 3h73 n PRO 570 Cb 0.44 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 3h73 n PRO 570 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h73 n GLY 571 N 1.70 0.54 3.15 0.55 0.00 -0.88 -4.92 105.19 105.33 3h73 n GLY 571 Ca 0.15 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 3h73 n GLY 571 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h73 s THR 572 N -3.96 1.93 0.57 2.61 2.01 -1.26 -1.41 115.64 116.13 3h73 s THR 572 Ca 0.00 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 61.00 3h73 s THR 572 Cb 0.00 -1.71 0.13 0.00 0.01 0.00 0.00 72.50 70.93 3h73 s THR 572 CO 0.00 0.53 0.76 0.61 -0.69 0.00 0.00 174.62 175.82 3h73 n GLY 573 N 4.04 -1.42 3.23 4.40 0.00 0.33 -4.78 105.19 111.00 3h73 n GLY 573 Ca -0.20 -1.68 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 3h73 n GLY 573 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h73 s ILE 574 N -2.64 0.18 -0.12 -0.61 -4.36 -1.00 -4.78 121.20 107.87 3h73 s ILE 574 Ca 0.43 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.84 3h73 s ILE 574 Cb -0.01 -2.52 0.01 0.00 1.25 0.00 0.00 42.46 41.20 3h73 s ILE 574 CO 0.30 -0.03 -0.17 -0.69 0.24 0.00 0.00 174.94 174.60 3h73 s VAL 575 N -4.03 1.63 0.22 8.37 1.01 -1.26 -0.69 120.40 125.66 3h73 s VAL 575 Ca 0.38 -0.72 -0.32 0.00 0.00 0.00 0.00 61.98 61.32 3h73 s VAL 575 Cb 0.07 -1.48 -0.13 0.00 0.00 0.00 0.00 36.38 34.85 3h73 s VAL 575 CO 0.12 0.47 1.57 0.18 0.00 0.00 0.00 175.10 177.43 3h73 n LEU 576 N 4.19 3.58 0.01 3.92 4.77 -0.06 -4.84 117.00 128.58 3h73 n LEU 576 Ca -0.19 1.11 -0.03 0.00 -0.03 0.00 0.00 56.01 56.87 3h73 n LEU 576 Cb 0.51 -1.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.00 3h73 n LEU 576 CO 0.24 -0.14 -0.43 0.54 -1.33 0.00 0.00 177.39 176.27 3h73 n ARG 577 N 2.85 0.63 -4.22 3.23 1.74 -1.26 -1.09 116.66 118.54 3h73 n ARG 577 Ca 0.13 0.22 -0.17 0.00 -0.77 0.00 0.00 57.85 57.26 3h73 n ARG 577 Cb 0.33 -1.78 -0.07 0.00 -1.02 0.00 0.00 32.46 29.91 3h73 n ARG 577 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h73 s ASN 578 N -5.83 1.31 0.00 0.55 2.20 -1.26 -4.87 114.94 107.04 3h73 s ASN 578 Ca -0.04 -1.64 0.00 0.00 -0.94 0.00 0.00 52.86 50.24 3h73 s ASN 578 Cb 0.08 0.56 0.00 0.00 -2.00 0.00 0.00 41.25 39.90 3h73 s ASN 578 CO 0.82 -1.10 0.00 0.61 -2.94 0.00 0.00 177.10 174.49 3h73 n GLY 579 N -0.57 -0.61 0.02 0.45 0.00 -1.26 -3.76 105.19 99.46 3h73 n GLY 579 Ca 0.05 -1.74 0.06 0.00 0.00 0.00 0.00 46.02 44.39 3h73 n GLY 579 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h73 n PRO 580 N -0.65 0.02 -0.53 1.61 -0.04 -1.26 -2.15 135.00 132.01 3h73 n PRO 580 Ca 0.00 0.33 0.06 0.00 -0.04 0.00 0.00 63.50 63.85 3h73 n PRO 580 Cb 0.00 -1.55 0.25 0.00 -0.04 0.00 0.00 33.50 32.16 3h73 n PRO 580 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3h73 n HIS 581 N -1.59 1.01 -1.68 0.54 8.25 -1.26 -5.03 115.22 115.46 3h73 n HIS 581 Ca 0.02 -1.03 -0.44 0.00 -0.26 0.00 0.00 57.72 56.01 3h73 n HIS 581 Cb 0.13 -0.36 -0.02 0.00 1.12 0.00 0.00 29.99 30.86 3h73 n HIS 581 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3h73 n LYS 582 N -0.65 2.11 0.00 -0.41 4.81 -0.91 -1.62 118.16 121.49 3h73 n LYS 582 Ca 0.24 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.44 3h73 n LYS 582 Cb 0.94 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 33.58 3h73 n LYS 582 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h73 n GLY 583 N 1.98 1.07 3.74 3.14 0.00 -0.25 -4.97 105.19 109.89 3h73 n GLY 583 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3h73 n GLY 583 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h73 s ARG 584 N -0.87 4.39 -0.16 1.61 3.52 -0.64 -4.71 118.95 122.08 3h73 s ARG 584 Ca 0.00 2.08 -0.16 0.00 -0.13 0.00 0.00 55.73 57.52 3h73 s ARG 584 Cb 0.00 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 3h73 s ARG 584 CO 0.00 -0.23 0.39 0.42 -0.81 0.00 0.00 175.30 175.07 3h73 s ILE 585 N -0.13 5.23 -0.12 4.11 1.01 -0.77 -0.88 121.20 129.66 3h73 s ILE 585 Ca 0.55 0.74 0.01 0.00 0.00 0.00 0.00 60.65 61.95 3h73 s ILE 585 Cb -0.37 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.36 3h73 s ILE 585 CO 0.41 0.31 -0.15 -0.76 0.00 0.00 0.00 174.94 174.76 3h73 s LEU 586 N 0.85 2.64 -0.17 2.97 1.43 0.13 -2.16 118.68 124.37 3h73 s LEU 586 Ca 0.20 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 3h73 s LEU 586 Cb -0.14 -1.58 0.04 0.00 0.03 0.00 0.00 46.19 44.54 3h73 s LEU 586 CO 0.07 0.19 -0.08 -0.63 0.23 0.00 0.00 176.35 176.13 3h73 s ILE 587 N 0.22 1.32 0.30 -0.59 -1.09 -0.54 -2.36 121.20 118.46 3h73 s ILE 587 Ca -0.09 -0.73 -0.29 0.00 -2.23 0.00 0.00 60.65 57.31 3h73 s ILE 587 Cb -0.16 -1.43 -0.10 0.00 -1.58 0.00 0.00 42.46 39.19 3h73 s ILE 587 CO 0.05 0.19 1.42 -2.84 -1.23 0.00 0.00 174.94 172.54 3h73 s PRO 588 N 1.55 4.25 0.23 2.79 0.02 -1.26 -1.43 135.00 141.15 3h73 s PRO 588 Ca 0.01 2.35 -0.09 0.00 0.02 0.00 0.00 61.00 63.29 3h73 s PRO 588 Cb -0.15 -3.06 -0.02 0.00 0.02 0.00 0.00 34.50 31.29 3h73 s PRO 588 CO -0.08 -0.38 0.36 0.14 -0.33 0.00 0.00 177.00 176.70 3h73 s VAL 589 N -0.57 0.00 0.08 3.83 -7.23 -0.19 -0.52 120.40 115.81 3h73 s VAL 589 Ca 0.55 -1.60 -0.17 0.00 -1.81 0.00 0.00 61.98 58.95 3h73 s VAL 589 Cb -0.42 -2.29 0.03 0.00 0.56 0.00 0.00 36.38 34.26 3h73 s VAL 589 CO 0.50 -0.01 0.40 -0.72 -0.31 0.00 0.00 175.10 174.96 3h73 s TYR 590 N -4.06 -0.23 0.29 2.82 -0.85 0.13 -1.16 117.35 114.30 3h73 s TYR 590 Ca 0.28 0.06 0.02 0.00 -0.52 0.00 0.00 57.07 56.91 3h73 s TYR 590 Cb 0.02 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.54 3h73 s TYR 590 CO 0.10 -0.63 0.13 0.95 -1.52 0.00 0.00 175.55 174.58 3h73 s THR 591 N -3.09 0.46 0.16 -3.49 -4.23 -0.87 -1.63 115.64 102.95 3h73 s THR 591 Ca -0.01 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.53 3h73 s THR 591 Cb 0.01 -2.56 -0.05 0.00 1.34 0.00 0.00 72.50 71.24 3h73 s THR 591 CO -0.07 0.00 -0.05 0.42 -0.54 0.00 0.00 174.62 174.39 3h73 s THR 592 N -3.63 0.92 0.50 3.99 -4.23 -0.76 -1.38 115.64 111.04 3h73 s THR 592 Ca 0.36 -2.01 0.04 0.00 -1.18 0.00 0.00 61.69 58.90 3h73 s THR 592 Cb 0.06 -2.00 -0.01 0.00 1.34 0.00 0.00 72.50 71.90 3h73 s THR 592 CO 0.16 -0.61 0.18 0.54 -0.54 0.00 0.00 174.62 174.35 3h73 s ASN 593 N -3.18 4.36 0.00 3.99 2.20 -1.26 -1.37 114.94 119.68 3h73 s ASN 593 Ca 0.20 -1.37 0.29 0.00 -0.94 0.00 0.00 52.86 51.04 3h73 s ASN 593 Cb 0.05 0.23 1.20 0.00 -2.00 0.00 0.00 41.25 40.72 3h73 s ASN 593 CO 0.02 -0.86 1.85 0.59 -2.94 0.00 0.00 177.10 175.77 3h73 n ASN 594 N -1.42 0.33 -0.03 3.54 3.02 -1.26 -1.38 115.26 118.06 3h73 n ASN 594 Ca -0.08 -0.31 -0.16 0.00 -0.03 0.00 0.00 54.58 54.00 3h73 n ASN 594 Cb 0.65 -0.14 -0.13 0.00 -0.61 0.00 0.00 39.78 39.56 3h73 n ASN 594 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3h73 h VAL 595 N 0.33 1.65 0.00 2.41 2.07 -1.89 -3.42 116.25 117.40 3h73 h VAL 595 Ca 0.00 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.30 3h73 h VAL 595 Cb 0.38 3.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 3h73 h VAL 595 CO 0.00 0.60 0.00 -1.54 0.02 0.00 0.00 177.57 176.65 3h73 n SER 596 N -4.49 0.23 0.00 0.57 3.41 -1.25 -5.06 113.62 107.04 3h73 n SER 596 Ca -0.11 -1.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.48 3h73 n SER 596 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 3h73 n SER 596 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3h73 n HIS 597 N -0.01 0.00 0.80 7.33 -0.00 -0.48 -0.44 115.22 122.42 3h73 n HIS 597 Ca 0.00 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.30 3h73 n HIS 597 Cb 0.22 0.00 0.50 0.00 -0.12 0.00 0.00 29.99 30.60 3h73 n HIS 597 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 3h73 n LEU 598 N 0.00 0.08 0.12 0.27 4.77 -1.26 -2.10 117.00 118.88 3h73 n LEU 598 Ca 0.00 0.51 -0.02 0.00 -0.03 0.00 0.00 56.01 56.48 3h73 n LEU 598 Cb 0.00 -0.49 0.08 0.00 -2.33 0.00 0.00 43.42 40.68 3h73 n LEU 598 CO 0.00 -0.11 0.40 0.78 -1.33 0.00 0.00 177.39 177.13 3h73 h ASN 599 N 0.00 0.00 0.00 -1.43 2.35 -1.18 -3.43 115.58 111.89 3h73 h ASN 599 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 3h73 h ASN 599 Cb 0.43 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.75 3h73 h ASN 599 CO 0.00 0.69 -0.13 0.61 -1.65 0.00 0.00 177.43 176.96 3h73 n GLY 600 N 0.78 0.07 0.00 2.83 0.00 -1.16 -4.25 105.19 103.47 3h73 n GLY 600 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h73 n GLY 600 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h73 n SER 601 N 0.00 0.27 -4.67 1.61 3.41 -0.89 -1.45 113.62 111.90 3h73 n SER 601 Ca -0.12 -0.60 -0.51 0.00 -0.26 0.00 0.00 58.87 57.38 3h73 n SER 601 Cb 0.45 0.38 -0.05 0.00 -0.26 0.00 0.00 64.21 64.72 3h73 n SER 601 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h73 n GLN 602 N -0.38 1.79 -3.84 4.33 6.02 -1.25 -4.48 117.38 119.57 3h73 n GLN 602 Ca 0.00 0.65 -0.20 0.00 -0.01 0.00 0.00 57.00 57.44 3h73 n GLN 602 Cb 0.04 -2.41 -0.17 0.00 1.02 0.00 0.00 30.24 28.71 3h73 n GLN 602 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3h73 s SER 603 N 2.79 1.09 0.61 1.08 0.01 -0.48 -1.43 113.70 117.37 3h73 s SER 603 Ca 0.90 -0.04 -0.15 0.00 1.31 0.00 0.00 55.95 57.97 3h73 s SER 603 Cb -0.82 -0.32 -0.03 0.00 0.21 0.00 0.00 66.02 65.06 3h73 s SER 603 CO 0.51 -0.16 1.06 -0.44 0.41 0.00 0.00 173.24 174.62 3h73 s SER 604 N 1.61 5.73 0.01 2.44 0.01 0.17 -2.05 113.70 121.62 3h73 s SER 604 Ca -0.01 1.79 -0.14 0.00 1.31 0.00 0.00 55.95 58.90 3h73 s SER 604 Cb -0.13 -2.53 0.05 0.00 0.21 0.00 0.00 66.02 63.62 3h73 s SER 604 CO -0.03 -1.20 0.64 -2.11 0.41 0.00 0.00 173.24 170.95 3h73 n ARG 605 N -2.17 0.14 -4.23 12.44 1.85 -0.31 -2.28 116.66 122.11 3h73 n ARG 605 Ca 0.09 -0.48 -0.13 0.00 -1.00 0.00 0.00 57.85 56.33 3h73 n ARG 605 Cb 0.53 0.74 -0.10 0.00 -1.05 0.00 0.00 32.46 32.58 3h73 n ARG 605 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 3h73 s ILE 606 N -2.13 0.79 0.19 8.89 -5.25 -1.26 -1.02 121.20 121.42 3h73 s ILE 606 Ca 0.15 -1.99 0.11 0.00 -0.99 0.00 0.00 60.65 57.93 3h73 s ILE 606 Cb -0.01 -1.98 -0.04 0.00 2.95 0.00 0.00 42.46 43.38 3h73 s ILE 606 CO 0.00 -0.61 -0.20 0.27 -1.79 0.00 0.00 174.94 172.62 3h73 s ILE 607 N -3.58 2.59 0.16 8.37 -4.36 -0.51 -1.11 121.20 122.77 3h73 s ILE 607 Ca 0.20 -1.95 -0.05 0.00 -0.26 0.00 0.00 60.65 58.59 3h73 s ILE 607 Cb 0.05 -2.26 -0.02 0.00 1.25 0.00 0.00 42.46 41.48 3h73 s ILE 607 CO 0.02 -0.13 0.19 -0.72 0.24 0.00 0.00 174.94 174.54 3h73 s TYR 608 N -1.72 0.67 -0.03 1.37 -0.85 0.17 -1.47 117.35 115.49 3h73 s TYR 608 Ca 0.22 -1.02 -0.01 0.00 -0.52 0.00 0.00 57.07 55.75 3h73 s TYR 608 Cb -0.08 -0.26 0.03 0.00 0.38 0.00 0.00 41.96 42.03 3h73 s TYR 608 CO 0.12 -0.66 0.05 0.45 -1.52 0.00 0.00 175.55 173.98 3h73 s SER 609 N -3.03 0.47 0.00 -0.18 0.15 -0.92 -0.03 113.70 110.16 3h73 s SER 609 Ca 0.23 0.06 0.22 0.00 0.70 0.00 0.00 55.95 57.16 3h73 s SER 609 Cb 0.05 -0.09 0.35 0.00 -1.71 0.00 0.00 66.02 64.63 3h73 s SER 609 CO 0.03 -0.18 1.33 0.47 1.20 0.00 0.00 173.24 176.09 3h73 n ASP 610 N 4.61 3.26 -2.10 5.45 8.00 -1.26 -1.84 116.55 132.67 3h73 n ASP 610 Ca -0.19 -1.96 -0.16 0.00 0.71 0.00 0.00 54.79 53.19 3h73 n ASP 610 Cb 0.50 -0.19 0.04 0.00 -0.02 0.00 0.00 41.12 41.45 3h73 n ASP 610 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3h73 n ASP 611 N 1.37 3.92 -3.19 -2.24 5.68 -1.26 -4.95 116.55 115.87 3h73 n ASP 611 Ca 0.17 -3.35 -0.22 0.00 -0.50 0.00 0.00 54.79 50.88 3h73 n ASP 611 Cb 0.58 -0.38 0.06 0.00 -1.14 0.00 0.00 41.12 40.23 3h73 n ASP 611 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3h73 n HIS 612 N -0.69 -2.35 -0.54 2.11 8.25 -1.26 -2.90 115.22 117.85 3h73 n HIS 612 Ca 0.34 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.54 3h73 n HIS 612 Cb 0.92 -4.64 0.00 0.00 1.12 0.00 0.00 29.99 27.39 3h73 n HIS 612 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h73 n GLY 613 N -1.73 0.77 0.13 -1.41 0.00 -1.26 -4.95 105.19 96.73 3h73 n GLY 613 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 3h73 n GLY 613 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h73 h LYS 614 N 3.87 -0.20 -5.80 1.61 1.57 -1.94 -3.45 116.57 112.23 3h73 h LYS 614 Ca 0.00 0.01 -0.49 0.00 -1.87 0.00 0.00 60.65 58.30 3h73 h LYS 614 Cb 0.00 0.05 -0.20 0.00 0.08 0.00 0.00 32.23 32.16 3h73 h LYS 614 CO 0.00 0.13 -0.79 0.95 -0.57 0.00 0.00 179.45 179.17 3h73 s THR 615 N -4.75 1.57 0.12 -0.16 -4.23 -1.26 -5.11 115.64 101.82 3h73 s THR 615 Ca -0.15 -1.68 0.09 0.00 -1.18 0.00 0.00 61.69 58.78 3h73 s THR 615 Cb 0.03 -1.58 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 3h73 s THR 615 CO 0.61 -0.25 -0.23 0.26 -0.54 0.00 0.00 174.62 174.47 3h73 s TRP 616 N -1.71 1.97 0.00 3.99 0.52 -1.26 -4.42 118.94 118.04 3h73 s TRP 616 Ca 0.09 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 55.82 3h73 s TRP 616 Cb -0.07 -1.06 -0.01 0.00 -1.15 0.00 0.00 33.47 31.17 3h73 s TRP 616 CO 0.04 0.27 -0.07 -1.01 0.02 0.00 0.00 176.95 176.21 3h73 s HIS 617 N -1.22 0.60 -0.07 -1.98 3.76 0.96 -4.56 115.29 112.77 3h73 s HIS 617 Ca 0.10 -0.17 -0.16 0.00 -0.15 0.00 0.00 55.06 54.68 3h73 s HIS 617 Cb -0.10 -0.38 -0.05 0.00 1.11 0.00 0.00 32.58 33.17 3h73 s HIS 617 CO 0.05 -0.02 0.43 0.00 -0.85 0.00 0.00 174.74 174.35 3h73 s ALA 618 N -0.36 3.59 0.84 -1.40 0.00 -1.26 0.46 121.76 123.62 3h73 s ALA 618 Ca 0.01 -0.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.69 3h73 s ALA 618 Cb -0.04 -2.51 0.09 0.00 0.00 0.00 0.00 23.12 20.66 3h73 s ALA 618 CO -0.00 0.23 0.53 0.41 0.00 0.00 0.00 175.76 176.92 3h73 n GLY 619 N 2.63 -0.59 3.89 0.00 0.00 -0.27 -4.95 105.19 105.89 3h73 n GLY 619 Ca -0.11 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.83 3h73 n GLY 619 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h73 s GLU 620 N -4.02 3.66 0.42 1.61 2.02 0.14 -4.77 118.70 117.77 3h73 s GLU 620 Ca 0.31 0.26 -0.22 0.00 0.02 0.00 0.00 54.97 55.34 3h73 s GLU 620 Cb -0.01 -2.44 -0.09 0.00 0.10 0.00 0.00 34.13 31.68 3h73 s GLU 620 CO 0.22 -0.04 1.01 0.00 0.02 0.00 0.00 175.26 176.46 3h73 s ALA 621 N -2.44 3.02 0.27 5.21 0.00 -1.26 -4.57 121.76 121.99 3h73 s ALA 621 Ca 0.48 0.57 -0.01 0.00 0.00 0.00 0.00 51.96 53.00 3h73 s ALA 621 Cb -0.10 -3.22 0.46 0.00 0.00 0.00 0.00 23.12 20.25 3h73 s ALA 621 CO 0.36 -0.10 1.87 0.28 0.00 0.00 0.00 175.76 178.16 3h73 h VAL 622 N 1.97 1.03 0.00 0.00 2.07 -1.81 -1.32 116.25 118.19 3h73 h VAL 622 Ca -0.49 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 66.65 3h73 h VAL 622 Cb 1.20 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 3h73 h VAL 622 CO 0.61 0.20 0.00 0.59 0.02 0.00 0.00 177.57 179.00 3h73 n ASN 623 N -4.54 0.00 -4.62 0.57 5.03 -1.26 -4.55 115.26 105.88 3h73 n ASN 623 Ca 0.17 0.40 -0.43 0.00 0.87 0.00 0.00 54.58 55.59 3h73 n ASN 623 Cb 0.24 -0.46 -0.03 0.00 -1.02 0.00 0.00 39.78 38.52 3h73 n ASN 623 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3h73 s ASP 624 N -2.91 6.21 -1.23 6.41 1.01 -0.50 -1.77 116.67 123.89 3h73 s ASP 624 Ca 0.11 1.71 0.00 0.00 0.71 0.00 0.00 52.55 55.07 3h73 s ASP 624 Cb 0.12 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.52 3h73 s ASP 624 CO 0.33 -1.38 0.00 -3.20 0.21 0.00 0.00 175.17 171.13 3h73 n ASN 625 N 9.00 -4.29 -4.78 0.27 5.15 -0.03 -4.96 115.26 115.63 3h73 n ASN 625 Ca 0.21 0.15 -0.38 0.00 -0.60 0.00 0.00 54.58 53.96 3h73 n ASN 625 Cb 0.45 -3.19 -0.06 0.00 -0.53 0.00 0.00 39.78 36.45 3h73 n ASN 625 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3h73 s ARG 626 N -3.85 4.61 -0.30 1.20 3.52 -0.73 -4.74 118.95 118.66 3h73 s ARG 626 Ca 0.00 1.27 -0.23 0.00 -0.13 0.00 0.00 55.73 56.65 3h73 s ARG 626 Cb 0.00 -3.02 -0.00 0.00 -1.56 0.00 0.00 34.95 30.37 3h73 s ARG 626 CO 0.00 0.41 0.75 -1.14 -0.81 0.00 0.00 175.30 174.51 3h73 s GLN 627 N -1.65 3.97 -0.03 5.12 -0.44 -1.26 -0.71 119.66 124.67 3h73 s GLN 627 Ca 0.44 0.55 0.03 0.00 -2.50 0.00 0.00 55.36 53.88 3h73 s GLN 627 Cb -0.21 -3.72 0.00 0.00 -1.64 0.00 0.00 33.01 27.45 3h73 s GLN 627 CO 0.26 -0.63 -0.10 0.08 0.50 0.00 0.00 175.29 175.40 3h73 s VAL 628 N 2.85 0.87 -1.27 1.34 1.01 0.21 -4.83 120.40 120.59 3h73 s VAL 628 Ca 0.31 -0.40 -0.16 0.00 0.00 0.00 0.00 61.98 61.73 3h73 s VAL 628 Cb -0.14 -0.77 0.16 0.00 0.00 0.00 0.00 36.38 35.62 3h73 s VAL 628 CO 0.12 0.27 0.41 0.47 0.00 0.00 0.00 175.10 176.37 3h73 n ASP 629 N 3.30 -1.66 0.00 3.32 8.00 -1.26 -1.28 116.55 126.97 3h73 n ASP 629 Ca -0.18 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.66 3h73 n ASP 629 Cb 0.54 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 3h73 n ASP 629 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h73 n GLY 630 N -0.89 3.10 3.77 0.44 0.00 -1.26 -5.07 105.19 105.28 3h73 n GLY 630 Ca 0.08 -0.99 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 3h73 n GLY 630 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3h73 s GLN 631 N 0.00 2.20 0.00 1.61 -2.07 -0.41 -5.06 119.66 115.93 3h73 s GLN 631 Ca 0.00 -2.05 -0.16 0.00 -1.82 0.00 0.00 55.36 51.33 3h73 s GLN 631 Cb 0.00 -1.86 -0.06 0.00 -1.09 0.00 0.00 33.01 30.00 3h73 s GLN 631 CO 0.00 -0.28 0.45 0.15 -1.32 0.00 0.00 175.29 174.29 3h73 s LYS 632 N -3.96 4.02 0.53 9.60 -0.14 -1.26 0.67 119.74 129.20 3h73 s LYS 632 Ca 0.30 0.49 0.01 0.00 -1.36 0.00 0.00 55.97 55.41 3h73 s LYS 632 Cb 0.03 -3.25 0.01 0.00 -1.68 0.00 0.00 37.83 32.94 3h73 s LYS 632 CO 0.17 0.62 0.09 0.44 -0.76 0.00 0.00 175.35 175.91 3h73 n ILE 633 N 1.99 0.00 -3.85 2.17 -5.35 0.12 -4.93 119.36 109.51 3h73 n ILE 633 Ca -0.12 -2.40 -0.12 0.00 -0.27 0.00 0.00 62.75 59.84 3h73 n ILE 633 Cb 0.52 0.38 -0.12 0.00 -1.74 0.00 0.00 39.64 38.68 3h73 n ILE 633 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 3h73 s HIS 634 N -2.85 -0.05 0.58 4.28 2.46 -1.26 -0.85 115.29 117.60 3h73 s HIS 634 Ca 0.07 0.13 0.28 0.00 0.47 0.00 0.00 55.06 56.01 3h73 s HIS 634 Cb -0.01 -0.00 1.75 0.00 -0.13 0.00 0.00 32.58 34.20 3h73 s HIS 634 CO 0.04 -0.14 2.24 0.66 -2.47 0.00 0.00 174.74 175.07 3h73 h SER 635 N 5.35 0.00 1.43 9.88 4.64 -1.94 0.19 113.55 133.10 3h73 h SER 635 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3h73 h SER 635 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3h73 h SER 635 CO 0.42 0.00 -0.08 0.77 -0.87 0.00 0.00 176.83 177.07 3h73 h SER 636 N 0.00 0.00 0.00 4.97 4.64 -1.95 -3.37 113.55 117.83 3h73 h SER 636 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3h73 h SER 636 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h73 h SER 636 CO 0.00 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.32 3h73 n THR 637 N -2.30 0.00 -1.32 2.95 -2.24 -0.84 -4.62 114.28 105.91 3h73 n THR 637 Ca 0.05 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.25 3h73 n THR 637 Cb 0.44 1.07 0.11 0.00 -2.10 0.00 0.00 70.33 69.84 3h73 n THR 637 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h73 s MET 638 N -0.42 1.96 -0.45 -0.78 0.00 0.60 -4.92 119.30 115.28 3h73 s MET 638 Ca 0.00 1.76 0.07 0.00 0.00 0.00 0.00 55.69 57.52 3h73 s MET 638 Cb 0.00 -1.81 0.25 0.00 0.00 0.00 0.00 34.83 33.27 3h73 s MET 638 CO 0.00 -1.98 0.79 -1.71 0.00 0.00 0.00 175.02 172.13 3h73 n ASN 639 N -2.93 -1.85 -3.60 -1.18 5.15 -1.23 -4.37 115.26 105.26 3h73 n ASN 639 Ca 0.13 -3.15 -0.25 0.00 -0.60 0.00 0.00 54.58 50.72 3h73 n ASN 639 Cb 0.50 1.04 -0.16 0.00 -0.53 0.00 0.00 39.78 40.63 3h73 n ASN 639 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 3h73 s ASN 640 N -1.54 2.21 0.11 1.20 3.84 -0.53 -4.96 114.94 115.27 3h73 s ASN 640 Ca 0.32 -0.56 -0.21 0.00 0.21 0.00 0.00 52.86 52.63 3h73 s ASN 640 Cb 0.22 -0.16 -0.08 0.00 -0.55 0.00 0.00 41.25 40.68 3h73 s ASN 640 CO -0.19 -0.35 1.74 -0.09 -2.79 0.00 0.00 177.10 175.42 3h73 h ARG 641 N 8.41 0.07 0.00 0.43 2.43 -1.77 -2.73 114.38 121.22 3h73 h ARG 641 Ca -0.15 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3h73 h ARG 641 Cb 1.15 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3h73 h ARG 641 CO 0.29 0.05 0.00 -0.09 -1.51 0.00 0.00 179.97 178.71 3h73 h ARG 642 N 0.07 0.00 -0.01 0.20 2.43 -1.92 -2.73 114.38 112.43 3h73 h ARG 642 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3h73 h ARG 642 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3h73 h ARG 642 CO -0.08 0.00 -0.15 0.00 -1.51 0.00 0.00 179.97 178.22 3h73 n ALA 643 N -2.00 2.87 -1.45 2.80 0.00 -1.04 -4.70 120.51 116.99 3h73 n ALA 643 Ca 0.01 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.77 3h73 n ALA 643 Cb 0.28 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 18.56 3h73 n ALA 643 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3h73 s GLN 644 N -2.40 2.69 -0.14 0.00 -0.21 -1.03 -4.98 119.66 113.59 3h73 s GLN 644 Ca 0.29 1.29 -0.07 0.00 0.02 0.00 0.00 55.36 56.89 3h73 s GLN 644 Cb 0.20 -1.94 0.06 0.00 1.00 0.00 0.00 33.01 32.32 3h73 s GLN 644 CO 0.47 -1.32 0.33 0.54 -2.12 0.00 0.00 175.29 173.19 3h73 s ASN 645 N -2.90 -0.28 0.00 5.90 2.20 -0.51 -4.55 114.94 114.79 3h73 s ASN 645 Ca 0.64 0.72 0.00 0.00 -0.94 0.00 0.00 52.86 53.29 3h73 s ASN 645 Cb -0.19 0.68 0.00 0.00 -2.00 0.00 0.00 41.25 39.74 3h73 s ASN 645 CO 0.46 -0.19 0.00 0.35 -2.94 0.00 0.00 177.10 174.78 3h73 n THR 646 N 4.51 0.00 -1.85 0.54 -2.24 -0.29 -0.65 114.28 114.29 3h73 n THR 646 Ca -0.20 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 3h73 n THR 646 Cb 0.53 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.77 3h73 n THR 646 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h73 s GLU 647 N 2.40 3.77 0.20 -0.78 2.02 -1.26 -4.27 118.70 120.78 3h73 s GLU 647 Ca 0.00 2.38 -0.05 0.00 0.02 0.00 0.00 54.97 57.33 3h73 s GLU 647 Cb 0.00 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.50 3h73 s GLU 647 CO 0.00 -0.74 0.22 -1.54 0.02 0.00 0.00 175.26 173.23 3h73 s SER 648 N -0.52 0.10 0.00 -0.19 1.04 -1.26 -0.24 113.70 112.63 3h73 s SER 648 Ca 0.60 -1.18 0.05 0.00 0.48 0.00 0.00 55.95 55.89 3h73 s SER 648 Cb -0.43 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.10 3h73 s SER 648 CO 0.56 -0.90 -0.15 0.28 0.98 0.00 0.00 173.24 174.00 3h73 s THR 649 N -4.08 1.18 -0.02 2.02 -1.32 -0.38 -4.73 115.64 108.31 3h73 s THR 649 Ca 0.30 -0.74 0.07 0.00 -1.21 0.00 0.00 61.69 60.11 3h73 s THR 649 Cb 0.05 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 70.01 3h73 s THR 649 CO 0.08 0.25 -0.23 0.54 -2.21 0.00 0.00 174.62 173.06 3h73 s VAL 650 N -0.47 2.35 -0.02 5.08 0.11 -1.26 -1.23 120.40 124.95 3h73 s VAL 650 Ca 0.05 -1.04 -0.03 0.00 -2.93 0.00 0.00 61.98 58.02 3h73 s VAL 650 Cb -0.06 -1.86 0.01 0.00 -1.53 0.00 0.00 36.38 32.93 3h73 s VAL 650 CO -0.00 0.55 0.09 -0.69 -3.33 0.00 0.00 175.10 171.72 3h73 s VAL 651 N -0.67 0.02 -0.10 2.04 1.01 -0.72 -4.76 120.40 117.22 3h73 s VAL 651 Ca 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 3h73 s VAL 651 Cb -0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 3h73 s VAL 651 CO -0.00 -0.09 -0.01 -1.58 0.00 0.00 0.00 175.10 173.41 3h73 s GLN 652 N -0.27 3.07 0.57 2.72 0.74 -1.26 -0.26 119.66 124.97 3h73 s GLN 652 Ca -0.03 -0.45 -0.03 0.00 0.05 0.00 0.00 55.36 54.90 3h73 s GLN 652 Cb -0.02 -2.79 0.02 0.00 1.10 0.00 0.00 33.01 31.32 3h73 s GLN 652 CO 0.00 0.62 0.85 -0.51 -0.55 0.00 0.00 175.29 175.70 3h73 s LEU 653 N -0.65 3.25 0.57 3.68 1.43 0.22 -4.90 118.68 122.27 3h73 s LEU 653 Ca 0.10 0.44 0.36 0.00 -1.03 0.00 0.00 54.13 54.00 3h73 s LEU 653 Cb -0.12 -3.25 1.65 0.00 0.03 0.00 0.00 46.19 44.50 3h73 s LEU 653 CO 0.02 -1.10 2.08 0.78 0.23 0.00 0.00 176.35 178.36 3h73 h ASN 654 N -0.09 0.00 0.13 2.29 2.35 -2.00 -1.93 115.58 116.34 3h73 h ASN 654 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 3h73 h ASN 654 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 3h73 h ASN 654 CO 0.58 0.00 -0.02 -0.46 -1.65 0.00 0.00 177.43 175.89 3h73 n ASN 655 N -3.06 0.30 0.00 5.81 2.04 -1.26 -4.91 115.26 114.18 3h73 n ASN 655 Ca -0.00 -0.89 0.00 0.00 -0.44 0.00 0.00 54.58 53.24 3h73 n ASN 655 Cb 0.24 -0.05 0.00 0.00 -2.53 0.00 0.00 39.78 37.44 3h73 n ASN 655 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3h73 n GLY 656 N 1.11 2.99 3.78 4.83 0.00 -0.72 -5.02 105.19 112.16 3h73 n GLY 656 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 3h73 n GLY 656 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h73 s ASP 657 N -1.15 6.03 -0.15 1.61 1.01 -1.26 -4.75 116.67 118.01 3h73 s ASP 657 Ca 0.00 2.13 -0.03 0.00 0.71 0.00 0.00 52.55 55.35 3h73 s ASP 657 Cb 0.00 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 3h73 s ASP 657 CO 0.00 -1.01 -0.04 -0.69 0.21 0.00 0.00 175.17 173.64 3h73 s VAL 658 N -1.78 3.86 -0.13 -1.27 1.01 0.20 -0.61 120.40 121.68 3h73 s VAL 658 Ca 0.69 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 3h73 s VAL 658 Cb -0.23 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 3h73 s VAL 658 CO 0.26 0.50 -0.02 -0.54 0.00 0.00 0.00 175.10 175.30 3h73 s LYS 659 N 0.31 3.42 -0.25 2.72 -0.14 0.64 -0.36 119.74 126.08 3h73 s LYS 659 Ca -0.04 -0.48 0.01 0.00 -1.36 0.00 0.00 55.97 54.11 3h73 s LYS 659 Cb -0.14 -2.88 0.05 0.00 -1.68 0.00 0.00 37.83 33.18 3h73 s LYS 659 CO 0.03 0.41 -0.10 -1.17 -0.76 0.00 0.00 175.35 173.76 3h73 s LEU 660 N -0.09 3.25 -0.33 3.17 2.96 0.01 -1.76 118.68 125.89 3h73 s LEU 660 Ca 0.03 -1.16 -0.19 0.00 -0.22 0.00 0.00 54.13 52.59 3h73 s LEU 660 Cb -0.13 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 44.97 3h73 s LEU 660 CO 0.02 -0.16 0.55 -0.36 -1.32 0.00 0.00 176.35 175.08 3h73 s PHE 661 N 1.20 3.19 -0.11 5.38 0.40 -0.37 -1.06 117.98 126.61 3h73 s PHE 661 Ca -0.04 0.34 -0.00 0.00 -0.60 0.00 0.00 56.93 56.63 3h73 s PHE 661 Cb -0.18 -2.93 -0.02 0.00 0.51 0.00 0.00 43.02 40.39 3h73 s PHE 661 CO -0.06 -0.50 -0.10 -1.64 0.70 0.00 0.00 175.22 173.63 3h73 s MET 662 N 2.46 3.19 0.17 0.44 -1.94 -0.65 -1.25 119.30 121.73 3h73 s MET 662 Ca 0.21 -0.62 -0.31 0.00 -1.71 0.00 0.00 55.69 53.26 3h73 s MET 662 Cb -0.15 -2.66 -0.10 0.00 2.01 0.00 0.00 34.83 33.93 3h73 s MET 662 CO 0.13 0.38 1.54 0.50 -0.01 0.00 0.00 175.02 177.55 3h73 s ARG 663 N -0.06 4.23 0.00 2.03 3.52 0.67 -4.21 118.95 125.13 3h73 s ARG 663 Ca -0.01 2.33 0.00 0.00 -0.13 0.00 0.00 55.73 57.92 3h73 s ARG 663 Cb -0.14 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.10 3h73 s ARG 663 CO 0.03 -0.57 0.00 0.41 -0.81 0.00 0.00 175.30 174.36 3h73 n GLY 664 N 3.53 3.41 0.72 8.12 0.00 -1.26 -1.14 105.19 118.57 3h73 n GLY 664 Ca 0.13 -1.45 0.04 0.00 0.00 0.00 0.00 46.02 44.74 3h73 n GLY 664 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h73 n LEU 665 N 0.00 3.07 -0.12 0.99 4.77 -1.26 -4.02 117.00 120.43 3h73 n LEU 665 Ca 0.00 -3.82 0.11 0.00 -0.03 0.00 0.00 56.01 52.27 3h73 n LEU 665 Cb 0.00 -0.55 0.01 0.00 -2.33 0.00 0.00 43.42 40.55 3h73 n LEU 665 CO 0.00 1.33 0.17 0.35 -1.33 0.00 0.00 177.39 177.91 3h73 n THR 666 N -1.13 0.00 0.00 -5.08 -2.24 -1.26 -4.95 114.28 99.62 3h73 n THR 666 Ca 0.23 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 3h73 n THR 666 Cb 0.78 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 3h73 n THR 666 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h73 n GLY 667 N 1.47 1.99 3.42 3.38 0.00 -1.25 -5.00 105.19 109.20 3h73 n GLY 667 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 3h73 n GLY 667 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3h73 s ASP 668 N -2.49 2.23 -0.06 1.61 1.47 -1.26 -1.55 116.67 116.62 3h73 s ASP 668 Ca 0.00 -1.63 -0.30 0.00 1.18 0.00 0.00 52.55 51.80 3h73 s ASP 668 Cb 0.00 0.44 -0.04 0.00 -0.34 0.00 0.00 42.92 42.98 3h73 s ASP 668 CO 0.00 -0.92 1.31 -0.22 0.68 0.00 0.00 175.17 176.03 3h73 s LEU 669 N -3.50 4.27 -0.15 2.11 2.96 -0.17 -4.44 118.68 119.76 3h73 s LEU 669 Ca 0.30 1.92 -0.04 0.00 -0.22 0.00 0.00 54.13 56.09 3h73 s LEU 669 Cb 0.04 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 3h73 s LEU 669 CO 0.17 -0.69 -0.01 -1.10 -1.32 0.00 0.00 176.35 173.40 3h73 s GLN 670 N 2.65 3.65 -0.05 1.98 -0.21 -1.26 -1.04 119.66 125.38 3h73 s GLN 670 Ca 0.59 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 55.52 3h73 s GLN 670 Cb -0.27 -2.96 0.02 0.00 1.00 0.00 0.00 33.01 30.80 3h73 s GLN 670 CO 0.23 0.31 -0.08 0.08 -2.12 0.00 0.00 175.29 173.70 3h73 s VAL 671 N 0.20 0.79 0.20 1.09 1.01 0.71 -1.63 120.40 122.77 3h73 s VAL 671 Ca -0.00 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 61.75 3h73 s VAL 671 Cb -0.13 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 3h73 s VAL 671 CO 0.02 0.27 0.13 0.00 0.00 0.00 0.00 175.10 175.52 3h73 s ALA 672 N 0.70 3.50 -0.02 5.51 0.00 -0.23 -1.17 121.76 130.04 3h73 s ALA 672 Ca -0.12 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 50.54 3h73 s ALA 672 Cb -0.14 -1.25 -0.00 0.00 0.00 0.00 0.00 23.12 21.73 3h73 s ALA 672 CO 0.02 0.40 -0.11 0.99 0.00 0.00 0.00 175.76 177.05 3h73 s THR 673 N -1.92 0.91 -0.06 0.00 2.01 -1.26 -0.81 115.64 114.51 3h73 s THR 673 Ca 0.31 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 61.92 3h73 s THR 673 Cb -0.09 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.62 3h73 s THR 673 CO 0.23 0.27 -0.23 -0.55 -0.69 0.00 0.00 174.62 173.66 3h73 s SER 674 N 0.07 2.80 0.00 3.53 0.15 0.51 -0.53 113.70 120.23 3h73 s SER 674 Ca -0.02 -0.47 0.17 0.00 0.70 0.00 0.00 55.95 56.33 3h73 s SER 674 Cb -0.08 -0.82 0.19 0.00 -1.71 0.00 0.00 66.02 63.60 3h73 s SER 674 CO 0.01 0.21 1.09 0.29 1.20 0.00 0.00 173.24 176.04 3h73 n LYS 675 N 3.06 1.58 -1.95 5.44 5.02 -1.26 -0.62 118.16 129.43 3h73 n LYS 675 Ca -0.18 -1.64 -0.12 0.00 -2.02 0.00 0.00 58.31 54.34 3h73 n LYS 675 Cb 0.52 -1.34 0.06 0.00 -0.02 0.00 0.00 35.03 34.25 3h73 n LYS 675 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3h73 n ASP 676 N 0.96 3.46 -0.35 4.39 5.68 -1.26 -4.94 116.55 124.49 3h73 n ASP 676 Ca 0.11 -3.29 -0.04 0.00 -0.50 0.00 0.00 54.79 51.08 3h73 n ASP 676 Cb 0.44 -0.40 -0.01 0.00 -1.14 0.00 0.00 41.12 40.01 3h73 n ASP 676 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h73 n GLY 677 N -0.68 0.43 1.24 6.12 0.00 -1.26 -3.72 105.19 107.32 3h73 n GLY 677 Ca 0.30 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3h73 n GLY 677 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h73 n GLY 678 N -1.74 0.75 0.15 -0.02 0.00 -1.26 -4.97 105.19 98.10 3h73 n GLY 678 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 3h73 n GLY 678 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h73 h VAL 679 N 0.00 1.37 -3.42 1.61 2.07 -1.92 -3.41 116.25 112.54 3h73 h VAL 679 Ca 0.00 -2.41 -0.36 0.00 0.82 0.00 0.00 66.70 64.75 3h73 h VAL 679 Cb 0.00 2.81 -0.16 0.00 -1.52 0.00 0.00 31.29 32.42 3h73 h VAL 679 CO 0.00 0.71 -0.73 0.42 0.02 0.00 0.00 177.57 177.99 3h73 s THR 680 N -2.88 1.25 -0.05 2.57 -4.23 -1.26 0.27 115.64 111.31 3h73 s THR 680 Ca -0.11 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 58.53 3h73 s THR 680 Cb 0.04 -1.72 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 3h73 s THR 680 CO 0.89 -0.62 -0.24 0.26 -0.54 0.00 0.00 174.62 174.37 3h73 s TRP 681 N -2.85 2.31 0.94 3.99 0.52 -1.26 -4.24 118.94 118.34 3h73 s TRP 681 Ca 0.14 -0.62 -0.11 0.00 0.02 0.00 0.00 56.10 55.54 3h73 s TRP 681 Cb -0.01 -1.51 0.16 0.00 -1.15 0.00 0.00 33.47 30.97 3h73 s TRP 681 CO 0.02 -0.16 1.12 -1.21 0.02 0.00 0.00 176.95 176.73 3h73 s GLU 682 N -0.27 0.80 0.68 4.98 0.41 0.31 -4.99 118.70 120.63 3h73 s GLU 682 Ca 0.00 1.35 -0.15 0.00 -0.41 0.00 0.00 54.97 55.77 3h73 s GLU 682 Cb -0.12 -1.72 0.01 0.00 -1.78 0.00 0.00 34.13 30.52 3h73 s GLU 682 CO 0.02 -2.72 1.12 0.21 -0.49 0.00 0.00 175.26 173.41 3h73 s LYS 683 N -4.65 2.66 -0.13 1.61 2.20 -1.26 -4.70 119.74 115.45 3h73 s LYS 683 Ca 0.66 1.42 -0.09 0.00 -0.36 0.00 0.00 55.97 57.60 3h73 s LYS 683 Cb -0.22 -1.93 0.04 0.00 -1.51 0.00 0.00 37.83 34.20 3h73 s LYS 683 CO 0.59 -1.37 0.19 -0.25 -0.36 0.00 0.00 175.35 174.15 3h73 n ASP 684 N -2.55 -1.49 -4.74 1.43 8.00 -1.26 -4.95 116.55 110.98 3h73 n ASP 684 Ca 0.11 1.18 -0.41 0.00 0.71 0.00 0.00 54.79 56.37 3h73 n ASP 684 Cb 0.52 -4.56 -0.04 0.00 -0.02 0.00 0.00 41.12 37.02 3h73 n ASP 684 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3h73 s ILE 685 N -0.55 3.73 0.06 0.53 1.09 -1.26 -4.93 121.20 119.87 3h73 s ILE 685 Ca -0.22 1.50 -0.21 0.00 -1.10 0.00 0.00 60.65 60.62 3h73 s ILE 685 Cb 0.01 -3.96 -0.06 0.00 -1.06 0.00 0.00 42.46 37.39 3h73 s ILE 685 CO 0.58 0.26 0.63 -0.75 -0.10 0.00 0.00 174.94 175.57 3h73 s LYS 686 N -0.42 4.33 -0.04 2.79 2.47 -0.32 -4.89 119.74 123.66 3h73 s LYS 686 Ca 0.50 0.84 0.07 0.00 -1.56 0.00 0.00 55.97 55.82 3h73 s LYS 686 Cb -0.31 -3.29 -0.02 0.00 -1.46 0.00 0.00 37.83 32.76 3h73 s LYS 686 CO 0.36 0.51 -0.24 1.03 0.16 0.00 0.00 175.35 177.17 3h73 s ARG 687 N -0.73 2.35 -0.35 4.03 0.52 -1.26 -0.21 118.95 123.30 3h73 s ARG 687 Ca 0.32 -0.89 0.04 0.00 -0.52 0.00 0.00 55.73 54.68 3h73 s ARG 687 Cb -0.20 -2.14 0.10 0.00 0.52 0.00 0.00 34.95 33.24 3h73 s ARG 687 CO 0.20 0.49 0.06 0.71 0.02 0.00 0.00 175.30 176.78 3h73 s TYR 688 N -0.43 3.71 0.66 -0.53 2.02 -0.21 -4.96 117.35 117.62 3h73 s TYR 688 Ca 0.04 -3.00 0.43 0.00 -0.37 0.00 0.00 57.07 54.17 3h73 s TYR 688 Cb -0.12 -2.91 2.37 0.00 -0.40 0.00 0.00 41.96 40.91 3h73 s TYR 688 CO 0.01 -0.94 2.36 -1.35 -1.57 0.00 0.00 175.55 174.06 3h73 h PRO 689 N 7.56 0.00 0.00 -1.71 0.11 -1.96 -1.90 132.00 134.10 3h73 h PRO 689 Ca -0.04 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3h73 h PRO 689 Cb 1.01 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3h73 h PRO 689 CO 0.53 0.00 -0.18 1.96 -0.21 0.00 0.00 178.00 180.10 3h73 h GLN 690 N 0.00 0.00 -4.88 1.05 7.50 -1.98 -3.40 115.11 113.41 3h73 h GLN 690 Ca 0.00 0.00 -0.67 0.00 0.50 0.00 0.00 58.65 58.48 3h73 h GLN 690 Cb 0.01 0.00 -0.33 0.00 0.05 0.00 0.00 27.48 27.21 3h73 h GLN 690 CO -0.00 0.18 -0.76 0.08 -1.50 0.00 0.00 178.83 176.83 3h73 s VAL 691 N -4.27 2.70 0.62 -0.54 1.01 -0.72 -5.09 120.40 114.11 3h73 s VAL 691 Ca -0.03 -1.22 -0.15 0.00 0.00 0.00 0.00 61.98 60.58 3h73 s VAL 691 Cb 0.14 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3h73 s VAL 691 CO 0.63 0.11 1.06 -0.54 0.00 0.00 0.00 175.10 176.37 3h73 s LYS 692 N 1.26 3.19 -0.21 2.72 -0.14 -1.26 -1.00 119.74 124.29 3h73 s LYS 692 Ca -0.03 1.20 -0.04 0.00 -1.36 0.00 0.00 55.97 55.74 3h73 s LYS 692 Cb -0.18 -2.01 0.07 0.00 -1.68 0.00 0.00 37.83 34.03 3h73 s LYS 692 CO -0.04 -0.92 0.09 0.34 -0.76 0.00 0.00 175.35 174.06 3h73 s ASP 693 N -2.89 2.85 -0.15 2.83 2.15 -0.60 -4.61 116.67 116.24 3h73 s ASP 693 Ca 0.63 -0.88 0.06 0.00 0.43 0.00 0.00 52.55 52.79 3h73 s ASP 693 Cb -0.16 -0.36 0.39 0.00 -0.30 0.00 0.00 42.92 42.49 3h73 s ASP 693 CO 0.40 -0.37 1.22 1.33 -0.17 0.00 0.00 175.17 177.58 3h73 n VAL 694 N 5.21 1.58 -2.34 1.11 0.24 -1.26 -3.90 118.33 118.98 3h73 n VAL 694 Ca -0.07 -0.77 -0.03 0.00 -2.04 0.00 0.00 64.34 61.43 3h73 n VAL 694 Cb 0.46 -0.49 0.01 0.00 -1.47 0.00 0.00 33.84 32.36 3h73 n VAL 694 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h73 n TYR 695 N 0.14 -1.44 -3.64 6.34 9.36 -1.26 -4.91 117.16 121.75 3h73 n TYR 695 Ca 0.18 0.54 -0.13 0.00 3.32 0.00 0.00 57.90 61.81 3h73 n TYR 695 Cb 0.83 -3.02 -0.06 0.00 -0.63 0.00 0.00 39.34 36.45 3h73 n TYR 695 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3h73 s VAL 696 N -3.07 0.05 0.78 2.97 0.11 -1.26 -5.02 120.40 114.96 3h73 s VAL 696 Ca 0.08 -0.40 -0.14 0.00 -2.93 0.00 0.00 61.98 58.59 3h73 s VAL 696 Cb -0.01 -0.96 0.04 0.00 -1.53 0.00 0.00 36.38 33.92 3h73 s VAL 696 CO 0.38 -0.22 0.98 1.67 -3.33 0.00 0.00 175.10 174.58 3h73 n GLN 697 N 0.47 0.26 -4.10 1.54 0.00 -1.26 -4.79 117.38 109.51 3h73 n GLN 697 Ca -0.18 0.15 -0.10 0.00 -0.00 0.00 0.00 57.00 56.87 3h73 n GLN 697 Cb 0.60 -2.25 -0.08 0.00 0.00 0.00 0.00 30.24 28.51 3h73 n GLN 697 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3h73 s MET 698 N -3.66 1.19 0.02 3.69 0.23 -1.26 -4.61 119.30 114.90 3h73 s MET 698 Ca 0.71 -1.41 0.01 0.00 -1.03 0.00 0.00 55.69 53.96 3h73 s MET 698 Cb -0.31 0.32 -0.02 0.00 -1.53 0.00 0.00 34.83 33.30 3h73 s MET 698 CO 0.53 -0.41 -0.04 -1.54 -2.03 0.00 0.00 175.02 171.52 3h73 s SER 699 N -3.07 0.40 -0.04 -1.18 1.04 -1.06 -4.57 113.70 105.23 3h73 s SER 699 Ca 0.28 -0.48 -0.09 0.00 0.48 0.00 0.00 55.95 56.13 3h73 s SER 699 Cb 0.05 0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.26 3h73 s SER 699 CO 0.06 -0.25 0.21 0.00 0.98 0.00 0.00 173.24 174.24 3h73 s ALA 700 N -1.35 -0.53 0.04 5.32 0.00 -1.26 -0.80 121.76 123.18 3h73 s ALA 700 Ca -0.13 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.13 3h73 s ALA 700 Cb -0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 3h73 s ALA 700 CO -0.01 -0.18 -0.05 0.96 0.00 0.00 0.00 175.76 176.48 3h73 s ILE 701 N -0.74 0.36 0.28 0.00 -4.36 -0.23 -4.71 121.20 111.79 3h73 s ILE 701 Ca -0.08 -1.26 -0.16 0.00 -0.26 0.00 0.00 60.65 58.88 3h73 s ILE 701 Cb -0.05 -0.79 -0.09 0.00 1.25 0.00 0.00 42.46 42.78 3h73 s ILE 701 CO 0.02 -0.59 0.72 -2.28 0.24 0.00 0.00 174.94 173.04 3h73 s HIS 702 N -2.15 3.48 -0.02 1.37 5.65 -1.26 -1.55 115.29 120.81 3h73 s HIS 702 Ca -0.06 1.26 -0.28 0.00 0.25 0.00 0.00 55.06 56.23 3h73 s HIS 702 Cb -0.05 -2.55 0.06 0.00 -1.18 0.00 0.00 32.58 28.86 3h73 s HIS 702 CO -0.03 0.19 0.62 -0.08 -0.65 0.00 0.00 174.74 174.80 3h73 s THR 703 N -1.80 0.01 0.00 0.89 -1.32 -0.76 -4.93 115.64 107.72 3h73 s THR 703 Ca 0.50 -0.07 0.07 0.00 -1.21 0.00 0.00 61.69 60.97 3h73 s THR 703 Cb -0.13 -0.96 -0.03 0.00 -1.51 0.00 0.00 72.50 69.88 3h73 s THR 703 CO 0.19 -0.04 -0.20 -0.04 -2.21 0.00 0.00 174.62 172.32 3h73 s MET 704 N -1.58 2.17 -0.19 7.08 -1.94 -1.26 -0.70 119.30 122.89 3h73 s MET 704 Ca -0.10 -0.90 -0.04 0.00 -1.71 0.00 0.00 55.69 52.94 3h73 s MET 704 Cb -0.01 -2.19 0.09 0.00 2.01 0.00 0.00 34.83 34.74 3h73 s MET 704 CO 0.06 0.57 0.31 -1.58 -0.01 0.00 0.00 175.02 174.36 3h73 s HIS 705 N -0.79 -0.56 -1.44 -0.03 5.04 -0.47 -4.91 115.29 112.12 3h73 s HIS 705 Ca 0.12 0.85 -0.08 0.00 -1.54 0.00 0.00 55.06 54.41 3h73 s HIS 705 Cb -0.10 -0.04 0.05 0.00 0.04 0.00 0.00 32.58 32.52 3h73 s HIS 705 CO 0.02 -0.53 0.87 0.39 -2.34 0.00 0.00 174.74 173.15 3h73 n GLU 706 N 5.35 -5.32 -0.20 2.88 1.02 -1.26 -1.61 120.64 121.50 3h73 n GLU 706 Ca -0.06 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 3h73 n GLU 706 Cb 0.50 -5.36 0.00 0.00 -0.02 0.00 0.00 31.44 26.55 3h73 n GLU 706 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h73 n GLY 707 N -1.67 2.48 3.91 0.62 0.00 -1.26 -5.02 105.19 104.25 3h73 n GLY 707 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 3h73 n GLY 707 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h73 s LYS 708 N -0.04 3.53 -0.16 1.61 -0.14 -0.64 -5.10 119.74 118.80 3h73 s LYS 708 Ca 0.00 -0.25 -0.08 0.00 -1.36 0.00 0.00 55.97 54.27 3h73 s LYS 708 Cb 0.00 -2.96 -0.05 0.00 -1.68 0.00 0.00 37.83 33.15 3h73 s LYS 708 CO 0.00 0.55 0.13 -2.00 -0.76 0.00 0.00 175.35 173.27 3h73 s GLU 709 N -2.51 3.85 0.24 1.68 2.12 -1.26 -1.37 118.70 121.44 3h73 s GLU 709 Ca 0.37 -0.20 0.01 0.00 0.36 0.00 0.00 54.97 55.51 3h73 s GLU 709 Cb -0.13 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 3h73 s GLU 709 CO 0.25 0.50 0.13 0.71 -0.54 0.00 0.00 175.26 176.31 3h73 s TYR 710 N -0.22 1.37 -0.02 5.30 2.02 0.12 -0.32 117.35 125.60 3h73 s TYR 710 Ca 0.11 -1.33 -0.00 0.00 -0.37 0.00 0.00 57.07 55.47 3h73 s TYR 710 Cb -0.11 -0.72 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 3h73 s TYR 710 CO 0.01 -0.54 0.04 0.42 -1.57 0.00 0.00 175.55 173.91 3h73 s ILE 711 N -3.92 -0.06 -0.18 2.71 1.01 -0.02 -1.83 121.20 118.90 3h73 s ILE 711 Ca 0.38 0.22 -0.05 0.00 0.00 0.00 0.00 60.65 61.20 3h73 s ILE 711 Cb 0.07 -0.10 -0.03 0.00 0.01 0.00 0.00 42.46 42.42 3h73 s ILE 711 CO 0.14 0.09 -0.00 -0.63 0.00 0.00 0.00 174.94 174.54 3h73 s ILE 712 N 1.10 4.03 -0.06 2.92 1.01 -0.60 -0.95 121.20 128.66 3h73 s ILE 712 Ca -0.09 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.29 3h73 s ILE 712 Cb -0.13 -2.81 0.01 0.00 0.01 0.00 0.00 42.46 39.55 3h73 s ILE 712 CO -0.03 0.45 -0.12 -0.22 0.00 0.00 0.00 174.94 175.02 3h73 s LEU 713 N 0.73 1.67 -0.03 2.97 0.20 0.02 -1.07 118.68 123.18 3h73 s LEU 713 Ca -0.00 -0.28 0.07 0.00 0.69 0.00 0.00 54.13 54.60 3h73 s LEU 713 Cb -0.14 -0.79 -0.01 0.00 -0.43 0.00 0.00 46.19 44.81 3h73 s LEU 713 CO 0.02 0.05 -0.23 -0.55 -0.29 0.00 0.00 176.35 175.34 3h73 s SER 714 N 0.56 2.79 0.16 3.68 0.15 0.02 0.45 113.70 121.51 3h73 s SER 714 Ca -0.12 -0.44 -0.24 0.00 0.70 0.00 0.00 55.95 55.85 3h73 s SER 714 Cb -0.15 -0.50 0.07 0.00 -1.71 0.00 0.00 66.02 63.74 3h73 s SER 714 CO 0.03 0.26 1.02 0.54 1.20 0.00 0.00 173.24 176.29 3h73 s ASN 715 N -0.37 -0.07 0.33 5.45 6.03 -1.09 -2.57 114.94 122.64 3h73 s ASN 715 Ca 0.04 -0.54 -0.29 0.00 -1.03 0.00 0.00 52.86 51.04 3h73 s ASN 715 Cb -0.11 0.48 -0.11 0.00 -3.03 0.00 0.00 41.25 38.49 3h73 s ASN 715 CO 0.01 -0.92 1.42 0.00 -2.03 0.00 0.00 177.10 175.57 3h73 s ALA 716 N -2.65 3.57 -0.17 3.54 0.00 -1.26 -1.55 121.76 123.24 3h73 s ALA 716 Ca 0.17 1.41 0.17 0.00 0.00 0.00 0.00 51.96 53.72 3h73 s ALA 716 Cb -0.02 -3.55 0.01 0.00 0.00 0.00 0.00 23.12 19.56 3h73 s ALA 716 CO 0.04 -0.84 1.20 0.78 0.00 0.00 0.00 175.76 176.94 3h73 h GLY 717 N 3.68 0.00 0.00 0.00 0.00 -0.21 -3.43 103.07 103.10 3h73 h GLY 717 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3h73 h GLY 717 CO 0.68 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.83 3h73 n GLY 718 N 1.27 -3.22 0.24 4.60 0.00 -0.97 -4.87 105.19 102.24 3h73 n GLY 718 Ca -0.02 -2.14 0.01 0.00 0.00 0.00 0.00 46.02 43.87 3h73 n GLY 718 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h73 h PRO 719 N 1.30 0.31 0.00 1.61 0.13 -1.98 -3.43 132.00 129.94 3h73 h PRO 719 Ca 0.00 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3h73 h PRO 719 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 3h73 h PRO 719 CO 0.00 0.45 0.00 1.63 -0.23 0.00 0.00 178.00 179.85 3h73 n LYS 720 N -4.25 3.39 -2.46 0.86 5.02 -1.26 -4.88 118.16 114.58 3h73 n LYS 720 Ca -0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 3h73 n LYS 720 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.30 3h73 n LYS 720 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3h73 n ARG 721 N 0.00 3.17 -3.94 1.97 1.74 -1.26 -4.69 116.66 113.65 3h73 n ARG 721 Ca 0.00 -3.23 -0.08 0.00 -0.77 0.00 0.00 57.85 53.76 3h73 n ARG 721 Cb 0.00 -3.38 -0.04 0.00 -1.02 0.00 0.00 32.46 28.02 3h73 n ARG 721 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 3h73 s GLU 722 N 3.57 1.67 -0.75 5.56 -1.05 -1.17 -1.16 118.70 125.38 3h73 s GLU 722 Ca 0.51 -1.17 -0.01 0.00 -0.15 0.00 0.00 54.97 54.14 3h73 s GLU 722 Cb 0.05 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 34.27 3h73 s GLU 722 CO 0.04 -0.73 0.67 -1.71 0.95 0.00 0.00 175.26 174.47 3h73 n ASN 723 N -0.47 -6.87 -4.76 0.83 5.15 0.56 -1.83 115.26 107.86 3h73 n ASN 723 Ca -0.03 -0.32 -0.41 0.00 -0.60 0.00 0.00 54.58 53.22 3h73 n ASN 723 Cb 0.61 -4.14 -0.01 0.00 -0.53 0.00 0.00 39.78 35.70 3h73 n ASN 723 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3h73 s GLY 724 N -2.96 2.66 0.20 8.20 0.00 -0.12 -0.84 107.32 114.46 3h73 s GLY 724 Ca 0.02 1.44 0.07 0.00 0.00 0.00 0.00 44.72 46.25 3h73 s GLY 724 CO 0.80 2.23 -0.13 1.06 0.00 0.00 0.00 173.10 177.06 3h73 s MET 725 N -1.32 1.29 -0.42 2.90 1.00 -0.59 0.12 119.30 122.28 3h73 s MET 725 Ca 0.55 -1.57 0.02 0.00 0.00 0.00 0.00 55.69 54.69 3h73 s MET 725 Cb -0.44 -1.02 0.11 0.00 0.00 0.00 0.00 34.83 33.48 3h73 s MET 725 CO 0.53 0.16 0.16 0.08 0.00 0.00 0.00 175.02 175.95 3h73 s VAL 726 N -3.04 2.63 0.11 -6.03 1.01 0.28 -2.66 120.40 112.69 3h73 s VAL 726 Ca 0.22 -2.61 -0.30 0.00 0.00 0.00 0.00 61.98 59.28 3h73 s VAL 726 Cb 0.00 -2.86 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 3h73 s VAL 726 CO 0.06 -0.69 1.03 -1.00 0.00 0.00 0.00 175.10 174.50 3h73 s HIS 727 N 0.54 3.69 -0.15 5.22 0.09 0.17 -3.56 115.29 121.30 3h73 s HIS 727 Ca 0.13 1.68 -0.01 0.00 -0.00 0.00 0.00 55.06 56.85 3h73 s HIS 727 Cb -0.22 -3.16 -0.01 0.00 -0.00 0.00 0.00 32.58 29.19 3h73 s HIS 727 CO -0.05 -0.21 -0.11 -1.17 -0.00 0.00 0.00 174.74 173.20 3h73 s LEU 728 N 0.13 2.76 -0.03 0.89 2.96 -0.21 -0.80 118.68 124.39 3h73 s LEU 728 Ca 0.49 -0.34 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 3h73 s LEU 728 Cb -0.25 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 3h73 s LEU 728 CO 0.31 0.12 -0.18 0.00 -1.32 0.00 0.00 176.35 175.29 3h73 s ALA 729 N 0.61 1.53 -0.01 5.97 0.00 -0.12 0.08 121.76 129.81 3h73 s ALA 729 Ca -0.06 -0.73 -0.14 0.00 0.00 0.00 0.00 51.96 51.03 3h73 s ALA 729 Cb -0.15 -0.46 -0.06 0.00 0.00 0.00 0.00 23.12 22.45 3h73 s ALA 729 CO 0.03 0.31 0.39 0.50 0.00 0.00 0.00 175.76 176.99 3h73 s ARG 730 N -0.13 3.90 -0.84 0.00 3.00 0.90 -0.84 118.95 124.94 3h73 s ARG 730 Ca 0.00 0.37 -0.15 0.00 -1.00 0.00 0.00 55.73 54.96 3h73 s ARG 730 Cb -0.10 -3.23 0.20 0.00 0.00 0.00 0.00 34.95 31.83 3h73 s ARG 730 CO 0.01 0.68 0.82 0.08 0.00 0.00 0.00 175.30 176.89 3h73 s VAL 731 N -1.02 5.47 0.99 7.11 1.01 0.57 -1.67 120.40 132.85 3h73 s VAL 731 Ca 0.23 -2.32 -0.13 0.00 0.00 0.00 0.00 61.98 59.77 3h73 s VAL 731 Cb -0.16 -4.52 0.10 0.00 0.00 0.00 0.00 36.38 31.80 3h73 s VAL 731 CO 0.13 -1.10 0.61 -0.62 0.00 0.00 0.00 175.10 174.11 3h73 n GLU 732 N 4.40 -0.71 0.28 2.72 -0.58 -0.83 -4.59 120.64 121.33 3h73 n GLU 732 Ca 0.15 -0.16 0.17 0.00 -0.42 0.00 0.00 57.16 56.89 3h73 n GLU 732 Cb 0.47 -2.00 0.78 0.00 -0.57 0.00 0.00 31.44 30.12 3h73 n GLU 732 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3h73 h GLU 733 N -1.83 0.00 0.00 3.49 4.39 -1.97 -1.79 114.58 116.88 3h73 h GLU 733 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 3h73 h GLU 733 Cb 1.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 3h73 h GLU 733 CO 0.38 0.05 0.00 0.27 -1.16 0.00 0.00 179.01 178.55 3h73 n ASN 734 N -3.24 0.00 0.00 1.42 0.23 -1.26 -4.89 115.26 107.52 3h73 n ASN 734 Ca -0.01 -0.28 0.00 0.00 -0.53 0.00 0.00 54.58 53.76 3h73 n ASN 734 Cb 0.26 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 3h73 n ASN 734 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h73 n GLY 735 N 1.04 0.86 3.88 4.83 0.00 -0.67 -5.06 105.19 110.08 3h73 n GLY 735 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3h73 n GLY 735 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h73 s GLU 736 N -0.52 3.71 -0.20 1.61 2.02 -1.26 -4.86 118.70 119.21 3h73 s GLU 736 Ca 0.00 0.38 -0.09 0.00 0.02 0.00 0.00 54.97 55.28 3h73 s GLU 736 Cb 0.00 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 3h73 s GLU 736 CO 0.00 -0.07 0.09 -0.51 0.02 0.00 0.00 175.26 174.80 3h73 s LEU 737 N -4.06 3.96 -0.25 1.80 1.43 -1.26 -1.97 118.68 118.33 3h73 s LEU 737 Ca 0.50 0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 3h73 s LEU 737 Cb -0.10 -2.02 0.05 0.00 0.03 0.00 0.00 46.19 44.15 3h73 s LEU 737 CO 0.35 0.16 -0.12 -0.89 0.23 0.00 0.00 176.35 176.08 3h73 s THR 738 N 0.47 2.25 -0.13 5.49 2.01 -0.67 -4.94 115.64 120.12 3h73 s THR 738 Ca 0.05 -1.45 -0.29 0.00 0.31 0.00 0.00 61.69 60.31 3h73 s THR 738 Cb -0.12 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 3h73 s THR 738 CO 0.00 0.09 1.17 0.26 -0.69 0.00 0.00 174.62 175.45 3h73 s TRP 739 N 1.16 3.15 -0.25 4.92 0.52 -1.26 -0.07 118.94 127.11 3h73 s TRP 739 Ca -0.05 1.24 -0.01 0.00 0.02 0.00 0.00 56.10 57.29 3h73 s TRP 739 Cb -0.18 -3.39 -0.17 0.00 -1.15 0.00 0.00 33.47 28.58 3h73 s TRP 739 CO -0.06 -1.14 -0.21 1.28 0.02 0.00 0.00 176.95 176.83 3h73 n LEU 740 N 5.81 2.77 -4.05 2.99 4.77 0.11 -4.97 117.00 124.44 3h73 n LEU 740 Ca 0.12 -0.03 -0.07 0.00 -0.03 0.00 0.00 56.01 55.99 3h73 n LEU 740 Cb 0.46 -0.91 -0.10 0.00 -2.33 0.00 0.00 43.42 40.55 3h73 n LEU 740 CO 0.54 0.87 -0.32 -0.54 -1.33 0.00 0.00 177.39 176.61 3h73 s LYS 741 N -2.52 0.65 -0.31 3.23 3.01 -1.19 -4.99 119.74 117.61 3h73 s LYS 741 Ca -0.35 -1.18 0.18 0.00 -1.01 0.00 0.00 55.97 53.61 3h73 s LYS 741 Cb 0.10 0.23 0.46 0.00 -1.01 0.00 0.00 37.83 37.61 3h73 s LYS 741 CO 0.59 -0.14 1.10 0.72 0.51 0.00 0.00 175.35 178.13 3h73 n HIS 742 N 0.08 0.45 -1.96 3.18 8.25 -1.26 -1.04 115.22 122.92 3h73 n HIS 742 Ca -0.14 -2.40 -0.41 0.00 -0.26 0.00 0.00 57.72 54.51 3h73 n HIS 742 Cb 0.61 0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.78 3h73 n HIS 742 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3h73 s ASN 743 N -2.92 6.58 0.31 0.41 0.01 -1.23 -4.61 114.94 113.49 3h73 s ASN 743 Ca 0.25 2.77 -0.28 0.00 -0.71 0.00 0.00 52.86 54.89 3h73 s ASN 743 Cb 0.41 -2.63 -0.09 0.00 0.41 0.00 0.00 41.25 39.34 3h73 s ASN 743 CO -0.01 -0.74 1.11 -2.16 -1.51 0.00 0.00 177.10 173.79 3h73 s PRO 744 N -0.81 4.51 -0.01 -0.60 0.04 -1.26 -0.56 135.00 136.30 3h73 s PRO 744 Ca 0.58 1.79 0.05 0.00 0.04 0.00 0.00 61.00 63.45 3h73 s PRO 744 Cb -0.43 -3.05 -0.07 0.00 0.04 0.00 0.00 34.50 30.99 3h73 s PRO 744 CO 0.48 0.10 0.09 1.51 0.04 0.00 0.00 177.00 179.22 3h73 n ILE 745 N 0.89 0.04 -3.42 0.56 3.06 0.12 -4.87 119.36 115.73 3h73 n ILE 745 Ca 0.00 -0.12 -0.06 0.00 -2.50 0.00 0.00 62.75 60.08 3h73 n ILE 745 Cb 0.45 0.23 -0.07 0.00 0.54 0.00 0.00 39.64 40.80 3h73 n ILE 745 CO 0.00 0.00 0.00 -1.58 -2.50 0.00 0.00 176.55 172.47 3h73 s GLN 746 N -2.30 0.40 0.79 9.51 2.00 -1.15 -5.00 119.66 123.91 3h73 s GLN 746 Ca -0.02 0.83 -0.11 0.00 -2.00 0.00 0.00 55.36 54.06 3h73 s GLN 746 Cb 0.03 0.04 0.07 0.00 0.80 0.00 0.00 33.01 33.95 3h73 s GLN 746 CO 0.19 -0.50 1.09 -1.59 -0.50 0.00 0.00 175.29 173.99 3h73 s LYS 747 N 2.65 2.14 2.01 1.67 -2.85 -1.26 -0.94 119.74 123.16 3h73 s LYS 747 Ca 0.09 0.70 0.00 0.00 -1.00 0.00 0.00 55.97 55.76 3h73 s LYS 747 Cb -0.14 -1.92 0.00 0.00 -2.06 0.00 0.00 37.83 33.71 3h73 s LYS 747 CO -0.16 -1.60 0.00 0.41 0.10 0.00 0.00 175.35 174.10 3h73 n GLY 748 N -2.00 -1.39 3.66 0.59 0.00 -1.26 -4.70 105.19 100.09 3h73 n GLY 748 Ca 0.07 -1.29 -0.45 0.00 0.00 0.00 0.00 46.02 44.35 3h73 n GLY 748 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h73 n GLU 749 N -0.00 1.94 -3.65 1.61 -0.58 -1.26 -0.32 120.64 118.37 3h73 n GLU 749 Ca 0.00 0.69 -0.07 0.00 -0.42 0.00 0.00 57.16 57.37 3h73 n GLU 749 Cb 0.00 -2.34 -0.07 0.00 -0.57 0.00 0.00 31.44 28.45 3h73 n GLU 749 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 3h73 s PHE 750 N 0.03 -1.01 0.00 -0.32 5.36 -0.30 -4.13 117.98 117.61 3h73 s PHE 750 Ca 0.70 1.95 0.00 0.00 -0.96 0.00 0.00 56.93 58.62 3h73 s PHE 750 Cb -0.68 0.57 0.00 0.00 -0.34 0.00 0.00 43.02 42.57 3h73 s PHE 750 CO 0.49 -0.52 0.00 0.00 -1.46 0.00 0.00 175.22 173.73 3h73 n ALA 751 N 4.63 0.00 -1.75 11.12 0.00 -0.91 -3.02 120.51 130.57 3h73 n ALA 751 Ca -0.18 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.89 3h73 n ALA 751 Cb 0.55 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.04 3h73 n ALA 751 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3h73 s TYR 752 N 2.56 2.37 0.22 0.00 1.51 -1.26 -4.62 117.35 118.13 3h73 s TYR 752 Ca 0.00 1.45 -0.17 0.00 -1.01 0.00 0.00 57.07 57.34 3h73 s TYR 752 Cb 0.00 -3.65 0.02 0.00 -0.11 0.00 0.00 41.96 38.22 3h73 s TYR 752 CO 0.00 -2.54 0.54 0.54 -1.11 0.00 0.00 175.55 172.98 3h73 s ASN 753 N -1.23 -0.22 -0.15 2.29 4.22 -1.26 -0.48 114.94 118.12 3h73 s ASN 753 Ca 0.73 -0.61 -0.05 0.00 -2.14 0.00 0.00 52.86 50.80 3h73 s ASN 753 Cb -0.36 0.60 0.07 0.00 1.28 0.00 0.00 41.25 42.84 3h73 s ASN 753 CO 0.41 -1.11 0.28 -0.55 -2.04 0.00 0.00 177.10 174.09 3h73 s SER 754 N -2.91 0.35 0.11 3.54 0.15 0.34 -4.28 113.70 110.99 3h73 s SER 754 Ca 0.13 0.57 -0.07 0.00 0.70 0.00 0.00 55.95 57.28 3h73 s SER 754 Cb -0.02 0.77 -0.06 0.00 -1.71 0.00 0.00 66.02 65.01 3h73 s SER 754 CO 0.01 -0.25 0.38 -0.76 1.20 0.00 0.00 173.24 173.83 3h73 s LEU 755 N 2.44 4.30 -0.09 3.45 1.43 -1.26 -1.70 118.68 127.25 3h73 s LEU 755 Ca 0.02 0.68 -0.12 0.00 -1.03 0.00 0.00 54.13 53.68 3h73 s LEU 755 Cb -0.12 -3.15 0.03 0.00 0.03 0.00 0.00 46.19 42.97 3h73 s LEU 755 CO -0.10 0.11 0.31 -1.10 0.23 0.00 0.00 176.35 175.80 3h73 s GLN 756 N -2.31 0.43 -0.01 1.70 -1.52 -0.47 -4.88 119.66 112.60 3h73 s GLN 756 Ca 0.37 0.27 -0.24 0.00 -1.95 0.00 0.00 55.36 53.82 3h73 s GLN 756 Cb -0.13 0.20 -0.05 0.00 -0.22 0.00 0.00 33.01 32.82 3h73 s GLN 756 CO 0.21 -0.08 0.72 -2.00 -0.25 0.00 0.00 175.29 173.89 3h73 s GLU 757 N -0.21 4.44 -0.01 2.91 2.12 -1.26 0.14 118.70 126.83 3h73 s GLU 757 Ca -0.03 0.95 0.22 0.00 0.36 0.00 0.00 54.97 56.46 3h73 s GLU 757 Cb -0.03 -3.40 -0.30 0.00 0.26 0.00 0.00 34.13 30.66 3h73 s GLU 757 CO 0.01 0.20 0.58 1.28 -0.54 0.00 0.00 175.26 176.79 3h73 n LEU 758 N 3.22 0.19 0.00 2.70 4.77 -0.09 -4.88 117.00 122.91 3h73 n LEU 758 Ca -0.02 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3h73 n LEU 758 Cb 0.51 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3h73 n LEU 758 CO 0.47 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3h73 n GLY 759 N 1.29 2.26 3.11 -0.72 0.00 -1.07 -4.90 105.19 105.17 3h73 n GLY 759 Ca -0.03 -1.88 -0.23 0.00 0.00 0.00 0.00 46.02 43.89 3h73 n GLY 759 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3h73 n ASN 760 N 0.00 -6.20 0.00 1.61 5.15 -1.26 -2.00 115.26 112.56 3h73 n ASN 760 Ca 0.00 -0.33 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 3h73 n ASN 760 Cb 0.00 -4.98 0.00 0.00 -0.53 0.00 0.00 39.78 34.27 3h73 n ASN 760 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h73 n GLY 761 N -1.62 0.60 3.67 8.20 0.00 -1.26 -5.01 105.19 109.77 3h73 n GLY 761 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 3h73 n GLY 761 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h73 s GLU 762 N -0.03 2.43 0.05 1.61 2.02 -0.85 -2.06 118.70 121.86 3h73 s GLU 762 Ca 0.00 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 53.97 3h73 s GLU 762 Cb 0.00 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.79 3h73 s GLU 762 CO 0.00 0.48 -0.05 0.71 0.02 0.00 0.00 175.26 176.42 3h73 s TYR 763 N -1.58 0.53 0.20 1.61 2.02 0.48 -0.92 117.35 119.69 3h73 s TYR 763 Ca 0.27 -0.73 0.09 0.00 -0.37 0.00 0.00 57.07 56.32 3h73 s TYR 763 Cb -0.10 -0.35 -0.05 0.00 -0.40 0.00 0.00 41.96 41.07 3h73 s TYR 763 CO 0.18 -0.21 -0.17 0.20 -1.57 0.00 0.00 175.55 173.99 3h73 s GLY 764 N -2.14 1.46 -0.15 0.71 0.00 0.12 -1.18 107.32 106.14 3h73 s GLY 764 Ca -0.04 -1.62 -0.09 0.00 0.00 0.00 0.00 44.72 42.97 3h73 s GLY 764 CO -0.04 -1.70 0.36 -1.50 0.00 0.00 0.00 173.10 170.23 3h73 s ILE 765 N -2.56 -0.02 -0.17 0.90 2.07 -0.34 -1.37 121.20 119.71 3h73 s ILE 765 Ca 0.21 0.08 -0.03 0.00 -1.41 0.00 0.00 60.65 59.49 3h73 s ILE 765 Cb -0.03 -0.54 -0.02 0.00 0.13 0.00 0.00 42.46 42.00 3h73 s ILE 765 CO 0.08 0.03 -0.05 -0.22 -1.91 0.00 0.00 174.94 172.87 3h73 s LEU 766 N 1.02 3.08 0.13 8.50 2.96 -0.69 -1.87 118.68 131.82 3h73 s LEU 766 Ca -0.07 -0.23 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 3h73 s LEU 766 Cb -0.07 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 3h73 s LEU 766 CO -0.08 0.11 0.21 -0.72 -1.32 0.00 0.00 176.35 174.55 3h73 s TYR 767 N 0.71 0.36 -0.08 5.38 1.13 -0.28 -0.51 117.35 124.06 3h73 s TYR 767 Ca -0.02 -0.76 -0.21 0.00 -1.41 0.00 0.00 57.07 54.67 3h73 s TYR 767 Cb -0.15 -0.12 -0.04 0.00 -1.10 0.00 0.00 41.96 40.55 3h73 s TYR 767 CO 0.02 -0.62 0.59 -1.21 -2.51 0.00 0.00 175.55 171.83 3h73 s GLU 768 N -3.93 4.38 0.04 -3.49 2.02 0.37 -1.37 118.70 116.71 3h73 s GLU 768 Ca 0.13 0.68 -0.27 0.00 0.02 0.00 0.00 54.97 55.53 3h73 s GLU 768 Cb 0.05 -3.43 0.08 0.00 0.10 0.00 0.00 34.13 30.93 3h73 s GLU 768 CO -0.04 0.15 0.71 -1.58 0.02 0.00 0.00 175.26 174.51 3h73 s HIS 769 N 0.58 -0.52 0.06 1.61 2.46 -0.90 -2.15 115.29 116.43 3h73 s HIS 769 Ca 0.32 0.56 -0.06 0.00 0.47 0.00 0.00 55.06 56.34 3h73 s HIS 769 Cb -0.17 0.51 -0.01 0.00 -0.13 0.00 0.00 32.58 32.78 3h73 s HIS 769 CO 0.15 -0.69 0.12 0.95 -2.47 0.00 0.00 174.74 172.80 3h73 s THR 770 N -2.70 0.15 -0.16 0.89 -4.23 -1.26 -1.86 115.64 106.47 3h73 s THR 770 Ca -0.02 -1.26 -0.31 0.00 -1.18 0.00 0.00 61.69 58.92 3h73 s THR 770 Cb -0.01 -1.22 0.14 0.00 1.34 0.00 0.00 72.50 72.75 3h73 s THR 770 CO -0.05 -0.69 1.10 -1.83 -0.54 0.00 0.00 174.62 172.61 3h73 s GLU 771 N -3.42 0.46 -1.47 3.99 -1.05 -1.26 -4.38 118.70 111.57 3h73 s GLU 771 Ca 0.02 -0.04 -0.12 0.00 -0.15 0.00 0.00 54.97 54.68 3h73 s GLU 771 Cb 0.03 0.21 0.06 0.00 -0.44 0.00 0.00 34.13 34.00 3h73 s GLU 771 CO -0.08 -0.17 1.05 1.63 0.95 0.00 0.00 175.26 178.64 3h73 n LYS 772 N 0.26 -6.38 -0.88 -4.83 5.02 -1.26 -2.34 118.16 107.75 3h73 n LYS 772 Ca -0.05 0.68 0.00 0.00 -2.02 0.00 0.00 58.31 56.92 3h73 n LYS 772 Cb 0.59 -5.63 0.00 0.00 -0.02 0.00 0.00 35.03 29.97 3h73 n LYS 772 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h73 n GLY 773 N -1.80 0.52 3.76 0.72 0.00 -1.26 -4.89 105.19 102.24 3h73 n GLY 773 Ca 0.03 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 3h73 n GLY 773 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h73 s GLN 774 N -0.78 4.43 0.47 1.61 -0.21 -0.99 -0.19 119.66 124.00 3h73 s GLN 774 Ca 0.00 2.10 -0.22 0.00 0.02 0.00 0.00 55.36 57.25 3h73 s GLN 774 Cb 0.00 -3.12 -0.07 0.00 1.00 0.00 0.00 33.01 30.82 3h73 s GLN 774 CO 0.00 -0.11 1.17 -0.80 -2.12 0.00 0.00 175.29 173.43 3h73 s ASN 775 N -0.42 6.09 -0.20 5.90 0.02 0.98 -4.63 114.94 122.69 3h73 s ASN 775 Ca 0.49 2.31 -0.29 0.00 -1.02 0.00 0.00 52.86 54.35 3h73 s ASN 775 Cb -0.37 -2.60 -0.02 0.00 0.02 0.00 0.00 41.25 38.28 3h73 s ASN 775 CO 0.47 -0.97 1.41 0.00 0.02 0.00 0.00 177.10 178.03 3h73 s ALA 776 N -1.56 3.48 0.28 0.60 0.00 -1.26 -3.76 121.76 119.54 3h73 s ALA 776 Ca 0.65 0.42 0.02 0.00 0.00 0.00 0.00 51.96 53.05 3h73 s ALA 776 Cb -0.28 -3.74 -0.05 0.00 0.00 0.00 0.00 23.12 19.05 3h73 s ALA 776 CO 0.34 -1.56 0.11 0.71 0.00 0.00 0.00 175.76 175.37 3h73 s TYR 777 N 4.22 1.59 -0.17 0.00 2.02 0.17 -4.28 117.35 120.91 3h73 s TYR 777 Ca 0.62 -1.23 -0.03 0.00 -0.37 0.00 0.00 57.07 56.05 3h73 s TYR 777 Cb -0.23 -0.92 -0.02 0.00 -0.40 0.00 0.00 41.96 40.39 3h73 s TYR 777 CO 0.22 -0.37 -0.05 0.99 -1.57 0.00 0.00 175.55 174.78 3h73 s THR 778 N -3.66 3.68 -0.27 -0.71 2.01 -0.78 -2.78 115.64 113.13 3h73 s THR 778 Ca 0.36 -0.42 -0.16 0.00 0.31 0.00 0.00 61.69 61.78 3h73 s THR 778 Cb 0.07 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 3h73 s THR 778 CO 0.15 0.47 0.43 -0.76 -0.69 0.00 0.00 174.62 174.22 3h73 s LEU 779 N 0.69 4.07 0.27 4.42 1.02 -0.33 -2.11 118.68 126.71 3h73 s LEU 779 Ca -0.02 0.33 0.12 0.00 0.02 0.00 0.00 54.13 54.57 3h73 s LEU 779 Cb -0.15 -2.51 -0.05 0.00 0.02 0.00 0.00 46.19 43.50 3h73 s LEU 779 CO 0.02 -0.24 -0.21 -0.44 0.02 0.00 0.00 176.35 175.50 3h73 s SER 780 N 1.62 3.55 0.06 2.29 0.01 -0.47 -0.59 113.70 120.16 3h73 s SER 780 Ca 0.17 -1.00 0.09 0.00 1.31 0.00 0.00 55.95 56.52 3h73 s SER 780 Cb -0.16 -0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.75 3h73 s SER 780 CO 0.10 0.05 -0.23 0.12 0.41 0.00 0.00 173.24 173.69 3h73 s PHE 781 N -2.38 2.41 0.00 2.43 5.36 0.25 -1.13 117.98 124.92 3h73 s PHE 781 Ca 0.28 -0.35 -0.07 0.00 -0.96 0.00 0.00 56.93 55.84 3h73 s PHE 781 Cb -0.05 -1.39 0.00 0.00 -0.34 0.00 0.00 43.02 41.24 3h73 s PHE 781 CO 0.14 0.22 0.13 1.03 -1.46 0.00 0.00 175.22 175.28 3h73 s ARG 782 N -1.49 0.47 -0.04 10.12 0.52 -0.78 -1.69 118.95 126.06 3h73 s ARG 782 Ca 0.13 -0.38 0.07 0.00 -0.52 0.00 0.00 55.73 55.03 3h73 s ARG 782 Cb -0.10 0.19 -0.01 0.00 0.52 0.00 0.00 34.95 35.55 3h73 s ARG 782 CO 0.04 -0.11 -0.24 0.21 0.02 0.00 0.00 175.30 175.22 3h73 s LYS 783 N -1.32 2.18 0.06 3.54 2.20 -1.26 -1.20 119.74 123.93 3h73 s LYS 783 Ca -0.14 -0.87 -0.01 0.00 -0.36 0.00 0.00 55.97 54.60 3h73 s LYS 783 Cb -0.07 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.23 3h73 s LYS 783 CO 0.01 0.45 -0.04 -0.59 -0.36 0.00 0.00 175.35 174.83 3h73 s PHE 784 N -0.37 0.57 0.56 4.03 -0.71 -0.33 -1.22 117.98 120.51 3h73 s PHE 784 Ca 0.04 -1.03 0.06 0.00 -1.04 0.00 0.00 56.93 54.95 3h73 s PHE 784 Cb -0.11 -0.40 0.06 0.00 -1.21 0.00 0.00 43.02 41.35 3h73 s PHE 784 CO 0.01 -0.34 0.47 0.27 -1.34 0.00 0.00 175.22 174.29 3h73 n ASN 785 N 0.12 2.69 -0.18 1.98 2.04 -1.08 -0.39 115.26 120.45 3h73 n ASN 785 Ca -0.14 -2.86 -0.01 0.00 -0.44 0.00 0.00 54.58 51.13 3h73 n ASN 785 Cb 0.61 -0.10 0.23 0.00 -2.53 0.00 0.00 39.78 37.99 3h73 n ASN 785 CO 0.00 0.00 0.00 -0.25 -0.44 0.00 0.00 177.26 176.57 3h73 h TRP 786 N 0.59 0.90 -0.70 -2.53 2.91 -1.79 -2.69 115.95 112.63 3h73 h TRP 786 Ca -0.34 -0.02 -0.04 0.00 1.13 0.00 0.00 58.89 59.63 3h73 h TRP 786 Cb 1.28 -0.29 -0.03 0.00 -0.51 0.00 0.00 29.16 29.61 3h73 h TRP 786 CO 0.00 0.63 0.30 -0.44 -1.03 0.00 0.00 178.44 177.90 3h73 h ASP 787 N 0.92 0.94 -0.50 2.65 3.32 -1.89 0.28 116.42 122.14 3h73 h ASP 787 Ca 0.23 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 3h73 h ASP 787 Cb 0.03 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3h73 h ASP 787 CO -0.04 0.82 -0.00 0.15 -1.72 0.00 0.00 179.24 178.45 3h73 h PHE 788 N 1.01 1.01 -0.07 4.55 3.57 -1.76 -0.87 116.94 124.39 3h73 h PHE 788 Ca 0.24 -0.16 -0.21 0.00 3.53 0.00 0.00 57.97 61.37 3h73 h PHE 788 Cb 0.16 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.64 3h73 h PHE 788 CO 0.01 0.91 -0.83 1.25 -2.23 0.00 0.00 178.31 177.43 3h73 h LEU 789 N 0.86 0.65 -0.89 0.59 5.85 -1.10 -3.35 115.31 117.91 3h73 h LEU 789 Ca 0.16 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3h73 h LEU 789 Cb 0.51 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3h73 h LEU 789 CO 0.03 1.23 -0.47 -1.54 -0.34 0.00 0.00 178.44 177.35 3h73 n SER 790 N -3.84 1.83 -4.50 1.25 3.41 0.95 -4.79 113.62 107.94 3h73 n SER 790 Ca -0.06 -1.42 -0.30 0.00 -0.26 0.00 0.00 58.87 56.83 3h73 n SER 790 Cb 0.77 0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 65.12 3h73 n SER 790 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3h73 s LYS 791 N -2.33 1.89 0.53 4.33 1.02 -0.34 -4.99 119.74 119.85 3h73 s LYS 791 Ca 0.16 -1.12 -0.22 0.00 0.02 0.00 0.00 55.97 54.81 3h73 s LYS 791 Cb 0.16 -2.16 -0.05 0.00 -0.52 0.00 0.00 37.83 35.26 3h73 s LYS 791 CO 0.54 0.50 1.34 -0.51 -0.92 0.00 0.00 175.35 176.30 3h73 s ASP 792 N -2.02 5.39 0.00 2.83 1.01 -1.26 -4.83 116.67 117.79 3h73 s ASP 792 Ca 0.18 2.73 0.27 0.00 0.71 0.00 0.00 52.55 56.44 3h73 s ASP 792 Cb -0.11 -2.63 0.78 0.00 1.01 0.00 0.00 42.92 41.97 3h73 s ASP 792 CO 0.10 -1.49 1.59 0.18 0.21 0.00 0.00 175.17 175.76