#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h73 n ALA 321 N 0.00 2.03 -3.70 4.61 0.00 -1.26 -4.76 120.51 117.44 3h73 n ALA 321 Ca 0.00 0.25 -0.21 0.00 0.00 0.00 0.00 53.44 53.48 3h73 n ALA 321 Cb 0.00 -2.39 -0.17 0.00 0.00 0.00 0.00 19.45 16.89 3h73 n ALA 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h73 s ALA 322 N -1.19 0.64 -0.08 0.00 0.00 -1.26 -4.85 121.76 115.01 3h73 s ALA 322 Ca 0.61 -0.06 -0.03 0.00 0.00 0.00 0.00 51.96 52.48 3h73 s ALA 322 Cb -0.45 -0.54 0.05 0.00 0.00 0.00 0.00 23.12 22.18 3h73 s ALA 322 CO 0.58 -0.20 0.16 -1.17 0.00 0.00 0.00 175.76 175.13 3h73 s LEU 323 N 1.35 0.03 0.71 0.00 2.96 -1.26 -2.73 118.68 119.75 3h73 s LEU 323 Ca -0.04 0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 54.10 3h73 s LEU 323 Cb -0.13 0.32 0.02 0.00 0.50 0.00 0.00 46.19 46.89 3h73 s LEU 323 CO -0.02 -0.23 1.07 0.42 -1.32 0.00 0.00 176.35 176.27 3h73 s THR 324 N 2.13 3.81 0.54 3.68 -4.23 -0.06 -4.99 115.64 116.51 3h73 s THR 324 Ca 0.01 0.60 -0.19 0.00 -1.18 0.00 0.00 61.69 60.93 3h73 s THR 324 Cb -0.12 -3.26 -0.06 0.00 1.34 0.00 0.00 72.50 70.40 3h73 s THR 324 CO -0.06 -0.75 1.10 -1.61 -0.54 0.00 0.00 174.62 172.77 3h73 s GLU 325 N -4.93 3.43 0.34 3.99 2.02 -1.26 -4.57 118.70 117.72 3h73 s GLU 325 Ca 0.59 1.52 -0.29 0.00 0.02 0.00 0.00 54.97 56.82 3h73 s GLU 325 Cb -0.15 -2.03 -0.10 0.00 0.10 0.00 0.00 34.13 31.95 3h73 s GLU 325 CO 0.54 -0.76 1.34 -1.59 0.02 0.00 0.00 175.26 174.80 3h73 s LYS 326 N -3.35 4.31 -0.12 1.61 -2.85 -1.26 -4.75 119.74 113.33 3h73 s LYS 326 Ca 0.71 2.28 0.02 0.00 -1.00 0.00 0.00 55.97 57.97 3h73 s LYS 326 Cb -0.21 -3.05 0.01 0.00 -2.06 0.00 0.00 37.83 32.52 3h73 s LYS 326 CO 0.26 -0.25 -0.18 0.99 0.10 0.00 0.00 175.35 176.28 3h73 s THR 327 N -1.14 1.74 -0.23 3.79 2.01 -0.22 -4.91 115.64 116.68 3h73 s THR 327 Ca 0.50 -0.79 -0.29 0.00 0.31 0.00 0.00 61.69 61.42 3h73 s THR 327 Cb -0.41 -1.57 0.00 0.00 0.01 0.00 0.00 72.50 70.54 3h73 s THR 327 CO 0.55 0.49 1.11 -1.81 -0.69 0.00 0.00 174.62 174.26 3h73 s ASP 328 N 0.95 7.03 -0.21 3.53 1.01 -1.26 0.65 116.67 128.36 3h73 s ASP 328 Ca -0.06 1.41 -0.09 0.00 0.71 0.00 0.00 52.55 54.52 3h73 s ASP 328 Cb -0.15 -2.54 -0.19 0.00 1.01 0.00 0.00 42.92 41.05 3h73 s ASP 328 CO -0.02 -0.73 0.02 -0.38 0.21 0.00 0.00 175.17 174.27 3h73 n ILE 329 N 5.43 1.60 -3.91 0.77 2.08 0.39 -4.83 119.36 120.89 3h73 n ILE 329 Ca 0.13 -0.44 -0.30 0.00 0.56 0.00 0.00 62.75 62.70 3h73 n ILE 329 Cb 0.46 -1.75 -0.16 0.00 -0.75 0.00 0.00 39.64 37.44 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 -2.50 2.19 -0.25 1.39 0.08 -0.86 -5.01 117.98 113.02 3h73 s PHE 330 Ca -0.31 -1.62 -0.15 0.00 0.12 0.00 0.00 56.93 54.97 3h73 s PHE 330 Cb 0.09 -1.50 -0.04 0.00 -0.57 0.00 0.00 43.02 41.00 3h73 s PHE 330 CO 0.63 -0.75 0.37 -1.21 -0.10 0.00 0.00 175.22 174.16 3h73 s GLU 331 N 1.47 4.06 0.72 0.44 2.02 -1.26 -1.02 118.70 125.12 3h73 s GLU 331 Ca -0.05 0.07 -0.08 0.00 0.02 0.00 0.00 54.97 54.93 3h73 s GLU 331 Cb -0.19 -3.62 0.06 0.00 0.10 0.00 0.00 34.13 30.48 3h73 s GLU 331 CO -0.06 -0.20 1.05 -1.54 0.02 0.00 0.00 175.26 174.52 3h73 s SER 332 N 1.46 4.83 1.00 -0.19 1.04 -1.26 -4.86 113.70 115.73 3h73 s SER 332 Ca 0.16 0.59 -0.01 0.00 0.48 0.00 0.00 55.95 57.16 3h73 s SER 332 Cb -0.15 -1.23 0.01 0.00 0.10 0.00 0.00 66.02 64.74 3h73 s SER 332 CO 0.09 -1.62 0.06 0.61 0.98 0.00 0.00 173.24 173.37 3h73 n GLY 333 N -3.00 -1.32 3.12 7.32 0.00 -0.69 -4.73 105.19 105.89 3h73 n GLY 333 Ca 0.08 -1.64 -0.11 0.00 0.00 0.00 0.00 46.02 44.34 3h73 n GLY 333 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h73 s ARG 334 N -3.14 0.68 -1.27 1.61 1.70 -1.19 -0.22 118.95 117.12 3h73 s ARG 334 Ca 0.04 -1.08 -0.05 0.00 -0.47 0.00 0.00 55.73 54.16 3h73 s ARG 334 Cb -0.00 -0.20 0.03 0.00 -0.57 0.00 0.00 34.95 34.22 3h73 s ARG 334 CO 0.03 -0.00 0.33 0.09 -1.08 0.00 0.00 175.30 174.67 3h73 n ASN 335 N 0.59 -4.27 0.00 -2.89 4.13 -0.48 -0.73 115.26 111.62 3h73 n ASN 335 Ca -0.17 -0.16 0.00 0.00 1.68 0.00 0.00 54.58 55.93 3h73 n ASN 335 Cb 0.58 -3.54 0.00 0.00 -1.54 0.00 0.00 39.78 35.28 3h73 n ASN 335 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h73 n GLY 336 N -1.11 0.64 3.93 7.41 0.00 -1.26 -5.03 105.19 109.77 3h73 n GLY 336 Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.14 3.53 0.74 1.61 1.02 0.09 -5.03 119.74 121.56 3h73 s LYS 337 Ca 0.00 -0.29 -0.11 0.00 0.02 0.00 0.00 55.97 55.59 3h73 s LYS 337 Cb 0.00 -2.77 0.04 0.00 -0.52 0.00 0.00 37.83 34.58 3h73 s LYS 337 CO 0.00 0.31 1.09 -2.14 -0.92 0.00 0.00 175.35 173.69 3h73 s PRO 338 N -3.60 2.46 0.00 -1.68 0.02 -1.26 -3.17 135.00 127.76 3h73 s PRO 338 Ca 0.40 1.15 0.00 0.00 0.02 0.00 0.00 61.00 62.57 3h73 s PRO 338 Cb -0.11 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.49 3h73 s PRO 338 CO 0.31 -1.48 0.00 0.27 -0.33 0.00 0.00 177.00 175.76 3h73 n ASN 339 N -3.30 0.00 0.19 2.53 2.04 0.97 -4.65 115.26 113.04 3h73 n ASN 339 Ca 0.09 -0.77 0.13 0.00 -0.44 0.00 0.00 54.58 53.59 3h73 n ASN 339 Cb 0.53 0.00 0.71 0.00 -2.53 0.00 0.00 39.78 38.49 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 -0.50 -3.83 2.10 -1.90 0.01 116.57 112.45 3h73 h LYS 340 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3h73 h LYS 340 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3h73 h LYS 340 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 3h73 n ASP 341 N -4.31 3.05 0.00 7.07 8.00 -1.26 -4.92 116.55 124.18 3h73 n ASP 341 Ca 0.01 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.54 3h73 n ASP 341 Cb 0.25 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 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 1.42 0.41 3.45 0.44 0.00 -0.01 -5.04 105.19 105.86 3h73 n GLY 342 Ca 0.19 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 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 3.78 0.05 -0.61 1.01 -1.26 -4.67 121.20 117.51 3h73 s ILE 343 Ca 0.00 -0.39 -0.12 0.00 0.00 0.00 0.00 60.65 60.14 3h73 s ILE 343 Cb 0.00 -2.67 -0.31 0.00 0.01 0.00 0.00 42.46 39.49 3h73 s ILE 343 CO 0.00 0.47 1.09 0.11 0.00 0.00 0.00 174.94 176.60 3h73 h LYS 344 N 7.08 0.51 -4.13 2.79 1.57 -1.40 0.28 116.57 123.28 3h73 h LYS 344 Ca -0.33 -0.78 -0.15 0.00 -1.87 0.00 0.00 60.65 57.52 3h73 h LYS 344 Cb 1.19 0.27 -0.18 0.00 0.08 0.00 0.00 32.23 33.59 3h73 h LYS 344 CO 0.61 1.36 -0.69 0.45 -0.57 0.00 0.00 179.45 180.61 3h73 s SER 345 N -7.42 0.39 0.01 0.86 0.15 -0.26 -1.70 113.70 105.72 3h73 s SER 345 Ca -0.08 -0.75 0.04 0.00 0.70 0.00 0.00 55.95 55.86 3h73 s SER 345 Cb 0.05 0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.50 3h73 s SER 345 CO 0.93 -0.44 -0.11 -0.31 1.20 0.00 0.00 173.24 174.50 3h73 s TYR 346 N -2.66 1.01 0.28 3.44 2.02 -1.18 -0.31 117.35 119.96 3h73 s TYR 346 Ca -0.05 -0.26 -0.16 0.00 -0.37 0.00 0.00 57.07 56.23 3h73 s TYR 346 Cb -0.01 -0.62 0.01 0.00 -0.40 0.00 0.00 41.96 40.94 3h73 s TYR 346 CO -0.05 -0.00 0.63 1.03 -1.57 0.00 0.00 175.55 175.58 3h73 s ARG 347 N -0.67 1.76 -0.63 -0.62 0.52 -0.82 -0.66 118.95 117.84 3h73 s ARG 347 Ca 0.02 -1.19 -0.06 0.00 -0.52 0.00 0.00 55.73 53.98 3h73 s ARG 347 Cb -0.06 0.55 0.01 0.00 0.52 0.00 0.00 34.95 35.97 3h73 s ARG 347 CO 0.00 -0.78 0.66 -0.89 0.02 0.00 0.00 175.30 174.31 3h73 n ILE 348 N -0.45-10.31 -2.46 1.52 2.08 -1.26 0.20 119.36 108.68 3h73 n ILE 348 Ca -0.03 0.18 -0.37 0.00 0.56 0.00 0.00 62.75 63.09 3h73 n ILE 348 Cb 0.60 -6.95 -0.03 0.00 -0.75 0.00 0.00 39.64 32.51 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 -2.89 4.12 -0.03 0.38 0.04 -1.26 -4.02 135.00 131.34 3h73 s PRO 349 Ca 0.10 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.76 3h73 s PRO 349 Cb -0.03 -2.59 0.03 0.00 0.04 0.00 0.00 34.50 31.95 3h73 s PRO 349 CO 0.76 -0.21 0.00 0.00 0.04 0.00 0.00 177.00 177.60 3h73 s ALA 350 N -1.57 0.35 -0.10 8.56 0.00 -0.58 -4.20 121.76 124.23 3h73 s ALA 350 Ca 0.58 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.70 3h73 s ALA 350 Cb -0.25 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.50 3h73 s ALA 350 CO 0.31 -0.13 -0.20 -1.17 0.00 0.00 0.00 175.76 174.57 3h73 s LEU 351 N 1.16 1.95 -0.05 0.00 2.96 -1.26 0.39 118.68 123.84 3h73 s LEU 351 Ca -0.08 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.34 3h73 s LEU 351 Cb -0.13 -1.26 0.02 0.00 0.50 0.00 0.00 46.19 45.32 3h73 s LEU 351 CO -0.02 0.10 -0.03 -0.22 -1.32 0.00 0.00 176.35 174.86 3h73 s LEU 352 N 0.58 1.13 -0.32 -0.68 2.96 -0.06 -4.73 118.68 117.56 3h73 s LEU 352 Ca -0.14 -0.11 -0.15 0.00 -0.22 0.00 0.00 54.13 53.51 3h73 s LEU 352 Cb -0.17 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.08 3h73 s LEU 352 CO 0.05 -0.09 0.34 -0.75 -1.32 0.00 0.00 176.35 174.57 3h73 s LYS 353 N 1.19 3.69 0.67 1.98 2.47 -1.26 -0.27 119.74 128.22 3h73 s LYS 353 Ca -0.07 -0.33 -0.05 0.00 -1.56 0.00 0.00 55.97 53.96 3h73 s LYS 353 Cb -0.14 -3.76 0.06 0.00 -1.46 0.00 0.00 37.83 32.53 3h73 s LYS 353 CO -0.02 -0.44 0.96 0.95 0.16 0.00 0.00 175.35 176.97 3h73 s THR 354 N 1.99 2.35 0.46 3.43 -4.23 0.06 -4.93 115.64 114.78 3h73 s THR 354 Ca 0.12 -0.37 0.16 0.00 -1.18 0.00 0.00 61.69 60.41 3h73 s THR 354 Cb -0.16 -2.98 0.33 0.00 1.34 0.00 0.00 72.50 71.02 3h73 s THR 354 CO 0.11 0.00 2.01 -2.24 -0.54 0.00 0.00 174.62 173.97 3h73 h ASP 355 N -0.46 0.26 0.36 3.99 2.03 -1.95 0.20 116.42 120.85 3h73 h ASP 355 Ca -0.43 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 3h73 h ASP 355 Cb 1.31 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 3h73 h ASP 355 CO 0.57 0.16 0.00 0.29 -1.03 0.00 0.00 179.24 179.23 3h73 n LYS 356 N -4.46 0.52 -0.46 4.15 5.02 -1.26 -4.86 118.16 116.80 3h73 n LYS 356 Ca 0.07 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 3h73 n LYS 356 Cb 0.34 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 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 0.92 0.73 3.78 0.72 0.00 0.69 -5.05 105.19 106.99 3h73 n GLY 357 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.87 3.43 -0.19 2.61 2.01 -1.26 -4.66 115.64 114.71 3h73 s THR 358 Ca 0.00 1.00 -0.06 0.00 0.31 0.00 0.00 61.69 62.93 3h73 s THR 358 Cb 0.00 -3.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 3h73 s THR 358 CO 0.00 -0.09 0.03 -0.76 -0.69 0.00 0.00 174.62 173.11 3h73 s LEU 359 N -3.20 3.52 -0.20 4.42 1.43 -0.14 -0.76 118.68 123.75 3h73 s LEU 359 Ca 0.65 -0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.65 3h73 s LEU 359 Cb -0.23 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3h73 s LEU 359 CO 0.28 0.11 -0.08 -0.63 0.23 0.00 0.00 176.35 176.26 3h73 s ILE 360 N 0.75 3.20 -0.28 -0.59 1.01 0.63 -0.99 121.20 124.93 3h73 s ILE 360 Ca 0.02 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 60.05 3h73 s ILE 360 Cb -0.14 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.92 3h73 s ILE 360 CO 0.02 0.46 0.05 0.00 0.00 0.00 0.00 174.94 175.47 3h73 s ALA 361 N 1.20 2.99 0.24 9.38 0.00 -0.23 -0.88 121.76 134.46 3h73 s ALA 361 Ca 0.02 -1.43 0.07 0.00 0.00 0.00 0.00 51.96 50.62 3h73 s ALA 361 Cb -0.14 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 3h73 s ALA 361 CO -0.02 -0.87 0.18 0.20 0.00 0.00 0.00 175.76 175.25 3h73 s GLY 362 N 1.47 1.45 0.10 0.00 0.00 0.16 -1.12 107.32 109.38 3h73 s GLY 362 Ca 0.02 -1.41 -0.27 0.00 0.00 0.00 0.00 44.72 43.07 3h73 s GLY 362 CO 0.01 -1.45 1.02 0.00 0.00 0.00 0.00 173.10 172.68 3h73 s ALA 363 N -2.10 -1.79 -0.15 3.20 0.00 -0.44 -1.52 121.76 118.96 3h73 s ALA 363 Ca 0.33 0.36 -0.20 0.00 0.00 0.00 0.00 51.96 52.45 3h73 s ALA 363 Cb -0.08 0.55 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 3h73 s ALA 363 CO 0.25 -0.99 0.59 -0.51 0.00 0.00 0.00 175.76 175.09 3h73 s ASP 364 N -2.88 6.74 -0.66 0.00 1.11 0.13 -2.33 116.67 118.78 3h73 s ASP 364 Ca 0.12 0.89 -0.14 0.00 0.18 0.00 0.00 52.55 53.59 3h73 s ASP 364 Cb -0.00 -2.34 0.17 0.00 1.07 0.00 0.00 42.92 41.82 3h73 s ASP 364 CO -0.00 -0.15 0.60 -0.70 1.18 0.00 0.00 175.17 176.09 3h73 s GLU 365 N 1.27 3.18 -0.84 8.23 2.12 0.02 -1.94 118.70 130.75 3h73 s GLU 365 Ca 0.29 -2.07 -0.17 0.00 0.36 0.00 0.00 54.97 53.39 3h73 s GLU 365 Cb -0.16 -4.30 0.17 0.00 0.26 0.00 0.00 34.13 30.10 3h73 s GLU 365 CO 0.12 -1.29 0.92 1.03 -0.54 0.00 0.00 175.26 175.49 3h73 s ARG 366 N 0.90 3.53 0.10 4.30 0.52 0.58 -1.75 118.95 127.14 3h73 s ARG 366 Ca 0.10 -2.01 -0.20 0.00 -0.52 0.00 0.00 55.73 53.09 3h73 s ARG 366 Cb -0.21 -4.63 -0.09 0.00 0.52 0.00 0.00 34.95 30.55 3h73 s ARG 366 CO -0.03 -1.53 1.70 -0.09 0.02 0.00 0.00 175.30 175.37 3h73 h ARG 367 N 8.42 0.25 0.00 3.54 2.43 -1.69 -0.68 114.38 126.64 3h73 h ARG 367 Ca 0.08 -0.03 -0.20 0.00 -0.81 0.00 0.00 59.98 59.02 3h73 h ARG 367 Cb 1.04 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.51 3h73 h ARG 367 CO 0.95 0.25 -0.95 -0.07 -1.51 0.00 0.00 179.97 178.64 3h73 h LEU 368 N 0.18 0.00 0.00 3.80 3.38 -1.90 -1.94 115.31 118.83 3h73 h LEU 368 Ca 0.06 0.00 0.25 0.00 0.09 0.00 0.00 57.88 58.29 3h73 h LEU 368 Cb 0.07 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3h73 h LEU 368 CO -0.01 0.94 0.68 0.00 0.09 0.00 0.00 178.44 180.14 3h73 n HIS 369 N -3.33 -0.44 1.36 1.13 1.44 -1.25 -4.89 115.22 109.23 3h73 n HIS 369 Ca 0.00 -0.62 0.13 0.00 -2.01 0.00 0.00 57.72 55.23 3h73 n HIS 369 Cb 0.92 0.28 0.42 0.00 0.12 0.00 0.00 29.99 31.73 3h73 n HIS 369 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 3h73 n SER 370 N -0.91 1.57 -4.75 4.39 7.64 -1.26 -4.52 113.62 115.77 3h73 n SER 370 Ca 0.03 -1.40 -0.30 0.00 1.01 0.00 0.00 58.87 58.20 3h73 n SER 370 Cb 0.46 0.06 0.11 0.00 -1.01 0.00 0.00 64.21 63.82 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 -2.15 4.10 -0.13 6.43 0.01 -1.26 -4.90 113.70 115.79 3h73 s SER 371 Ca 0.33 1.60 -0.06 0.00 1.31 0.00 0.00 55.95 59.12 3h73 s SER 371 Cb 0.20 -2.31 -0.24 0.00 0.21 0.00 0.00 66.02 63.89 3h73 s SER 371 CO 0.39 -2.26 3.54 0.47 0.41 0.00 0.00 173.24 175.79 3h73 n ASP 372 N -3.65 5.54 -1.78 2.44 8.00 -1.26 -4.77 116.55 121.07 3h73 n ASP 372 Ca 0.08 -2.52 -0.00 0.00 0.71 0.00 0.00 54.79 53.05 3h73 n ASP 372 Cb 0.54 -1.42 0.01 0.00 -0.02 0.00 0.00 41.12 40.23 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 2.49 -0.56 -1.50 1.24 2.14 -1.26 -4.42 117.44 115.56 3h73 n TRP 373 Ca 0.46 -0.32 0.00 0.00 2.07 0.00 0.00 57.50 59.71 3h73 n TRP 373 Cb 0.86 0.15 0.00 0.00 -0.81 0.00 0.00 31.31 31.51 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 -0.25 -0.93 3.52 -1.67 0.00 -1.25 -4.76 105.19 99.85 3h73 n GLY 374 Ca 0.00 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 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 6.19 -0.10 1.61 2.15 -1.26 -4.47 116.67 116.79 3h73 s ASP 375 Ca 0.00 -0.55 0.01 0.00 0.43 0.00 0.00 52.55 52.44 3h73 s ASP 375 Cb 0.00 -2.51 0.02 0.00 -0.30 0.00 0.00 42.92 40.13 3h73 s ASP 375 CO 0.00 -1.67 -0.11 -0.63 -0.17 0.00 0.00 175.17 172.59 3h73 s ILE 376 N 5.12 1.17 0.09 4.11 1.01 -1.26 -2.52 121.20 128.93 3h73 s ILE 376 Ca 0.32 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.56 3h73 s ILE 376 Cb -0.11 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 3h73 s ILE 376 CO 0.15 0.38 0.10 -0.83 0.00 0.00 0.00 174.94 174.74 3h73 s GLY 377 N 1.17 1.97 -0.37 6.18 0.00 -0.72 -4.03 107.32 111.53 3h73 s GLY 377 Ca -0.04 -1.04 -0.15 0.00 0.00 0.00 0.00 44.72 43.49 3h73 s GLY 377 CO -0.03 -1.02 0.35 1.06 0.00 0.00 0.00 173.10 173.47 3h73 s MET 378 N -2.54 3.34 0.17 2.90 1.00 0.06 -0.79 119.30 123.44 3h73 s MET 378 Ca 0.30 -0.63 0.06 0.00 0.00 0.00 0.00 55.69 55.43 3h73 s MET 378 Cb -0.12 -3.87 -0.04 0.00 0.00 0.00 0.00 34.83 30.79 3h73 s MET 378 CO 0.23 -0.63 -0.13 0.14 0.00 0.00 0.00 175.02 174.63 3h73 s VAL 379 N 1.95 1.49 0.16 -6.03 -7.23 -0.98 0.33 120.40 110.08 3h73 s VAL 379 Ca 0.10 -2.10 -0.03 0.00 -1.81 0.00 0.00 61.98 58.13 3h73 s VAL 379 Cb -0.17 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 3h73 s VAL 379 CO 0.12 -0.63 0.14 0.27 -0.31 0.00 0.00 175.10 174.69 3h73 s ILE 380 N -3.01 0.07 0.04 -0.62 -4.36 0.23 -1.33 121.20 112.22 3h73 s ILE 380 Ca 0.19 -1.78 0.02 0.00 -0.26 0.00 0.00 60.65 58.82 3h73 s ILE 380 Cb -0.00 -2.08 -0.02 0.00 1.25 0.00 0.00 42.46 41.61 3h73 s ILE 380 CO 0.04 -0.33 -0.07 -0.13 0.24 0.00 0.00 174.94 174.70 3h73 s ARG 381 N -4.05 0.48 0.01 0.37 0.52 -0.28 0.13 118.95 116.13 3h73 s ARG 381 Ca 0.25 -0.71 0.07 0.00 -0.52 0.00 0.00 55.73 54.83 3h73 s ARG 381 Cb 0.06 -0.21 -0.03 0.00 0.52 0.00 0.00 34.95 35.29 3h73 s ARG 381 CO 0.03 0.03 -0.23 1.03 0.02 0.00 0.00 175.30 176.19 3h73 s ARG 382 N -1.50 2.08 -0.10 3.54 0.52 -1.26 -1.07 118.95 121.16 3h73 s ARG 382 Ca -0.11 -0.95 0.02 0.00 -0.52 0.00 0.00 55.73 54.17 3h73 s ARG 382 Cb -0.10 -2.11 0.02 0.00 0.52 0.00 0.00 34.95 33.28 3h73 s ARG 382 CO 0.00 0.55 -0.14 0.45 0.02 0.00 0.00 175.30 176.19 3h73 s SER 383 N -0.97 2.33 0.00 0.23 0.15 -0.16 -0.39 113.70 114.89 3h73 s SER 383 Ca 0.12 -0.40 0.21 0.00 0.70 0.00 0.00 55.95 56.58 3h73 s SER 383 Cb -0.10 -1.03 0.20 0.00 -1.71 0.00 0.00 66.02 63.37 3h73 s SER 383 CO 0.01 0.00 1.19 -0.62 1.20 0.00 0.00 173.24 175.02 3h73 n GLU 384 N 4.25 1.98 -1.60 5.44 1.02 -1.26 -0.97 120.64 129.50 3h73 n GLU 384 Ca -0.19 -1.81 -0.17 0.00 -0.02 0.00 0.00 57.16 54.97 3h73 n GLU 384 Cb 0.51 -1.41 0.08 0.00 -0.02 0.00 0.00 31.44 30.60 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 1.20 4.20 -3.66 1.62 5.68 -1.26 -4.93 116.55 119.40 3h73 n ASP 385 Ca 0.13 -3.79 -0.26 0.00 -0.50 0.00 0.00 54.79 50.37 3h73 n ASP 385 Cb 0.53 -0.43 0.06 0.00 -1.14 0.00 0.00 41.12 40.14 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 -0.84 -5.99 0.00 -1.12 5.15 -1.26 -2.99 115.26 108.21 3h73 n ASN 386 Ca 0.39 -0.59 0.00 0.00 -0.60 0.00 0.00 54.58 53.78 3h73 n ASN 386 Cb 0.89 -4.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.41 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 -1.92 0.44 0.08 8.20 0.00 -1.26 -4.97 105.19 105.76 3h73 n GLY 387 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 3h73 n GLY 387 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h73 h LYS 388 N 4.03 -0.09 -5.10 1.61 1.57 -1.94 -3.45 116.57 113.20 3h73 h LYS 388 Ca 0.00 0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 58.44 3h73 h LYS 388 Cb 0.00 0.02 -0.18 0.00 0.08 0.00 0.00 32.23 32.15 3h73 h LYS 388 CO 0.00 0.22 -0.74 0.95 -0.57 0.00 0.00 179.45 179.31 3h73 s THR 389 N -4.95 1.06 0.04 -0.16 -4.23 -1.26 -5.10 115.64 101.03 3h73 s THR 389 Ca -0.15 -1.67 0.05 0.00 -1.18 0.00 0.00 61.69 58.74 3h73 s THR 389 Cb 0.03 -1.41 -0.02 0.00 1.34 0.00 0.00 72.50 72.44 3h73 s THR 389 CO 0.65 -0.52 -0.14 0.26 -0.54 0.00 0.00 174.62 174.33 3h73 s TRP 390 N -2.36 1.22 1.00 3.99 0.52 -1.26 -4.25 118.94 117.80 3h73 s TRP 390 Ca 0.07 -0.36 -0.17 0.00 0.02 0.00 0.00 56.10 55.66 3h73 s TRP 390 Cb -0.03 -0.72 0.23 0.00 -1.15 0.00 0.00 33.47 31.79 3h73 s TRP 390 CO 0.01 0.03 1.34 0.41 0.02 0.00 0.00 176.95 178.76 3h73 n GLY 391 N 1.89 -1.56 3.73 0.98 0.00 0.48 -4.96 105.19 105.75 3h73 n GLY 391 Ca -0.18 -1.70 -0.31 0.00 0.00 0.00 0.00 46.02 43.83 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 -5.86 3.86 0.39 1.61 1.01 -1.26 -4.52 116.67 111.90 3h73 s ASP 392 Ca 0.76 1.95 -0.27 0.00 0.71 0.00 0.00 52.55 55.70 3h73 s ASP 392 Cb -0.02 -2.53 -0.09 0.00 1.01 0.00 0.00 42.92 41.29 3h73 s ASP 392 CO 0.53 -2.47 1.36 -0.13 0.21 0.00 0.00 175.17 174.68 3h73 s ARG 393 N -4.81 4.03 -0.17 8.23 0.52 -1.26 -4.61 118.95 120.88 3h73 s ARG 393 Ca 0.63 2.30 0.01 0.00 -0.52 0.00 0.00 55.73 58.15 3h73 s ARG 393 Cb -0.19 -2.85 0.01 0.00 0.52 0.00 0.00 34.95 32.44 3h73 s ARG 393 CO 0.57 -0.49 -0.18 0.08 0.02 0.00 0.00 175.30 175.30 3h73 s VAL 394 N -1.19 2.30 -0.16 3.52 1.01 0.12 -4.96 120.40 121.04 3h73 s VAL 394 Ca 0.55 -0.87 -0.21 0.00 0.00 0.00 0.00 61.98 61.45 3h73 s VAL 394 Cb -0.41 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 3h73 s VAL 394 CO 0.54 0.52 0.62 -0.89 0.00 0.00 0.00 175.10 175.90 3h73 s THR 395 N 1.14 5.05 -0.18 3.92 2.01 -1.26 -0.60 115.64 125.71 3h73 s THR 395 Ca 0.01 1.21 -0.24 0.00 0.31 0.00 0.00 61.69 62.97 3h73 s THR 395 Cb -0.14 -3.95 -0.22 0.00 0.01 0.00 0.00 72.50 68.20 3h73 s THR 395 CO -0.07 0.17 0.44 0.40 -0.69 0.00 0.00 174.62 174.86 3h73 h ILE 396 N 5.03 1.27 -2.79 1.82 2.04 -0.49 -3.43 117.51 120.96 3h73 h ILE 396 Ca -0.35 -2.24 -0.13 0.00 1.00 0.00 0.00 64.86 63.15 3h73 h ILE 396 Cb 1.16 2.68 -0.25 0.00 -0.74 0.00 0.00 36.82 39.67 3h73 h ILE 396 CO 0.77 0.43 -0.28 -0.89 0.00 0.00 0.00 178.15 178.17 3h73 s THR 397 N -2.30 -0.01 -0.32 -0.27 2.01 -1.16 -4.73 115.64 108.87 3h73 s THR 397 Ca -0.25 0.03 0.04 0.00 0.31 0.00 0.00 61.69 61.82 3h73 s THR 397 Cb 0.02 -0.54 0.17 0.00 0.01 0.00 0.00 72.50 72.16 3h73 s THR 397 CO 0.63 0.01 0.49 0.21 -0.69 0.00 0.00 174.62 175.27 3h73 s ASN 398 N 0.50 -0.42 0.50 3.53 3.84 -0.49 -0.76 114.94 121.63 3h73 s ASN 398 Ca -0.02 -0.41 -0.22 0.00 0.21 0.00 0.00 52.86 52.42 3h73 s ASN 398 Cb -0.04 1.45 -0.07 0.00 -0.55 0.00 0.00 41.25 42.05 3h73 s ASN 398 CO -0.03 -0.30 1.17 -0.76 -2.79 0.00 0.00 177.10 174.39 3h73 s LEU 399 N 2.40 3.91 0.49 3.21 1.43 -1.26 -3.86 118.68 125.00 3h73 s LEU 399 Ca 0.11 2.31 -0.19 0.00 -1.03 0.00 0.00 54.13 55.33 3h73 s LEU 399 Cb -0.11 -4.36 -0.09 0.00 0.03 0.00 0.00 46.19 41.67 3h73 s LEU 399 CO -0.23 -1.08 1.00 0.00 0.23 0.00 0.00 176.35 176.27 3h73 s ARG 400 N -2.91 3.91 0.76 1.70 1.70 -1.22 -4.86 118.95 118.03 3h73 s ARG 400 Ca 0.67 1.17 -0.12 0.00 -0.47 0.00 0.00 55.73 56.99 3h73 s ARG 400 Cb -0.28 -2.12 0.05 0.00 -0.57 0.00 0.00 34.95 32.02 3h73 s ARG 400 CO 0.33 -0.32 1.12 0.16 -1.08 0.00 0.00 175.30 175.51 3h73 s ASP 401 N -2.39 4.93 -0.51 -2.89 -4.77 -1.26 -4.33 116.67 105.45 3h73 s ASP 401 Ca 0.63 1.09 -0.26 0.00 -3.30 0.00 0.00 52.55 50.71 3h73 s ASP 401 Cb -0.12 -1.79 0.03 0.00 -1.09 0.00 0.00 42.92 39.94 3h73 s ASP 401 CO 0.22 -1.66 0.99 0.21 0.70 0.00 0.00 175.17 175.63 3h73 s ASN 402 N -4.29 6.45 0.29 2.11 3.84 -0.37 -4.90 114.94 118.08 3h73 s ASN 402 Ca 0.60 -0.00 0.21 0.00 0.21 0.00 0.00 52.86 53.88 3h73 s ASN 402 Cb -0.12 -2.47 1.09 0.00 -0.55 0.00 0.00 41.25 39.20 3h73 s ASN 402 CO 0.52 -1.19 1.65 -0.81 -2.79 0.00 0.00 177.10 174.48 3h73 n PRO 403 N 7.51 0.15 -0.05 0.43 -0.04 -1.26 -2.14 135.00 139.60 3h73 n PRO 403 Ca 0.06 0.58 0.07 0.00 -0.04 0.00 0.00 63.50 64.17 3h73 n PRO 403 Cb 0.48 -1.92 0.09 0.00 -0.04 0.00 0.00 33.50 32.11 3h73 n PRO 403 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3h73 n LYS 404 N -2.23 1.38 -1.76 0.54 4.76 -1.26 -5.01 118.16 114.59 3h73 n LYS 404 Ca -0.01 -1.54 -0.41 0.00 -2.87 0.00 0.00 58.31 53.48 3h73 n LYS 404 Cb 0.08 -1.29 -0.01 0.00 -1.84 0.00 0.00 35.03 31.97 3h73 n LYS 404 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h73 n ALA 405 N 0.80 2.50 -0.20 7.82 0.00 -0.91 -4.80 120.51 125.72 3h73 n ALA 405 Ca 0.10 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.80 3h73 n ALA 405 Cb 0.38 -2.45 0.02 0.00 0.00 0.00 0.00 19.45 17.40 3h73 n ALA 405 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3h73 h SER 406 N 4.13 1.05 -3.64 0.00 0.02 -1.94 -3.39 113.55 109.78 3h73 h SER 406 Ca -0.48 -0.33 -0.68 0.00 -0.84 0.00 0.00 61.79 59.46 3h73 h SER 406 Cb 1.23 -0.29 -0.36 0.00 0.14 0.00 0.00 62.40 63.12 3h73 h SER 406 CO 0.74 1.13 -0.65 -0.62 -1.14 0.00 0.00 176.83 176.29 3h73 s ASP 407 N -6.62 4.96 0.36 3.07 -1.08 -1.26 -4.99 116.67 111.11 3h73 s ASP 407 Ca -0.12 -1.86 0.10 0.00 -0.52 0.00 0.00 52.55 50.15 3h73 s ASP 407 Cb 0.13 -1.72 0.85 0.00 -1.46 0.00 0.00 42.92 40.73 3h73 s ASP 407 CO 0.86 -0.40 1.86 -0.65 0.52 0.00 0.00 175.17 177.36 3h73 h PRO 408 N 7.88 0.63 0.00 4.34 0.11 -1.94 -1.00 132.00 142.02 3h73 h PRO 408 Ca -0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3h73 h PRO 408 Cb 1.04 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3h73 h PRO 408 CO 0.59 0.42 0.03 0.66 -0.21 0.00 0.00 178.00 179.49 3h73 h SER 409 N 0.65 0.00 0.00 -2.05 4.64 -1.97 -2.35 113.55 112.47 3h73 h SER 409 Ca 0.46 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.76 3h73 h SER 409 Cb 0.79 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.83 3h73 h SER 409 CO -0.21 0.00 -0.46 2.30 -0.87 0.00 0.00 176.83 177.58 3h73 n ILE 410 N -3.03 0.49 -1.45 0.95 -5.35 -0.63 -3.97 119.36 106.37 3h73 n ILE 410 Ca -0.03 -0.75 -0.30 0.00 -0.27 0.00 0.00 62.75 61.40 3h73 n ILE 410 Cb 0.09 0.38 0.08 0.00 -1.74 0.00 0.00 39.64 38.45 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 -0.29 5.80 3.00 3.28 0.00 -0.48 -3.48 105.19 113.02 3h73 n GLY 411 Ca 0.05 -2.20 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 3h73 n GLY 411 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h73 s SER 412 N -2.14 0.01 0.64 1.61 0.01 -1.26 -1.23 113.70 111.33 3h73 s SER 412 Ca 0.61 -0.05 -0.18 0.00 1.31 0.00 0.00 55.95 57.63 3h73 s SER 412 Cb 0.48 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.87 3h73 s SER 412 CO 0.01 -0.17 1.30 -2.84 0.41 0.00 0.00 173.24 171.95 3h73 s PRO 413 N -0.61 2.60 -0.02 12.44 0.02 -1.26 -3.60 135.00 144.57 3h73 s PRO 413 Ca -0.07 2.08 0.07 0.00 0.02 0.00 0.00 61.00 63.10 3h73 s PRO 413 Cb -0.04 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 32.58 3h73 s PRO 413 CO 0.00 -1.57 -0.23 0.08 -0.33 0.00 0.00 177.00 174.95 3h73 s VAL 414 N -1.39 2.29 -0.03 3.83 1.01 0.14 -4.67 120.40 121.58 3h73 s VAL 414 Ca 0.82 -1.06 0.06 0.00 0.00 0.00 0.00 61.98 61.80 3h73 s VAL 414 Cb -0.38 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 3h73 s VAL 414 CO 0.40 0.56 -0.22 0.20 0.00 0.00 0.00 175.10 176.04 3h73 s ASN 415 N -0.71 2.59 -0.27 3.32 0.01 -1.26 -0.46 114.94 118.16 3h73 s ASN 415 Ca 0.11 -0.41 -0.22 0.00 -0.71 0.00 0.00 52.86 51.62 3h73 s ASN 415 Cb -0.10 -0.44 0.07 0.00 0.41 0.00 0.00 41.25 41.19 3h73 s ASN 415 CO -0.00 0.25 0.71 -0.51 -1.51 0.00 0.00 177.10 176.04 3h73 s ILE 416 N -0.36 0.00 0.03 0.60 2.07 -0.87 -4.62 121.20 118.06 3h73 s ILE 416 Ca 0.04 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.28 3h73 s ILE 416 Cb -0.10 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.49 3h73 s ILE 416 CO 0.00 0.00 0.00 0.47 -1.91 0.00 0.00 174.94 173.50 3h73 n ASP 417 N 3.17 -5.78 -4.52 4.50 8.00 -1.26 -1.97 116.55 118.70 3h73 n ASP 417 Ca -0.16 0.89 -0.25 0.00 0.71 0.00 0.00 54.79 55.99 3h73 n ASP 417 Cb 0.56 -3.12 -0.10 0.00 -0.02 0.00 0.00 41.12 38.45 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 -1.41 1.86 -0.07 -1.24 0.23 -1.26 -3.16 119.30 114.24 3h73 s MET 418 Ca 0.00 -1.54 0.03 0.00 -1.03 0.00 0.00 55.69 53.15 3h73 s MET 418 Cb 0.00 -1.95 0.01 0.00 -1.53 0.00 0.00 34.83 31.36 3h73 s MET 418 CO 0.00 0.37 -0.17 0.08 -2.03 0.00 0.00 175.02 173.28 3h73 s VAL 419 N -2.14 1.47 0.08 5.16 1.01 0.57 -1.84 120.40 124.72 3h73 s VAL 419 Ca 0.27 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.62 3h73 s VAL 419 Cb -0.07 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3h73 s VAL 419 CO 0.15 0.43 -0.04 -0.76 0.00 0.00 0.00 175.10 174.88 3h73 s LEU 420 N 0.48 3.29 -0.18 3.92 1.43 -0.45 -1.18 118.68 125.99 3h73 s LEU 420 Ca -0.15 -0.24 -0.30 0.00 -1.03 0.00 0.00 54.13 52.41 3h73 s LEU 420 Cb -0.16 -2.03 0.14 0.00 0.03 0.00 0.00 46.19 44.17 3h73 s LEU 420 CO 0.05 0.19 1.07 0.54 0.23 0.00 0.00 176.35 178.43 3h73 s VAL 421 N -1.24 0.00 -0.03 -1.59 0.11 -0.88 -0.37 120.40 116.39 3h73 s VAL 421 Ca 0.23 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.34 3h73 s VAL 421 Cb -0.11 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.73 3h73 s VAL 421 CO 0.15 0.00 -0.20 -1.58 -3.33 0.00 0.00 175.10 170.14 3h73 s GLN 422 N -1.21 1.84 -0.14 1.54 0.74 -1.26 0.21 119.66 121.37 3h73 s GLN 422 Ca 0.01 -0.72 -0.29 0.00 0.05 0.00 0.00 55.36 54.41 3h73 s GLN 422 Cb -0.01 -1.67 -0.01 0.00 1.10 0.00 0.00 33.01 32.42 3h73 s GLN 422 CO -0.01 0.37 1.14 0.34 -0.55 0.00 0.00 175.29 176.58 3h73 s ASP 423 N -0.26 7.06 0.60 6.67 -1.08 -0.18 -4.84 116.67 124.64 3h73 s ASP 423 Ca 0.02 1.62 0.38 0.00 -0.52 0.00 0.00 52.55 54.05 3h73 s ASP 423 Cb -0.10 -2.55 1.80 0.00 -1.46 0.00 0.00 42.92 40.62 3h73 s ASP 423 CO 0.01 -0.64 2.15 1.55 0.52 0.00 0.00 175.17 178.76 3h73 h PRO 424 N 7.62 0.00 0.00 4.34 0.13 -1.95 0.65 132.00 142.79 3h73 h PRO 424 Ca -0.27 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.72 3h73 h PRO 424 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 3h73 h PRO 424 CO 0.93 0.00 -1.06 -1.91 -0.23 0.00 0.00 178.00 175.73 3h73 n GLU 425 N -3.10 0.52 0.10 0.86 2.13 -1.26 -4.46 120.64 115.43 3h73 n GLU 425 Ca -0.01 0.49 0.13 0.00 0.66 0.00 0.00 57.16 58.43 3h73 n GLU 425 Cb 0.21 -1.67 0.31 0.00 0.27 0.00 0.00 31.44 30.55 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 -1.99 -3.47 112.91 114.11 3h73 h THR 426 Ca -0.21 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 3h73 h THR 426 Cb 0.98 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 3h73 h THR 426 CO -0.13 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.43 3h73 n LYS 427 N -2.30 -0.52 -2.13 4.72 4.76 0.22 -4.98 118.16 117.94 3h73 n LYS 427 Ca 0.05 0.13 -0.41 0.00 -2.87 0.00 0.00 58.31 55.20 3h73 n LYS 427 Cb 0.44 -3.76 -0.03 0.00 -1.84 0.00 0.00 35.03 29.85 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 -0.76 4.34 -0.21 1.97 3.52 -1.25 -4.71 118.95 121.85 3h73 s ARG 428 Ca 0.00 2.17 -0.08 0.00 -0.13 0.00 0.00 55.73 57.69 3h73 s ARG 428 Cb 0.00 -3.15 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 3h73 s ARG 428 CO 0.00 -0.31 0.08 0.42 -0.81 0.00 0.00 175.30 174.68 3h73 s ILE 429 N -0.09 4.77 -0.01 4.11 1.01 -0.09 -1.01 121.20 129.90 3h73 s ILE 429 Ca 0.57 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 61.20 3h73 s ILE 429 Cb -0.39 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3h73 s ILE 429 CO 0.42 0.41 -0.01 -0.36 0.00 0.00 0.00 174.94 175.39 3h73 s PHE 430 N 0.78 3.04 -0.17 3.97 0.08 0.13 -0.51 117.98 125.30 3h73 s PHE 430 Ca 0.04 0.06 -0.01 0.00 0.12 0.00 0.00 56.93 57.15 3h73 s PHE 430 Cb -0.13 -1.66 0.05 0.00 -0.57 0.00 0.00 43.02 40.70 3h73 s PHE 430 CO 0.02 0.44 -0.04 0.45 -0.10 0.00 0.00 175.22 175.99 3h73 s SER 431 N -1.47 2.93 -0.12 1.36 0.15 -0.22 -2.08 113.70 114.25 3h73 s SER 431 Ca 0.18 -0.73 0.00 0.00 0.70 0.00 0.00 55.95 56.11 3h73 s SER 431 Cb -0.11 -0.88 -0.02 0.00 -1.71 0.00 0.00 66.02 63.30 3h73 s SER 431 CO 0.09 -0.21 -0.13 -0.63 1.20 0.00 0.00 173.24 173.56 3h73 s ILE 432 N 1.65 3.11 0.20 6.45 1.01 -0.33 -1.44 121.20 131.85 3h73 s ILE 432 Ca -0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.91 3h73 s ILE 432 Cb -0.16 -2.30 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 3h73 s ILE 432 CO -0.07 0.53 0.32 -0.72 0.00 0.00 0.00 174.94 175.00 3h73 s TYR 433 N 0.16 0.51 0.50 3.97 -0.85 -0.67 -0.31 117.35 120.66 3h73 s TYR 433 Ca -0.07 -0.85 -0.18 0.00 -0.52 0.00 0.00 57.07 55.45 3h73 s TYR 433 Cb -0.15 -0.06 -0.09 0.00 0.38 0.00 0.00 41.96 42.05 3h73 s TYR 433 CO 0.05 -0.80 0.98 -0.51 -1.52 0.00 0.00 175.55 173.75 3h73 s ASP 434 N -3.02 6.67 -0.01 -0.18 1.01 -0.83 -0.70 116.67 119.61 3h73 s ASP 434 Ca 0.23 1.61 0.00 0.00 0.71 0.00 0.00 52.55 55.10 3h73 s ASP 434 Cb 0.03 -2.52 0.01 0.00 1.01 0.00 0.00 42.92 41.45 3h73 s ASP 434 CO 0.05 -0.55 -0.00 -0.32 0.21 0.00 0.00 175.17 174.56 3h73 s MET 435 N -3.86 0.13 -0.00 8.23 -2.45 -0.26 -2.04 119.30 119.05 3h73 s MET 435 Ca 0.60 0.04 0.02 0.00 -1.25 0.00 0.00 55.69 55.10 3h73 s MET 435 Cb -0.10 -0.24 -0.01 0.00 1.25 0.00 0.00 34.83 35.73 3h73 s MET 435 CO 0.27 -0.06 -0.06 -0.06 1.05 0.00 0.00 175.02 176.16 3h73 s PHE 436 N 0.51 0.55 1.02 4.11 0.08 0.39 -0.68 117.98 123.97 3h73 s PHE 436 Ca -0.05 -0.12 -0.14 0.00 0.12 0.00 0.00 56.93 56.74 3h73 s PHE 436 Cb -0.07 -0.35 0.20 0.00 -0.57 0.00 0.00 43.02 42.23 3h73 s PHE 436 CO -0.01 -0.01 1.12 -1.25 -0.10 0.00 0.00 175.22 174.97 3h73 s PRO 437 N -0.21 0.22 -0.26 0.24 0.04 -1.26 0.25 135.00 134.02 3h73 s PRO 437 Ca 0.02 0.24 -0.43 0.00 0.04 0.00 0.00 61.00 60.87 3h73 s PRO 437 Cb -0.03 -1.74 -0.19 0.00 0.04 0.00 0.00 34.50 32.59 3h73 s PRO 437 CO -0.00 -2.81 1.43 -1.91 0.04 0.00 0.00 177.00 173.75 3h73 n GLU 438 N -4.19 0.27 -2.81 4.56 2.13 0.26 -4.30 120.64 116.56 3h73 n GLU 438 Ca 0.08 0.10 0.00 0.00 0.66 0.00 0.00 57.16 58.00 3h73 n GLU 438 Cb 0.59 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.66 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 3.12 -0.51 1.97 8.31 0.00 -1.23 -4.55 105.19 112.30 3h73 n GLY 439 Ca 0.26 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 3h73 n GLY 439 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h73 n LYS 440 N 0.00 2.66 0.00 1.61 4.81 -1.26 -4.32 118.16 121.66 3h73 n LYS 440 Ca 0.00 -3.06 0.00 0.00 -0.87 0.00 0.00 58.31 54.38 3h73 n LYS 440 Cb 0.00 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 32.92 3h73 n LYS 440 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h73 n GLY 441 N -0.83 2.87 0.32 3.14 0.00 -1.26 -2.10 105.19 107.33 3h73 n GLY 441 Ca 0.49 -0.33 0.21 0.00 0.00 0.00 0.00 46.02 46.39 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 0.04 -0.39 -0.61 2.10 -1.97 -1.36 117.51 115.32 3h73 h ILE 442 Ca 0.00 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 65.78 3h73 h ILE 442 Cb 0.00 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 36.88 3h73 h ILE 442 CO 0.00 0.01 0.00 0.49 -1.08 0.00 0.00 178.15 177.57 3h73 n PHE 443 N -3.13 0.51 -1.87 2.19 3.01 -0.89 -4.03 117.46 113.24 3h73 n PHE 443 Ca -0.02 -0.26 0.03 0.00 1.01 0.00 0.00 57.45 58.21 3h73 n PHE 443 Cb 0.14 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.66 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 1.25 1.76 3.77 1.37 0.00 -0.52 -4.91 105.19 107.92 3h73 n GLY 444 Ca 0.16 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.78 4.35 0.67 1.61 -1.94 -1.21 -4.71 119.30 117.27 3h73 s MET 445 Ca 0.15 1.89 -0.14 0.00 -1.71 0.00 0.00 55.69 55.88 3h73 s MET 445 Cb 0.15 -2.94 0.00 0.00 2.01 0.00 0.00 34.83 34.05 3h73 s MET 445 CO -0.03 -0.08 1.09 0.45 -0.01 0.00 0.00 175.02 176.44 3h73 s SER 446 N -0.92 5.16 0.31 3.03 0.15 -1.26 -4.95 113.70 115.22 3h73 s SER 446 Ca 0.51 1.90 0.17 0.00 0.70 0.00 0.00 55.95 59.22 3h73 s SER 446 Cb -0.33 -2.54 0.24 0.00 -1.71 0.00 0.00 66.02 61.69 3h73 s SER 446 CO 0.42 -1.59 1.53 0.77 1.20 0.00 0.00 173.24 175.56 3h73 h SER 447 N -0.16 0.00 -3.02 5.45 4.64 -1.99 -3.44 113.55 115.02 3h73 h SER 447 Ca -0.46 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.19 3h73 h SER 447 Cb 1.23 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.22 3h73 h SER 447 CO 0.54 0.45 -0.56 -1.10 -0.87 0.00 0.00 176.83 175.30 3h73 s GLN 448 N -3.12 3.17 0.43 4.77 -1.52 -1.26 -5.09 119.66 117.04 3h73 s GLN 448 Ca 0.03 -0.33 -0.21 0.00 -1.95 0.00 0.00 55.36 52.90 3h73 s GLN 448 Cb 0.08 -2.95 -0.11 0.00 -0.22 0.00 0.00 33.01 29.81 3h73 s GLN 448 CO 0.72 0.72 0.96 0.21 -0.25 0.00 0.00 175.29 177.65 3h73 s LYS 449 N -1.16 4.21 -0.09 2.91 2.20 -1.26 -5.05 119.74 121.50 3h73 s LYS 449 Ca 0.16 1.18 -0.00 0.00 -0.36 0.00 0.00 55.97 56.95 3h73 s LYS 449 Cb -0.12 -2.23 0.02 0.00 -1.51 0.00 0.00 37.83 33.99 3h73 s LYS 449 CO 0.06 -0.05 -0.06 -1.21 -0.36 0.00 0.00 175.35 173.73 3h73 s GLU 450 N -3.07 1.19 0.21 4.03 2.02 -1.26 -5.11 118.70 116.71 3h73 s GLU 450 Ca 0.62 -0.15 -0.32 0.00 0.02 0.00 0.00 54.97 55.13 3h73 s GLU 450 Cb -0.11 -1.28 -0.13 0.00 0.10 0.00 0.00 34.13 32.71 3h73 s GLU 450 CO 0.15 -0.21 1.61 0.39 0.02 0.00 0.00 175.26 177.22 3h73 n GLU 451 N 4.73 2.45 -0.04 1.61 -0.58 -1.26 -4.77 120.64 122.78 3h73 n GLU 451 Ca -0.14 0.88 0.03 0.00 -0.42 0.00 0.00 57.16 57.51 3h73 n GLU 451 Cb 0.50 -2.67 -0.16 0.00 -0.57 0.00 0.00 31.44 28.55 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 3.22 2.32 -2.36 0.62 0.00 -1.26 -4.65 120.51 118.40 3h73 n ALA 452 Ca 0.15 -0.80 -0.12 0.00 0.00 0.00 0.00 53.44 52.67 3h73 n ALA 452 Cb 0.33 -0.57 -0.10 0.00 0.00 0.00 0.00 19.45 19.10 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 -3.14 0.88 -0.02 0.00 1.51 -1.26 -0.74 117.35 114.58 3h73 s TYR 453 Ca -0.08 -0.78 -0.00 0.00 -1.01 0.00 0.00 57.07 55.19 3h73 s TYR 453 Cb 0.11 -0.51 0.03 0.00 -0.11 0.00 0.00 41.96 41.48 3h73 s TYR 453 CO 0.88 -0.11 0.03 0.21 -1.11 0.00 0.00 175.55 175.45 3h73 s LYS 454 N -3.20 -0.04 0.09 -0.62 2.20 -0.37 -4.88 119.74 112.91 3h73 s LYS 454 Ca 0.06 0.18 -0.25 0.00 -0.36 0.00 0.00 55.97 55.61 3h73 s LYS 454 Cb 0.01 -0.24 -0.06 0.00 -1.51 0.00 0.00 37.83 36.03 3h73 s LYS 454 CO -0.03 -0.16 0.76 0.15 -0.36 0.00 0.00 175.35 175.72 3h73 s LYS 455 N 1.02 4.51 -0.18 4.03 1.02 -1.26 -1.97 119.74 126.91 3h73 s LYS 455 Ca -0.08 1.09 -0.04 0.00 0.02 0.00 0.00 55.97 56.95 3h73 s LYS 455 Cb -0.12 -3.32 0.07 0.00 -0.52 0.00 0.00 37.83 33.94 3h73 s LYS 455 CO -0.03 0.40 0.16 0.42 -0.92 0.00 0.00 175.35 175.38 3h73 s ILE 456 N -0.48 -0.22 -1.21 2.17 1.01 0.12 -4.90 121.20 117.69 3h73 s ILE 456 Ca 0.37 -0.09 -0.10 0.00 0.00 0.00 0.00 60.65 60.83 3h73 s ILE 456 Cb -0.21 -0.59 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 3h73 s ILE 456 CO 0.24 -0.20 0.73 0.47 0.00 0.00 0.00 174.94 176.17 3h73 n ASP 457 N 5.30 -3.54 -2.47 3.58 8.00 -1.26 -1.21 116.55 124.95 3h73 n ASP 457 Ca -0.06 -0.92 -0.21 0.00 0.71 0.00 0.00 54.79 54.31 3h73 n ASP 457 Cb 0.49 -3.75 -0.01 0.00 -0.02 0.00 0.00 41.12 37.83 3h73 n ASP 457 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h73 n GLY 458 N -1.64 -0.50 2.89 0.44 0.00 -1.26 -4.98 105.19 100.14 3h73 n GLY 458 Ca -0.18 0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -5.12 1.19 -0.28 1.61 -0.14 -0.35 -5.12 119.74 111.54 3h73 s LYS 459 Ca 0.03 -0.16 -0.18 0.00 -1.36 0.00 0.00 55.97 54.31 3h73 s LYS 459 Cb -0.01 -1.27 -0.02 0.00 -1.68 0.00 0.00 37.83 34.84 3h73 s LYS 459 CO 0.04 -0.20 0.51 0.99 -0.76 0.00 0.00 175.35 175.93 3h73 s THR 460 N 1.48 5.06 0.09 2.17 2.01 -1.26 0.13 115.64 125.32 3h73 s THR 460 Ca -0.01 0.73 0.09 0.00 0.31 0.00 0.00 61.69 62.81 3h73 s THR 460 Cb -0.13 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 3h73 s THR 460 CO -0.04 0.01 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.38 3h73 s TYR 461 N 2.32 2.45 0.23 4.92 2.02 -0.83 -4.96 117.35 123.50 3h73 s TYR 461 Ca 0.20 -0.31 -0.30 0.00 -0.37 0.00 0.00 57.07 56.29 3h73 s TYR 461 Cb -0.16 -1.35 -0.09 0.00 -0.40 0.00 0.00 41.96 39.96 3h73 s TYR 461 CO 0.10 0.31 0.95 -1.14 -1.57 0.00 0.00 175.55 174.20 3h73 s GLN 462 N -1.84 4.83 0.27 -0.62 0.74 -1.26 -1.24 119.66 120.55 3h73 s GLN 462 Ca 0.15 1.51 -0.16 0.00 0.05 0.00 0.00 55.36 56.91 3h73 s GLN 462 Cb -0.10 -3.28 -0.08 0.00 1.10 0.00 0.00 33.01 30.64 3h73 s GLN 462 CO 0.07 0.48 0.70 0.42 -0.55 0.00 0.00 175.29 176.41 3h73 s ILE 463 N -1.09 4.68 -0.03 -2.34 1.01 0.08 -1.46 121.20 122.05 3h73 s ILE 463 Ca 0.42 1.02 0.05 0.00 0.00 0.00 0.00 60.65 62.13 3h73 s ILE 463 Cb -0.26 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.49 3h73 s ILE 463 CO 0.32 -0.01 -0.19 -0.76 0.00 0.00 0.00 174.94 174.31 3h73 s LEU 464 N -2.54 1.99 -0.01 2.97 1.43 -0.22 -4.14 118.68 118.15 3h73 s LEU 464 Ca 0.48 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 53.24 3h73 s LEU 464 Cb -0.13 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 3h73 s LEU 464 CO 0.19 0.20 -0.03 -0.31 0.23 0.00 0.00 176.35 176.64 3h73 s TYR 465 N -0.21 3.01 -0.11 0.29 2.02 0.56 -1.29 117.35 121.61 3h73 s TYR 465 Ca 0.02 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.77 3h73 s TYR 465 Cb -0.10 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.83 3h73 s TYR 465 CO 0.01 0.43 -0.11 0.50 -1.57 0.00 0.00 175.55 174.80 3h73 s ARG 466 N -1.43 1.85 0.17 -0.62 3.52 -1.26 -2.10 118.95 119.08 3h73 s ARG 466 Ca 0.18 -0.41 -0.33 0.00 -0.13 0.00 0.00 55.73 55.04 3h73 s ARG 466 Cb -0.11 -1.70 -0.14 0.00 -1.56 0.00 0.00 34.95 31.44 3h73 s ARG 466 CO 0.08 -0.15 1.50 0.39 -0.81 0.00 0.00 175.30 176.32 3h73 n GLU 467 N 4.49 2.00 0.00 5.12 -0.58 -1.26 -1.40 120.64 129.01 3h73 n GLU 467 Ca -0.17 0.72 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 3h73 n GLU 467 Cb 0.51 -2.44 0.00 0.00 -0.57 0.00 0.00 31.44 28.94 3h73 n GLU 467 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h73 n GLY 468 N 2.97 1.17 3.19 0.62 0.00 -1.26 -5.05 105.19 106.84 3h73 n GLY 468 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.91 1.55 -0.01 1.61 2.02 -0.49 -5.03 118.70 117.44 3h73 s GLU 469 Ca 0.00 -0.69 0.08 0.00 0.02 0.00 0.00 54.97 54.38 3h73 s GLU 469 Cb 0.00 -1.50 -0.24 0.00 0.10 0.00 0.00 34.13 32.50 3h73 s GLU 469 CO 0.00 0.41 0.79 -0.22 0.02 0.00 0.00 175.26 176.26 3h73 h LYS 470 N 5.66 0.06 -7.14 1.61 3.64 -1.97 -3.41 116.57 115.02 3h73 h LYS 470 Ca -0.38 -0.10 -0.55 0.00 -1.27 0.00 0.00 60.65 58.35 3h73 h LYS 470 Cb 1.14 0.04 0.16 0.00 -0.41 0.00 0.00 32.23 33.16 3h73 h LYS 470 CO 0.48 0.75 0.46 0.20 -2.27 0.00 0.00 179.45 179.07 3h73 s GLY 471 N -5.05 2.64 -0.29 5.01 0.00 -1.26 -4.99 107.32 103.38 3h73 s GLY 471 Ca -0.06 1.09 -0.13 0.00 0.00 0.00 0.00 44.72 45.62 3h73 s GLY 471 CO 0.82 1.51 0.28 0.00 0.00 0.00 0.00 173.10 175.71 3h73 s ALA 472 N -1.64 3.53 0.78 3.20 0.00 -1.26 -4.69 121.76 121.69 3h73 s ALA 472 Ca 0.79 -1.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.57 3h73 s ALA 472 Cb -0.34 -2.62 0.06 0.00 0.00 0.00 0.00 23.12 20.22 3h73 s ALA 472 CO 0.43 -0.71 1.13 0.71 0.00 0.00 0.00 175.76 177.31 3h73 s TYR 473 N 1.88 3.00 0.02 0.00 1.51 -0.41 -3.87 117.35 119.48 3h73 s TYR 473 Ca 0.10 0.96 0.00 0.00 -1.01 0.00 0.00 57.07 57.12 3h73 s TYR 473 Cb -0.16 -3.25 -0.02 0.00 -0.11 0.00 0.00 41.96 38.42 3h73 s TYR 473 CO 0.11 -1.64 -0.03 0.95 -1.11 0.00 0.00 175.55 173.83 3h73 s THR 474 N -3.37 0.15 -0.33 -0.71 -4.23 -0.52 -1.06 115.64 105.58 3h73 s THR 474 Ca 0.61 -0.94 -0.13 0.00 -1.18 0.00 0.00 61.69 60.05 3h73 s THR 474 Cb -0.12 -0.31 -0.02 0.00 1.34 0.00 0.00 72.50 73.38 3h73 s THR 474 CO 0.52 -0.49 0.25 -0.63 -0.54 0.00 0.00 174.62 173.72 3h73 s ILE 475 N -1.48 5.27 0.00 2.99 1.01 -0.53 -0.12 121.20 128.34 3h73 s ILE 475 Ca -0.15 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.40 3h73 s ILE 475 Cb -0.10 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.68 3h73 s ILE 475 CO -0.01 0.03 0.00 0.54 0.00 0.00 0.00 174.94 175.50 3h73 n ARG 476 N 5.14 3.74 -1.58 2.79 1.74 -0.16 -4.09 116.66 124.23 3h73 n ARG 476 Ca -0.12 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.52 3h73 n ARG 476 Cb 0.50 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.93 3h73 n ARG 476 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3h73 n GLU 477 N 0.00 1.27 -0.84 5.56 0.00 -1.26 -0.83 120.64 124.54 3h73 n GLU 477 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 57.16 57.61 3h73 n GLU 477 Cb 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 31.44 29.62 3h73 n GLU 477 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3h73 n ASN 478 N 1.16 -2.78 0.00 -1.84 3.02 -1.26 -2.04 115.26 111.52 3h73 n ASN 478 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 3h73 n ASN 478 Cb 0.33 -2.20 0.00 0.00 -0.61 0.00 0.00 39.78 37.30 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 -1.03 0.55 3.71 7.41 0.00 -0.01 -4.71 105.19 111.11 3h73 n GLY 479 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.00 3.07 -0.09 2.61 2.01 -0.87 0.00 115.64 120.37 3h73 s THR 480 Ca 0.00 0.69 -0.24 0.00 0.31 0.00 0.00 61.69 62.45 3h73 s THR 480 Cb 0.00 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 3h73 s THR 480 CO 0.00 0.03 0.74 -0.69 -0.69 0.00 0.00 174.62 174.02 3h73 s VAL 481 N 1.62 5.00 -0.01 3.82 1.01 -0.70 -0.99 120.40 130.16 3h73 s VAL 481 Ca 0.68 1.52 0.02 0.00 0.00 0.00 0.00 61.98 64.20 3h73 s VAL 481 Cb -0.39 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 3h73 s VAL 481 CO 0.31 0.19 -0.04 -0.31 0.00 0.00 0.00 175.10 175.25 3h73 s TYR 482 N 1.13 2.97 0.85 5.22 1.51 0.83 -1.42 117.35 128.44 3h73 s TYR 482 Ca 0.38 0.02 -0.11 0.00 -1.01 0.00 0.00 57.07 56.35 3h73 s TYR 482 Cb -0.18 -1.64 0.10 0.00 -0.11 0.00 0.00 41.96 40.13 3h73 s TYR 482 CO 0.17 0.41 1.09 0.95 -1.11 0.00 0.00 175.55 177.06 3h73 s THR 483 N -1.01 2.84 0.59 -0.71 -4.23 0.83 -1.44 115.64 112.51 3h73 s THR 483 Ca 0.17 0.27 0.30 0.00 -1.18 0.00 0.00 61.69 61.26 3h73 s THR 483 Cb -0.11 -2.86 0.36 0.00 1.34 0.00 0.00 72.50 71.22 3h73 s THR 483 CO 0.08 -0.36 2.23 -0.65 -0.54 0.00 0.00 174.62 175.39 3h73 h PRO 484 N -1.35 0.00 -0.04 3.99 0.11 -1.90 -1.00 132.00 131.81 3h73 h PRO 484 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3h73 h PRO 484 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3h73 h PRO 484 CO 0.56 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 3h73 n ASP 485 N -3.80 0.80 0.00 -2.05 5.75 -1.26 -4.90 116.55 111.09 3h73 n ASP 485 Ca -0.02 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 53.39 3h73 n ASP 485 Cb 0.12 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 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 1.05 0.83 3.51 6.12 0.00 -0.38 -5.08 105.19 111.23 3h73 n GLY 486 Ca 0.19 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.48 2.82 0.51 1.61 1.02 -1.26 -4.87 119.74 118.09 3h73 s LYS 487 Ca 0.00 -0.62 -0.21 0.00 0.02 0.00 0.00 55.97 55.16 3h73 s LYS 487 Cb 0.00 -2.54 -0.06 0.00 -0.52 0.00 0.00 37.83 34.71 3h73 s LYS 487 CO 0.00 0.55 1.17 0.00 -0.92 0.00 0.00 175.35 176.15 3h73 s ALA 488 N -0.52 2.81 0.38 5.17 0.00 -1.26 -0.12 121.76 128.21 3h73 s ALA 488 Ca 0.07 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.96 3h73 s ALA 488 Cb -0.12 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3h73 s ALA 488 CO 0.02 -0.80 0.03 0.25 0.00 0.00 0.00 175.76 175.26 3h73 n THR 489 N -0.96 0.00 0.36 0.00 -2.24 -0.51 -4.85 114.28 106.08 3h73 n THR 489 Ca 0.10 -1.75 0.09 0.00 -2.27 0.00 0.00 64.05 60.22 3h73 n THR 489 Cb 0.49 0.30 0.25 0.00 -2.10 0.00 0.00 70.33 69.27 3h73 n THR 489 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h73 n ASP 490 N -1.29 2.83 -4.89 3.42 5.75 -1.26 -4.72 116.55 116.39 3h73 n ASP 490 Ca -0.14 -1.98 -0.32 0.00 -0.01 0.00 0.00 54.79 52.34 3h73 n ASP 490 Cb 0.47 -0.33 -0.05 0.00 -1.03 0.00 0.00 41.12 40.18 3h73 n ASP 490 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3h73 s TYR 491 N -1.34 3.50 -0.03 2.11 1.51 -1.26 -0.59 117.35 121.24 3h73 s TYR 491 Ca 0.36 0.67 -0.10 0.00 -1.01 0.00 0.00 57.07 56.99 3h73 s TYR 491 Cb 0.19 -2.09 0.02 0.00 -0.11 0.00 0.00 41.96 39.97 3h73 s TYR 491 CO 0.25 0.43 0.24 -0.98 -1.11 0.00 0.00 175.55 174.38 3h73 s ARG 492 N -2.47 0.49 -0.02 -0.62 1.70 0.06 -1.72 118.95 116.38 3h73 s ARG 492 Ca 0.40 -0.09 0.02 0.00 -0.47 0.00 0.00 55.73 55.58 3h73 s ARG 492 Cb -0.12 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.44 3h73 s ARG 492 CO 0.22 -0.11 -0.03 0.08 -1.08 0.00 0.00 175.30 174.37 3h73 s VAL 493 N -0.90 3.92 -0.72 4.99 1.01 0.10 -0.51 120.40 128.29 3h73 s VAL 493 Ca -0.10 -0.61 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 3h73 s VAL 493 Cb -0.05 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.65 3h73 s VAL 493 CO 0.02 0.44 1.39 -0.69 0.00 0.00 0.00 175.10 176.26 3h73 s VAL 494 N -0.99 3.66 -0.79 2.92 1.01 -0.15 -4.41 120.40 121.65 3h73 s VAL 494 Ca 0.17 0.35 0.22 0.00 0.00 0.00 0.00 61.98 62.72 3h73 s VAL 494 Cb -0.11 -4.75 -0.19 0.00 0.00 0.00 0.00 36.38 31.33 3h73 s VAL 494 CO 0.07 -1.69 0.94 1.33 0.00 0.00 0.00 175.10 175.75 3h73 n VAL 495 N 6.54 0.04 -3.53 2.92 0.24 -1.26 -1.89 118.33 121.39 3h73 n VAL 495 Ca 0.07 -0.12 -0.27 0.00 -2.04 0.00 0.00 64.34 61.98 3h73 n VAL 495 Cb 0.50 0.60 -0.10 0.00 -1.47 0.00 0.00 33.84 33.37 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 -1.70 2.15 -4.75 -1.34 8.00 -1.26 -5.03 116.55 112.62 3h73 n ASP 496 Ca 0.03 -3.05 -0.38 0.00 0.71 0.00 0.00 54.79 52.10 3h73 n ASP 496 Cb 0.38 -0.67 0.03 0.00 -0.02 0.00 0.00 41.12 40.84 3h73 n ASP 496 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3h73 s PRO 497 N -1.48 3.22 0.00 -0.24 0.04 -1.26 -4.97 135.00 130.31 3h73 s PRO 497 Ca 0.33 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.51 3h73 s PRO 497 Cb 0.07 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3h73 s PRO 497 CO -0.11 -1.10 0.13 1.33 0.04 0.00 0.00 177.00 177.28 3h73 n VAL 498 N -0.99 0.00 -1.78 -0.36 0.24 -1.26 -4.95 118.33 109.23 3h73 n VAL 498 Ca 0.10 -0.28 -0.31 0.00 -2.04 0.00 0.00 64.34 61.81 3h73 n VAL 498 Cb 0.46 1.20 0.02 0.00 -1.47 0.00 0.00 33.84 34.05 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 -0.31 3.33 0.28 7.34 1.02 -1.26 -4.91 119.74 125.23 3h73 s LYS 499 Ca 0.00 0.86 -0.29 0.00 0.02 0.00 0.00 55.97 56.56 3h73 s LYS 499 Cb 0.00 -2.04 -0.13 0.00 -0.52 0.00 0.00 37.83 35.13 3h73 s LYS 499 CO 0.00 -0.79 1.26 -2.30 -0.92 0.00 0.00 175.35 172.61 3h73 n PRO 500 N -2.82 1.87 -0.90 -1.68 -0.02 -1.26 -0.10 135.00 130.08 3h73 n PRO 500 Ca 0.07 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3h73 n PRO 500 Cb 0.54 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.95 0.00 -3.80 3.55 0.00 -1.26 -3.04 120.51 116.91 3h73 n ALA 501 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.25 3h73 n ALA 501 Cb 0.33 -1.11 0.05 0.00 0.00 0.00 0.00 19.45 18.71 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 -2.14 -2.51 0.60 0.00 4.02 0.85 -1.39 117.16 116.59 3h73 n TYR 502 Ca 0.00 0.95 0.07 0.00 -0.01 0.00 0.00 57.90 58.90 3h73 n TYR 502 Cb 0.30 -4.37 0.33 0.00 -0.02 0.00 0.00 39.34 35.58 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 -2.91 0.00 -0.68 7.72 3.41 -1.17 -1.69 113.62 118.30 3h73 n SER 503 Ca 0.02 0.19 0.13 0.00 -0.26 0.00 0.00 58.87 58.95 3h73 n SER 503 Cb 0.54 -0.34 0.29 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.34 2.18 -4.75 4.04 5.75 -1.26 -3.42 116.55 117.76 3h73 n ASP 504 Ca 0.06 -1.68 -0.41 0.00 -0.01 0.00 0.00 54.79 52.74 3h73 n ASP 504 Cb 0.12 0.04 -0.02 0.00 -1.03 0.00 0.00 41.12 40.24 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 -2.07 4.16 0.00 0.11 2.20 -0.68 -1.83 119.74 121.63 3h73 s LYS 505 Ca 0.31 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.42 3h73 s LYS 505 Cb 0.20 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.47 3h73 s LYS 505 CO 0.35 -0.59 0.00 0.41 -0.36 0.00 0.00 175.35 175.16 3h73 n GLY 506 N 2.35 1.58 3.68 5.54 0.00 -0.79 -4.90 105.19 112.64 3h73 n GLY 506 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 2.65 -4.35 1.61 8.00 -0.76 -1.13 116.55 122.57 3h73 n ASP 507 Ca 0.00 1.19 -0.35 0.00 0.71 0.00 0.00 54.79 56.34 3h73 n ASP 507 Cb 0.00 -1.46 -0.14 0.00 -0.02 0.00 0.00 41.12 39.51 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 -0.64 3.05 0.14 0.64 1.98 0.12 -0.97 118.68 122.98 3h73 s LEU 508 Ca 0.59 -0.34 0.08 0.00 -2.89 0.00 0.00 54.13 51.56 3h73 s LEU 508 Cb -0.60 -1.79 -0.04 0.00 0.66 0.00 0.00 46.19 44.42 3h73 s LEU 508 CO 0.59 -0.02 -0.09 -0.31 -1.89 0.00 0.00 176.35 174.63 3h73 s TYR 509 N 1.50 2.72 -0.27 5.38 1.51 0.33 -0.38 117.35 128.14 3h73 s TYR 509 Ca 0.06 -0.18 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 3h73 s TYR 509 Cb -0.14 -1.38 0.07 0.00 -0.11 0.00 0.00 41.96 40.40 3h73 s TYR 509 CO -0.01 0.46 -0.01 0.21 -1.11 0.00 0.00 175.55 175.09 3h73 s LYS 510 N -2.50 1.48 6.47 -0.62 2.20 -0.34 -0.76 119.74 125.66 3h73 s LYS 510 Ca 0.23 -1.20 0.00 0.00 -0.36 0.00 0.00 55.97 54.64 3h73 s LYS 510 Cb -0.10 -2.63 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 3h73 s LYS 510 CO 0.15 -0.73 0.00 0.41 -0.36 0.00 0.00 175.35 174.82 3h73 n GLY 511 N 4.60 1.87 0.00 5.54 0.00 0.24 -2.11 105.19 115.33 3h73 n GLY 511 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3h73 n GLY 511 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3h73 n ASN 512 N 10.18 1.75 -4.59 1.61 5.15 -1.26 -4.92 115.26 123.18 3h73 n ASN 512 Ca 0.00 -1.87 -0.34 0.00 -0.60 0.00 0.00 54.58 51.76 3h73 n ASN 512 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 3h73 n ASN 512 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 3h73 s GLN 513 N -0.87 3.86 -0.05 1.20 0.74 -0.90 -5.07 119.66 118.57 3h73 s GLN 513 Ca 0.00 -0.40 -0.30 0.00 0.05 0.00 0.00 55.36 54.71 3h73 s GLN 513 Cb 0.00 -3.11 -0.04 0.00 1.10 0.00 0.00 33.01 30.96 3h73 s GLN 513 CO 0.00 0.28 1.31 -1.17 -0.55 0.00 0.00 175.29 175.16 3h73 s LEU 514 N 0.33 4.28 -0.18 3.68 2.96 -1.26 -1.20 118.68 127.28 3h73 s LEU 514 Ca 0.01 1.93 0.08 0.00 -0.22 0.00 0.00 54.13 55.93 3h73 s LEU 514 Cb -0.13 -3.55 -0.17 0.00 0.50 0.00 0.00 46.19 42.84 3h73 s LEU 514 CO 0.01 -0.68 -0.07 0.18 -1.32 0.00 0.00 176.35 174.47 3h73 n LEU 515 N 5.60 1.54 0.00 -0.68 4.77 0.49 -4.95 117.00 123.76 3h73 n LEU 515 Ca 0.13 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3h73 n LEU 515 Cb 0.45 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3h73 n LEU 515 CO 0.57 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 3h73 n GLY 516 N 2.27 -1.00 3.22 -0.72 0.00 -1.03 -3.78 105.19 104.15 3h73 n GLY 516 Ca -0.31 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.00 -0.36 0.00 1.61 2.47 -1.26 -0.70 114.94 112.69 3h73 s ASN 517 Ca 0.00 0.69 0.14 0.00 0.42 0.00 0.00 52.86 54.11 3h73 s ASN 517 Cb 0.00 0.68 0.65 0.00 -1.45 0.00 0.00 41.25 41.13 3h73 s ASN 517 CO 0.00 -0.13 1.41 2.30 -3.72 0.00 0.00 177.10 176.96 3h73 n ILE 518 N 3.15 0.84 1.16 -5.21 -5.35 -0.28 -2.02 119.36 111.65 3h73 n ILE 518 Ca -0.15 0.21 0.12 0.00 -0.27 0.00 0.00 62.75 62.66 3h73 n ILE 518 Cb 0.57 -0.97 0.22 0.00 -1.74 0.00 0.00 39.64 37.72 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 -1.40 0.00 -2.99 4.28 0.53 -1.26 -1.04 117.16 115.28 3h73 n TYR 519 Ca 0.05 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.53 3h73 n TYR 519 Cb 0.14 -0.04 -0.05 0.00 -1.03 0.00 0.00 39.34 38.36 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 -2.31 3.74 -0.32 -0.72 2.99 -0.85 -0.58 117.98 119.92 3h73 s PHE 520 Ca 0.25 1.47 0.07 0.00 0.00 0.00 0.00 56.93 58.72 3h73 s PHE 520 Cb 0.19 -2.82 -0.07 0.00 0.00 0.00 0.00 43.02 40.33 3h73 s PHE 520 CO 0.46 0.28 0.29 0.25 -0.00 0.00 0.00 175.22 176.50 3h73 n THR 521 N 2.79 0.00 -4.21 0.64 -2.24 -1.26 -4.80 114.28 105.20 3h73 n THR 521 Ca -0.03 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 3h73 n THR 521 Cb 0.50 1.00 -0.10 0.00 -2.10 0.00 0.00 70.33 69.63 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 -1.61 0.97 -1.81 4.28 -4.23 -1.26 -4.84 115.64 107.14 3h73 s THR 522 Ca 0.03 -1.96 -0.19 0.00 -1.18 0.00 0.00 61.69 58.38 3h73 s THR 522 Cb 0.05 -1.72 0.19 0.00 1.34 0.00 0.00 72.50 72.36 3h73 s THR 522 CO 0.27 -0.77 0.50 0.59 -0.54 0.00 0.00 174.62 174.67 3h73 n ASN 523 N -0.04 -1.37 -4.76 3.99 5.03 -1.26 -4.75 115.26 112.10 3h73 n ASN 523 Ca -0.12 -1.24 -0.39 0.00 0.87 0.00 0.00 54.58 53.70 3h73 n ASN 523 Cb 0.60 -1.66 0.01 0.00 -1.02 0.00 0.00 39.78 37.71 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 -7.26 3.70 0.00 3.52 1.02 -1.26 -4.82 119.74 114.64 3h73 s LYS 524 Ca 0.67 2.13 0.15 0.00 0.02 0.00 0.00 55.97 58.94 3h73 s LYS 524 Cb -0.39 -2.56 -0.13 0.00 -0.52 0.00 0.00 37.83 34.23 3h73 s LYS 524 CO 1.02 -0.71 0.67 0.25 -0.92 0.00 0.00 175.35 175.67 3h73 n THR 525 N -0.31 0.00 -4.40 2.17 -2.24 -1.26 -4.97 114.28 103.27 3h73 n THR 525 Ca 0.06 -0.18 -0.25 0.00 -2.27 0.00 0.00 64.05 61.41 3h73 n THR 525 Cb 0.45 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.62 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 -2.32 4.06 0.00 3.42 1.04 -1.25 -4.71 113.70 113.94 3h73 s SER 526 Ca 0.07 -1.10 0.28 0.00 0.48 0.00 0.00 55.95 55.68 3h73 s SER 526 Cb 0.12 -0.47 1.01 0.00 0.10 0.00 0.00 66.02 66.78 3h73 s SER 526 CO 0.58 -0.29 1.76 -2.65 0.98 0.00 0.00 173.24 173.62 3h73 n PRO 527 N -0.95 0.07 -4.80 4.02 -0.02 -1.26 -4.94 135.00 127.12 3h73 n PRO 527 Ca -0.04 -0.02 -0.29 0.00 -2.02 0.00 0.00 63.50 61.13 3h73 n PRO 527 Cb 0.63 -1.50 -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 -2.94 2.17 0.02 6.00 0.08 -1.26 -4.11 117.98 117.94 3h73 s PHE 528 Ca 0.15 -0.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 3h73 s PHE 528 Cb 0.19 -1.29 0.01 0.00 -0.57 0.00 0.00 43.02 41.36 3h73 s PHE 528 CO 0.58 0.13 0.22 -0.98 -0.10 0.00 0.00 175.22 175.07 3h73 s ARG 529 N -1.27 0.66 0.93 0.44 1.70 -0.89 -4.16 118.95 116.36 3h73 s ARG 529 Ca 0.11 -0.47 -0.14 0.00 -0.47 0.00 0.00 55.73 54.75 3h73 s ARG 529 Cb -0.10 0.28 0.16 0.00 -0.57 0.00 0.00 34.95 34.72 3h73 s ARG 529 CO 0.02 -0.19 1.21 0.96 -1.08 0.00 0.00 175.30 176.23 3h73 s ILE 530 N -2.05 1.96 0.35 4.99 -4.36 -0.21 -0.33 121.20 121.55 3h73 s ILE 530 Ca -0.09 0.00 -0.28 0.00 -0.26 0.00 0.00 60.65 60.02 3h73 s ILE 530 Cb -0.03 -2.88 -0.11 0.00 1.25 0.00 0.00 42.46 40.69 3h73 s ILE 530 CO -0.01 0.00 1.38 0.00 0.24 0.00 0.00 174.94 176.56 3h73 s ALA 531 N -3.55 3.53 -0.63 2.27 0.00 -1.26 -4.78 121.76 117.35 3h73 s ALA 531 Ca 0.68 1.39 -0.27 0.00 0.00 0.00 0.00 51.96 53.75 3h73 s ALA 531 Cb -0.09 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.51 3h73 s ALA 531 CO 0.52 -0.81 1.43 0.15 0.00 0.00 0.00 175.76 177.05 3h73 s LYS 532 N -1.88 3.16 0.26 0.00 1.02 -1.26 -4.87 119.74 116.17 3h73 s LYS 532 Ca 0.51 0.23 -0.10 0.00 0.02 0.00 0.00 55.97 56.63 3h73 s LYS 532 Cb -0.43 -4.18 0.04 0.00 -0.52 0.00 0.00 37.83 32.74 3h73 s LYS 532 CO 0.57 -2.13 0.52 -3.47 -0.92 0.00 0.00 175.35 169.92 3h73 n ASP 533 N 9.97 -1.51 -4.73 2.83 2.03 -1.26 -4.63 116.55 119.25 3h73 n ASP 533 Ca 0.10 -2.07 -0.36 0.00 0.52 0.00 0.00 54.79 52.98 3h73 n ASP 533 Cb 0.50 2.52 -0.07 0.00 -0.72 0.00 0.00 41.12 43.34 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 -2.38 6.41 0.28 1.67 0.15 -1.26 -4.36 113.70 114.21 3h73 s SER 534 Ca 0.11 0.48 0.08 0.00 0.70 0.00 0.00 55.95 57.32 3h73 s SER 534 Cb -0.03 -2.17 -0.06 0.00 -1.71 0.00 0.00 66.02 62.05 3h73 s SER 534 CO 0.08 0.12 -0.10 -0.31 1.20 0.00 0.00 173.24 174.23 3h73 s TYR 535 N 0.41 2.02 -0.13 3.44 1.51 0.15 -4.73 117.35 120.03 3h73 s TYR 535 Ca 0.16 -0.60 0.01 0.00 -1.01 0.00 0.00 57.07 55.62 3h73 s TYR 535 Cb -0.13 -1.09 0.02 0.00 -0.11 0.00 0.00 41.96 40.65 3h73 s TYR 535 CO 0.03 0.39 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.56 3h73 s LEU 536 N -3.46 1.64 0.30 -1.29 2.96 -1.26 -1.10 118.68 116.48 3h73 s LEU 536 Ca 0.29 -0.44 0.09 0.00 -0.22 0.00 0.00 54.13 53.85 3h73 s LEU 536 Cb 0.02 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 3h73 s LEU 536 CO 0.12 -0.03 0.06 0.26 -1.32 0.00 0.00 176.35 175.44 3h73 s TRP 537 N 1.29 2.71 -0.07 5.38 0.52 0.12 -1.44 118.94 127.45 3h73 s TRP 537 Ca -0.00 -0.29 -0.05 0.00 0.02 0.00 0.00 56.10 55.78 3h73 s TRP 537 Cb -0.14 -1.38 0.03 0.00 -1.15 0.00 0.00 33.47 30.82 3h73 s TRP 537 CO -0.06 0.51 0.18 1.41 0.02 0.00 0.00 176.95 179.00 3h73 s MET 538 N -3.75 0.18 0.08 4.98 -2.45 0.85 -1.67 119.30 117.53 3h73 s MET 538 Ca 0.34 0.31 0.06 0.00 -1.25 0.00 0.00 55.69 55.14 3h73 s MET 538 Cb -0.05 0.01 -0.03 0.00 1.25 0.00 0.00 34.83 36.01 3h73 s MET 538 CO 0.21 -0.07 -0.15 -1.12 1.05 0.00 0.00 175.02 174.94 3h73 s SER 539 N 0.49 1.81 0.05 1.11 0.01 -0.52 -0.07 113.70 116.57 3h73 s SER 539 Ca -0.03 -0.65 -0.01 0.00 1.31 0.00 0.00 55.95 56.57 3h73 s SER 539 Cb -0.05 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 3h73 s SER 539 CO -0.02 -0.07 -0.02 -0.72 0.41 0.00 0.00 173.24 172.82 3h73 s TYR 540 N -1.37 0.44 -0.04 2.43 -0.85 -1.26 -1.05 117.35 115.65 3h73 s TYR 540 Ca 0.00 -0.93 0.03 0.00 -0.52 0.00 0.00 57.07 55.65 3h73 s TYR 540 Cb -0.09 -0.33 0.01 0.00 0.38 0.00 0.00 41.96 41.92 3h73 s TYR 540 CO 0.03 -0.35 -0.10 0.45 -1.52 0.00 0.00 175.55 174.05 3h73 s SER 541 N -2.61 1.42 0.00 -0.18 0.15 0.34 -1.47 113.70 111.34 3h73 s SER 541 Ca 0.02 -0.22 0.12 0.00 0.70 0.00 0.00 55.95 56.57 3h73 s SER 541 Cb 0.04 -0.46 0.32 0.00 -1.71 0.00 0.00 66.02 64.21 3h73 s SER 541 CO -0.08 0.06 1.26 0.47 1.20 0.00 0.00 173.24 176.15 3h73 n ASP 542 N 3.44 2.97 -2.38 5.45 8.00 -1.26 -0.91 116.55 131.85 3h73 n ASP 542 Ca -0.20 -1.97 -0.20 0.00 0.71 0.00 0.00 54.79 53.14 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 0.63 3.91 -2.45 -2.24 5.68 -1.26 -4.95 116.55 115.86 3h73 n ASP 543 Ca 0.13 -3.35 -0.21 0.00 -0.50 0.00 0.00 54.79 50.86 3h73 n ASP 543 Cb 0.44 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 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 -0.53 -5.82 0.00 -1.12 2.03 -1.26 -2.80 116.55 107.05 3h73 n ASP 544 Ca 0.32 -0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.55 3h73 n ASP 544 Cb 0.82 -4.79 0.00 0.00 -0.72 0.00 0.00 41.12 36.43 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 -1.14 0.80 0.21 0.27 0.00 -1.26 -4.97 105.19 99.10 3h73 n GLY 545 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.68 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 4.00 0.70 -5.14 1.61 1.57 -1.94 -3.45 116.57 113.92 3h73 h LYS 546 Ca 0.00 -0.40 -0.37 0.00 -1.87 0.00 0.00 60.65 58.01 3h73 h LYS 546 Cb 0.00 0.03 -0.20 0.00 0.08 0.00 0.00 32.23 32.14 3h73 h LYS 546 CO 0.00 1.02 -0.76 0.95 -0.57 0.00 0.00 179.45 180.09 3h73 s THR 547 N -4.26 1.01 0.10 -0.16 -4.23 -1.26 -5.03 115.64 101.81 3h73 s THR 547 Ca -0.12 -1.42 0.07 0.00 -1.18 0.00 0.00 61.69 59.03 3h73 s THR 547 Cb 0.08 -1.15 -0.03 0.00 1.34 0.00 0.00 72.50 72.74 3h73 s THR 547 CO 0.84 -0.37 -0.17 0.26 -0.54 0.00 0.00 174.62 174.64 3h73 s TRP 548 N -1.74 1.49 0.84 3.99 0.52 -1.26 -4.37 118.94 118.41 3h73 s TRP 548 Ca 0.00 -0.46 -0.12 0.00 0.02 0.00 0.00 56.10 55.54 3h73 s TRP 548 Cb -0.07 -0.81 0.10 0.00 -1.15 0.00 0.00 33.47 31.53 3h73 s TRP 548 CO 0.01 0.14 1.12 -1.54 0.02 0.00 0.00 176.95 176.71 3h73 s SER 549 N -1.97 4.12 0.45 2.95 1.04 -0.55 -4.95 113.70 114.80 3h73 s SER 549 Ca 0.04 1.10 -0.23 0.00 0.48 0.00 0.00 55.95 57.33 3h73 s SER 549 Cb -0.09 -1.74 -0.08 0.00 0.10 0.00 0.00 66.02 64.21 3h73 s SER 549 CO 0.03 -2.18 1.16 0.00 0.98 0.00 0.00 173.24 173.23 3h73 s ALA 550 N -3.26 2.99 0.30 5.32 0.00 -1.26 -4.56 121.76 121.29 3h73 s ALA 550 Ca 0.62 0.92 -0.29 0.00 0.00 0.00 0.00 51.96 53.21 3h73 s ALA 550 Cb -0.14 -3.38 -0.13 0.00 0.00 0.00 0.00 23.12 19.47 3h73 s ALA 550 CO 0.53 -0.62 1.23 -2.30 0.00 0.00 0.00 175.76 174.61 3h73 n PRO 551 N -0.42 1.86 -4.93 0.00 -0.02 -1.26 -4.79 135.00 125.44 3h73 n PRO 551 Ca 0.07 0.66 -0.33 0.00 -2.02 0.00 0.00 63.50 61.88 3h73 n PRO 551 Cb 0.48 -2.19 -0.15 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.43 3.17 -0.57 -0.52 0.74 0.89 -4.91 119.66 117.03 3h73 s GLN 552 Ca 0.60 -0.75 -0.24 0.00 0.05 0.00 0.00 55.36 55.02 3h73 s GLN 552 Cb -0.63 -2.50 0.05 0.00 1.10 0.00 0.00 33.01 31.03 3h73 s GLN 552 CO 0.59 0.25 0.95 0.34 -0.55 0.00 0.00 175.29 176.87 3h73 s ASP 553 N 0.22 6.30 0.00 6.67 -1.08 -1.26 -0.10 116.67 127.42 3h73 s ASP 553 Ca -0.11 -0.47 0.25 0.00 -0.52 0.00 0.00 52.55 51.71 3h73 s ASP 553 Cb -0.16 -2.44 0.49 0.00 -1.46 0.00 0.00 42.92 39.35 3h73 s ASP 553 CO 0.06 -1.28 1.41 2.30 0.52 0.00 0.00 175.17 178.18 3h73 n ILE 554 N 6.15 0.00 -0.29 4.11 -5.35 -0.52 -4.55 119.36 118.91 3h73 n ILE 554 Ca 0.01 -0.29 0.04 0.00 -0.27 0.00 0.00 62.75 62.24 3h73 n ILE 554 Cb 0.47 0.94 0.12 0.00 -1.74 0.00 0.00 39.64 39.43 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 2.75 0.18 0.00 7.28 2.02 -1.85 -0.12 112.91 123.18 3h73 h THR 555 Ca 0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 3h73 h THR 555 Cb 0.70 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 3h73 h THR 555 CO 0.00 0.00 -0.00 1.55 0.37 0.00 0.00 175.52 177.44 3h73 h PRO 556 N 0.01 0.00 0.00 6.66 0.13 -1.89 0.58 132.00 137.50 3h73 h PRO 556 Ca 0.41 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.49 3h73 h PRO 556 Cb 0.66 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 3h73 h PRO 556 CO -0.83 0.00 -0.25 0.52 -0.23 0.00 0.00 178.00 177.21 3h73 h MET 557 N 0.00 0.00 0.00 0.86 2.86 -1.33 -3.40 114.93 113.93 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 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 3h73 h MET 557 CO 0.00 0.25 -0.16 1.33 1.06 0.00 0.00 176.91 179.40 3h73 n VAL 558 N -3.18 0.00 -3.15 -2.22 0.24 -0.84 -4.49 118.33 104.71 3h73 n VAL 558 Ca 0.03 -0.14 -0.41 0.00 -2.04 0.00 0.00 64.34 61.77 3h73 n VAL 558 Cb 0.62 0.72 -0.07 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 -0.60 3.89 0.72 7.34 2.20 0.14 -4.65 119.74 128.77 3h73 s LYS 559 Ca 0.00 0.24 -0.11 0.00 -0.36 0.00 0.00 55.97 55.75 3h73 s LYS 559 Cb 0.00 -3.73 0.02 0.00 -1.51 0.00 0.00 37.83 32.62 3h73 s LYS 559 CO 0.00 -0.55 1.07 0.00 -0.36 0.00 0.00 175.35 175.51 3h73 s ALA 560 N 2.55 2.54 0.47 3.13 0.00 -1.26 -4.86 121.76 124.32 3h73 s ALA 560 Ca 0.24 0.12 0.21 0.00 0.00 0.00 0.00 51.96 52.53 3h73 s ALA 560 Cb -0.15 -3.20 1.28 0.00 0.00 0.00 0.00 23.12 21.05 3h73 s ALA 560 CO 0.12 -1.40 2.07 -0.44 0.00 0.00 0.00 175.76 176.11 3h73 h ASP 561 N -0.85 0.00 1.61 0.00 3.32 -2.01 -2.52 116.42 115.97 3h73 h ASP 561 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 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 0.55 0.12 -0.33 4.11 -1.72 0.00 0.00 179.24 181.97 3h73 h TRP 562 N 0.00 0.00 -3.21 4.55 5.08 -1.99 -3.46 115.95 116.92 3h73 h TRP 562 Ca -0.00 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.44 3h73 h TRP 562 Cb 0.25 0.00 0.05 0.00 -3.00 0.00 0.00 29.16 26.46 3h73 h TRP 562 CO 0.00 0.00 0.78 -1.64 -1.28 0.00 0.00 178.44 176.30 3h73 s MET 563 N -3.25 4.26 0.00 0.12 -1.94 -0.95 -4.34 119.30 113.20 3h73 s MET 563 Ca 0.05 2.29 0.00 0.00 -1.71 0.00 0.00 55.69 56.32 3h73 s MET 563 Cb 0.07 -3.14 0.00 0.00 2.01 0.00 0.00 34.83 33.78 3h73 s MET 563 CO 0.70 -0.46 0.00 1.17 -0.01 0.00 0.00 175.02 176.42 3h73 n LYS 564 N 2.90 0.00 -3.33 2.03 4.81 -0.44 -4.94 118.16 119.18 3h73 n LYS 564 Ca 0.09 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.15 3h73 n LYS 564 Cb 0.40 -0.16 -0.06 0.00 0.02 0.00 0.00 35.03 35.23 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 3.73 -0.20 5.64 5.36 -1.22 -4.35 117.98 126.94 3h73 s PHE 565 Ca 0.00 1.17 -0.04 0.00 -0.96 0.00 0.00 56.93 57.10 3h73 s PHE 565 Cb 0.00 -2.43 0.09 0.00 -0.34 0.00 0.00 43.02 40.34 3h73 s PHE 565 CO 0.00 0.55 0.19 -1.17 -1.46 0.00 0.00 175.22 173.32 3h73 s LEU 566 N -1.38 0.03 0.15 6.12 2.96 -1.26 -1.85 118.68 123.45 3h73 s LEU 566 Ca 0.31 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.85 3h73 s LEU 566 Cb -0.18 0.20 -0.04 0.00 0.50 0.00 0.00 46.19 46.67 3h73 s LEU 566 CO 0.18 -0.34 0.08 -0.83 -1.32 0.00 0.00 176.35 174.12 3h73 s GLY 567 N 2.27 1.15 0.61 7.98 0.00 -0.69 -4.57 107.32 114.07 3h73 s GLY 567 Ca 0.06 -1.55 -0.09 0.00 0.00 0.00 0.00 44.72 43.14 3h73 s GLY 567 CO -0.12 -1.38 0.97 -1.34 0.00 0.00 0.00 173.10 171.23 3h73 s VAL 568 N -4.07 4.19 -0.61 1.40 -7.23 -1.26 -0.76 120.40 112.05 3h73 s VAL 568 Ca 0.29 0.44 -0.16 0.00 -1.81 0.00 0.00 61.98 60.74 3h73 s VAL 568 Cb 0.07 -3.67 0.14 0.00 0.56 0.00 0.00 36.38 33.49 3h73 s VAL 568 CO 0.05 -0.80 0.59 -0.83 -0.31 0.00 0.00 175.10 173.80 3h73 s GLY 569 N -4.24 2.16 0.21 2.32 0.00 0.47 -4.71 107.32 103.53 3h73 s GLY 569 Ca 0.54 -2.66 -0.30 0.00 0.00 0.00 0.00 44.72 42.30 3h73 s GLY 569 CO 0.50 1.27 0.85 -1.55 0.00 0.00 0.00 173.10 174.16 3h73 n PRO 570 N 5.15 0.69 0.00 2.90 -0.04 -1.26 -4.60 135.00 137.84 3h73 n PRO 570 Ca -0.07 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 3h73 n PRO 570 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 1.69 0.47 3.09 0.55 0.00 -0.76 -4.91 105.19 105.30 3h73 n GLY 571 Ca 0.15 -1.25 -0.30 0.00 0.00 0.00 0.00 46.02 44.61 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 -3.67 1.69 0.87 2.61 2.01 -1.26 -1.34 115.64 116.54 3h73 s THR 572 Ca 0.00 -0.75 -0.15 0.00 0.31 0.00 0.00 61.69 61.10 3h73 s THR 572 Cb 0.00 -1.54 0.20 0.00 0.01 0.00 0.00 72.50 71.18 3h73 s THR 572 CO 0.00 0.48 1.12 0.61 -0.69 0.00 0.00 174.62 176.14 3h73 n GLY 573 N 4.27 -1.61 3.29 4.40 0.00 0.50 -4.78 105.19 111.26 3h73 n GLY 573 Ca -0.19 -1.68 -0.15 0.00 0.00 0.00 0.00 46.02 44.00 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 -3.40 0.43 -0.09 -0.61 -4.36 -1.03 -4.76 121.20 107.37 3h73 s ILE 574 Ca 0.64 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 59.06 3h73 s ILE 574 Cb -0.02 -2.61 0.01 0.00 1.25 0.00 0.00 42.46 41.09 3h73 s ILE 574 CO 0.46 -0.00 -0.17 -0.69 0.24 0.00 0.00 174.94 174.77 3h73 s VAL 575 N -3.85 1.58 0.27 8.37 1.01 -1.26 -0.48 120.40 126.04 3h73 s VAL 575 Ca 0.38 -0.72 -0.31 0.00 0.00 0.00 0.00 61.98 61.33 3h73 s VAL 575 Cb 0.08 -1.41 -0.11 0.00 0.00 0.00 0.00 36.38 34.93 3h73 s VAL 575 CO 0.13 0.45 1.63 -0.76 0.00 0.00 0.00 175.10 176.55 3h73 s LEU 576 N 0.67 4.35 0.06 3.92 1.43 0.05 -4.84 118.68 124.32 3h73 s LEU 576 Ca -0.13 2.92 0.19 0.00 -1.03 0.00 0.00 54.13 56.08 3h73 s LEU 576 Cb -0.16 -3.62 -0.15 0.00 0.03 0.00 0.00 46.19 42.29 3h73 s LEU 576 CO 0.03 -0.93 0.74 0.54 0.23 0.00 0.00 176.35 176.97 3h73 n ARG 577 N 2.68 0.63 -4.11 1.70 1.74 -1.26 -0.63 116.66 117.41 3h73 n ARG 577 Ca 0.10 0.10 -0.13 0.00 -0.77 0.00 0.00 57.85 57.15 3h73 n ARG 577 Cb 0.37 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.01 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 -5.43 0.62 0.00 0.55 2.20 -1.26 -4.87 114.94 106.75 3h73 s ASN 578 Ca -0.04 -1.37 0.00 0.00 -0.94 0.00 0.00 52.86 50.51 3h73 s ASN 578 Cb 0.10 0.58 0.00 0.00 -2.00 0.00 0.00 41.25 39.92 3h73 s ASN 578 CO 0.82 -1.15 0.00 0.61 -2.94 0.00 0.00 177.10 174.45 3h73 n GLY 579 N -0.47 -0.60 0.15 0.45 0.00 -1.26 -3.66 105.19 99.80 3h73 n GLY 579 Ca 0.01 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.39 3h73 n GLY 579 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h73 n PRO 580 N -0.63 0.14 -0.38 1.61 -0.02 -1.26 -1.80 135.00 132.67 3h73 n PRO 580 Ca 0.00 0.60 0.08 0.00 -2.02 0.00 0.00 63.50 62.16 3h73 n PRO 580 Cb 0.00 -1.93 0.22 0.00 -0.02 0.00 0.00 33.50 31.77 3h73 n PRO 580 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3h73 n HIS 581 N -2.22 0.67 -1.63 6.00 8.25 -1.26 -5.04 115.22 119.98 3h73 n HIS 581 Ca -0.01 -1.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.03 3h73 n HIS 581 Cb 0.06 -0.28 0.01 0.00 1.12 0.00 0.00 29.99 30.89 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 -0.86 1.49 0.00 -0.41 4.81 -0.74 -1.69 118.16 120.76 3h73 n LYS 582 Ca 0.21 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 3h73 n LYS 582 Cb 0.83 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.79 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 1.10 1.77 3.73 3.14 0.00 0.20 -4.95 105.19 110.20 3h73 n GLY 583 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.59 4.44 -0.14 1.61 3.52 -0.68 -4.71 118.95 122.40 3h73 s ARG 584 Ca 0.00 1.92 -0.19 0.00 -0.13 0.00 0.00 55.73 57.33 3h73 s ARG 584 Cb 0.00 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 3h73 s ARG 584 CO 0.00 -0.18 0.51 0.42 -0.81 0.00 0.00 175.30 175.24 3h73 s ILE 585 N 0.24 5.15 -0.14 4.11 1.01 -0.51 -0.77 121.20 130.29 3h73 s ILE 585 Ca 0.56 0.99 0.00 0.00 0.00 0.00 0.00 60.65 62.20 3h73 s ILE 585 Cb -0.33 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 3h73 s ILE 585 CO 0.35 0.27 -0.15 -0.76 0.00 0.00 0.00 174.94 174.66 3h73 s LEU 586 N 0.98 2.57 -0.19 2.97 1.43 0.36 -1.99 118.68 124.81 3h73 s LEU 586 Ca 0.26 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 3h73 s LEU 586 Cb -0.15 -1.57 0.03 0.00 0.03 0.00 0.00 46.19 44.52 3h73 s LEU 586 CO 0.10 0.14 -0.15 -0.63 0.23 0.00 0.00 176.35 176.04 3h73 s ILE 587 N 0.52 1.89 0.31 -0.59 -1.09 -0.59 -2.48 121.20 119.17 3h73 s ILE 587 Ca -0.10 -1.01 -0.29 0.00 -2.23 0.00 0.00 60.65 57.02 3h73 s ILE 587 Cb -0.16 -1.83 -0.10 0.00 -1.58 0.00 0.00 42.46 38.79 3h73 s ILE 587 CO 0.04 0.35 1.39 -2.84 -1.23 0.00 0.00 174.94 172.65 3h73 s PRO 588 N 1.32 4.28 0.24 2.79 0.02 -1.26 -1.47 135.00 140.92 3h73 s PRO 588 Ca 0.01 2.31 -0.07 0.00 0.02 0.00 0.00 61.00 63.27 3h73 s PRO 588 Cb -0.15 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.29 3h73 s PRO 588 CO -0.10 -0.33 0.34 0.14 -0.33 0.00 0.00 177.00 176.72 3h73 s VAL 589 N -0.72 0.00 0.05 3.83 -7.23 0.08 -0.39 120.40 116.02 3h73 s VAL 589 Ca 0.53 -1.67 -0.19 0.00 -1.81 0.00 0.00 61.98 58.84 3h73 s VAL 589 Cb -0.42 -2.37 0.04 0.00 0.56 0.00 0.00 36.38 34.19 3h73 s VAL 589 CO 0.51 0.00 0.44 -0.72 -0.31 0.00 0.00 175.10 175.02 3h73 s TYR 590 N -3.95 -0.30 0.34 2.82 -0.85 0.06 -1.48 117.35 113.99 3h73 s TYR 590 Ca 0.30 0.25 0.03 0.00 -0.52 0.00 0.00 57.07 57.14 3h73 s TYR 590 Cb 0.02 0.25 -0.05 0.00 0.38 0.00 0.00 41.96 42.56 3h73 s TYR 590 CO 0.12 -0.60 0.07 0.95 -1.52 0.00 0.00 175.55 174.57 3h73 s THR 591 N -2.59 1.02 0.10 -3.49 -4.23 -0.61 -1.70 115.64 104.14 3h73 s THR 591 Ca -0.05 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.49 3h73 s THR 591 Cb -0.01 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.10 3h73 s THR 591 CO -0.03 0.00 -0.08 0.42 -0.54 0.00 0.00 174.62 174.39 3h73 s THR 592 N -3.32 0.77 0.52 3.99 -4.23 -0.77 -1.40 115.64 111.20 3h73 s THR 592 Ca 0.34 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 59.12 3h73 s THR 592 Cb 0.07 -1.48 0.02 0.00 1.34 0.00 0.00 72.50 72.45 3h73 s THR 592 CO 0.15 -0.73 0.26 0.54 -0.54 0.00 0.00 174.62 174.30 3h73 s ASN 593 N -2.73 4.46 0.00 3.99 2.20 -1.26 -1.33 114.94 120.27 3h73 s ASN 593 Ca 0.08 -1.37 0.28 0.00 -0.94 0.00 0.00 52.86 50.91 3h73 s ASN 593 Cb 0.01 0.39 0.98 0.00 -2.00 0.00 0.00 41.25 40.64 3h73 s ASN 593 CO -0.03 -0.99 1.74 0.59 -2.94 0.00 0.00 177.10 175.47 3h73 n ASN 594 N -1.57 0.27 0.02 3.54 3.02 -1.26 -1.62 115.26 117.67 3h73 n ASN 594 Ca -0.07 0.01 -0.08 0.00 -0.03 0.00 0.00 54.58 54.40 3h73 n ASN 594 Cb 0.65 -0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.61 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 0.12 0.70 0.00 2.41 2.07 -1.89 -3.42 116.25 116.24 3h73 h VAL 595 Ca 0.00 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.27 3h73 h VAL 595 Cb 0.47 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 3h73 h VAL 595 CO 0.00 0.21 0.00 -1.54 0.02 0.00 0.00 177.57 176.26 3h73 n SER 596 N -4.86 0.51 0.00 0.57 3.41 -1.26 -5.07 113.62 106.93 3h73 n SER 596 Ca -0.06 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.71 3h73 n SER 596 Cb 0.23 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 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 -0.16 0.00 0.81 7.33 -0.00 -0.64 -0.59 115.22 121.97 3h73 n HIS 597 Ca 0.00 0.00 0.10 0.00 0.46 0.00 0.00 57.72 58.28 3h73 n HIS 597 Cb 0.06 0.00 0.47 0.00 -0.12 0.00 0.00 29.99 30.40 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 0.00 0.09 0.27 4.77 -1.26 -2.21 117.00 118.66 3h73 n LEU 598 Ca 0.00 0.42 -0.15 0.00 -0.03 0.00 0.00 56.01 56.25 3h73 n LEU 598 Cb 0.00 -0.42 -0.14 0.00 -2.33 0.00 0.00 43.42 40.54 3h73 n LEU 598 CO 0.00 -0.13 -0.07 0.78 -1.33 0.00 0.00 177.39 176.65 3h73 h ASN 599 N 0.00 0.36 0.00 -1.43 2.35 -1.28 -3.44 115.58 112.14 3h73 h ASN 599 Ca 0.00 -0.40 -0.11 0.00 -0.55 0.00 0.00 56.30 55.25 3h73 h ASN 599 Cb 0.29 -0.12 -0.11 0.00 0.05 0.00 0.00 38.32 38.44 3h73 h ASN 599 CO 0.00 1.31 -0.23 0.61 -1.65 0.00 0.00 177.43 177.48 3h73 n GLY 600 N 1.53 0.49 0.00 2.83 0.00 -1.18 -4.23 105.19 104.62 3h73 n GLY 600 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.21 0.45 -4.67 1.61 3.41 -0.94 -1.34 113.62 111.92 3h73 n SER 601 Ca -0.21 -0.91 -0.45 0.00 -0.26 0.00 0.00 58.87 57.04 3h73 n SER 601 Cb 0.64 0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.61 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 -0.06 2.58 -3.91 4.33 6.02 -1.25 -4.42 117.38 120.67 3h73 n GLN 602 Ca 0.00 0.95 -0.21 0.00 -0.01 0.00 0.00 57.00 57.72 3h73 n GLN 602 Cb 0.11 -2.85 -0.17 0.00 1.02 0.00 0.00 30.24 28.35 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 4.14 1.21 0.51 1.08 0.01 -0.49 -1.16 113.70 119.00 3h73 s SER 603 Ca 0.90 -0.09 -0.18 0.00 1.31 0.00 0.00 55.95 57.89 3h73 s SER 603 Cb -0.55 -0.41 -0.07 0.00 0.21 0.00 0.00 66.02 65.21 3h73 s SER 603 CO 0.46 -0.14 1.01 -0.44 0.41 0.00 0.00 173.24 174.54 3h73 s SER 604 N 1.51 6.36 0.07 2.44 0.01 -0.49 -1.57 113.70 122.03 3h73 s SER 604 Ca -0.02 1.76 -0.19 0.00 1.31 0.00 0.00 55.95 58.81 3h73 s SER 604 Cb -0.13 -2.54 0.07 0.00 0.21 0.00 0.00 66.02 63.63 3h73 s SER 604 CO -0.03 -0.76 0.89 -2.11 0.41 0.00 0.00 173.24 171.63 3h73 n ARG 605 N -1.37 0.35 -4.30 12.44 1.85 -0.55 -1.96 116.66 123.13 3h73 n ARG 605 Ca 0.08 -0.92 -0.16 0.00 -1.00 0.00 0.00 57.85 55.85 3h73 n ARG 605 Cb 0.53 1.32 -0.10 0.00 -1.05 0.00 0.00 32.46 33.16 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 -2.12 1.19 0.20 8.89 -5.25 -1.26 -0.74 121.20 122.11 3h73 s ILE 606 Ca 0.20 -2.07 0.10 0.00 -0.99 0.00 0.00 60.65 57.90 3h73 s ILE 606 Cb -0.02 -2.09 -0.04 0.00 2.95 0.00 0.00 42.46 43.26 3h73 s ILE 606 CO 0.02 -0.55 -0.15 0.27 -1.79 0.00 0.00 174.94 172.74 3h73 s ILE 607 N -3.32 2.83 0.18 8.37 -4.36 -0.54 -1.00 121.20 123.35 3h73 s ILE 607 Ca 0.22 -1.91 -0.08 0.00 -0.26 0.00 0.00 60.65 58.62 3h73 s ILE 607 Cb 0.04 -2.41 -0.01 0.00 1.25 0.00 0.00 42.46 41.33 3h73 s ILE 607 CO 0.05 -0.17 0.29 -0.72 0.24 0.00 0.00 174.94 174.62 3h73 s TYR 608 N -1.85 0.47 -0.02 1.37 -0.85 0.78 -1.55 117.35 115.70 3h73 s TYR 608 Ca 0.25 -0.82 -0.00 0.00 -0.52 0.00 0.00 57.07 55.97 3h73 s TYR 608 Cb -0.08 -0.08 0.03 0.00 0.38 0.00 0.00 41.96 42.21 3h73 s TYR 608 CO 0.14 -0.74 0.03 0.45 -1.52 0.00 0.00 175.55 173.91 3h73 s SER 609 N -2.99 0.10 0.00 -0.18 0.15 -0.84 -0.85 113.70 109.08 3h73 s SER 609 Ca 0.20 0.05 0.16 0.00 0.70 0.00 0.00 55.95 57.06 3h73 s SER 609 Cb 0.03 -0.07 0.12 0.00 -1.71 0.00 0.00 66.02 64.40 3h73 s SER 609 CO 0.02 -0.13 1.00 0.47 1.20 0.00 0.00 173.24 175.80 3h73 n ASP 610 N 4.23 2.29 -2.08 5.45 8.00 -1.26 -1.43 116.55 131.75 3h73 n ASP 610 Ca -0.27 -1.65 -0.25 0.00 0.71 0.00 0.00 54.79 53.33 3h73 n ASP 610 Cb 0.50 0.03 0.02 0.00 -0.02 0.00 0.00 41.12 41.66 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 0.84 5.13 -3.42 -2.24 5.68 -1.26 -4.94 116.55 116.33 3h73 n ASP 611 Ca 0.09 -3.75 -0.24 0.00 -0.50 0.00 0.00 54.79 50.39 3h73 n ASP 611 Cb 0.40 -0.40 0.06 0.00 -1.14 0.00 0.00 41.12 40.04 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 -0.71 -2.58 -0.53 2.11 8.25 -1.26 -2.79 115.22 117.71 3h73 n HIS 612 Ca 0.45 0.85 0.00 0.00 -0.26 0.00 0.00 57.72 58.77 3h73 n HIS 612 Cb 0.92 -4.84 0.00 0.00 1.12 0.00 0.00 29.99 27.19 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 -1.85 0.84 0.05 -1.41 0.00 -1.26 -4.95 105.19 96.61 3h73 n GLY 613 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 3h73 n GLY 613 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3h73 h LYS 614 N 3.81 -0.00 -5.21 1.61 3.64 -1.93 -3.45 116.57 115.03 3h73 h LYS 614 Ca 0.00 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.00 3h73 h LYS 614 Cb 0.00 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 31.62 3h73 h LYS 614 CO 0.00 0.23 -0.76 0.95 -2.27 0.00 0.00 179.45 177.60 3h73 s THR 615 N -5.27 1.08 0.16 1.00 -4.23 -1.26 -5.11 115.64 102.01 3h73 s THR 615 Ca -0.14 -1.47 0.10 0.00 -1.18 0.00 0.00 61.69 58.99 3h73 s THR 615 Cb 0.04 -1.22 -0.04 0.00 1.34 0.00 0.00 72.50 72.62 3h73 s THR 615 CO 0.67 -0.37 -0.22 0.26 -0.54 0.00 0.00 174.62 174.42 3h73 s TRP 616 N -1.78 2.06 0.02 3.99 0.52 -1.26 -4.42 118.94 118.06 3h73 s TRP 616 Ca 0.02 -0.41 0.00 0.00 0.02 0.00 0.00 56.10 55.74 3h73 s TRP 616 Cb -0.07 -1.05 -0.01 0.00 -1.15 0.00 0.00 33.47 31.18 3h73 s TRP 616 CO 0.02 0.37 -0.03 -1.01 0.02 0.00 0.00 176.95 176.32 3h73 s HIS 617 N -1.60 0.26 0.00 -1.98 3.76 -0.03 -4.56 115.29 111.14 3h73 s HIS 617 Ca 0.16 -0.38 -0.17 0.00 -0.15 0.00 0.00 55.06 54.51 3h73 s HIS 617 Cb -0.08 -0.18 -0.06 0.00 1.11 0.00 0.00 32.58 33.38 3h73 s HIS 617 CO 0.07 -0.12 0.49 0.00 -0.85 0.00 0.00 174.74 174.33 3h73 s ALA 618 N -1.03 3.60 0.75 -1.40 0.00 -1.26 -0.16 121.76 122.26 3h73 s ALA 618 Ca -0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.71 3h73 s ALA 618 Cb -0.07 -2.55 0.11 0.00 0.00 0.00 0.00 23.12 20.61 3h73 s ALA 618 CO -0.01 0.34 0.71 0.41 0.00 0.00 0.00 175.76 177.21 3h73 n GLY 619 N 2.12 -0.05 3.90 0.00 0.00 -0.17 -4.96 105.19 106.02 3h73 n GLY 619 Ca -0.11 -1.89 -0.29 0.00 0.00 0.00 0.00 46.02 43.73 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 -4.37 3.67 0.46 1.61 2.02 0.11 -4.77 118.70 117.44 3h73 s GLU 620 Ca 0.44 0.17 -0.21 0.00 0.02 0.00 0.00 54.97 55.39 3h73 s GLU 620 Cb -0.02 -2.54 -0.09 0.00 0.10 0.00 0.00 34.13 31.58 3h73 s GLU 620 CO 0.30 0.10 1.03 0.00 0.02 0.00 0.00 175.26 176.71 3h73 s ALA 621 N -2.23 2.93 0.32 5.21 0.00 -1.26 -4.60 121.76 122.14 3h73 s ALA 621 Ca 0.47 0.60 0.02 0.00 0.00 0.00 0.00 51.96 53.04 3h73 s ALA 621 Cb -0.10 -3.24 0.59 0.00 0.00 0.00 0.00 23.12 20.37 3h73 s ALA 621 CO 0.31 -0.23 1.93 0.28 0.00 0.00 0.00 175.76 178.06 3h73 h VAL 622 N 1.72 1.07 0.00 0.00 2.07 -1.75 -1.61 116.25 117.75 3h73 h VAL 622 Ca -0.49 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.70 3h73 h VAL 622 Cb 1.21 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 3h73 h VAL 622 CO 0.60 0.17 0.00 0.59 0.02 0.00 0.00 177.57 178.95 3h73 n ASN 623 N -4.48 0.00 -4.64 0.57 5.03 -1.26 -4.58 115.26 105.90 3h73 n ASN 623 Ca 0.12 0.17 -0.43 0.00 0.87 0.00 0.00 54.58 55.32 3h73 n ASN 623 Cb 0.19 -0.37 -0.02 0.00 -1.02 0.00 0.00 39.78 38.56 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 -2.74 6.59 -1.22 6.41 1.01 -0.61 -2.27 116.67 123.85 3h73 s ASP 624 Ca 0.17 1.67 0.00 0.00 0.71 0.00 0.00 52.55 55.10 3h73 s ASP 624 Cb 0.15 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.54 3h73 s ASP 624 CO 0.36 -1.07 0.00 -3.20 0.21 0.00 0.00 175.17 171.47 3h73 n ASN 625 N 7.72 -4.27 -4.75 0.27 5.15 0.59 -4.95 115.26 115.03 3h73 n ASN 625 Ca 0.17 0.14 -0.40 0.00 -0.60 0.00 0.00 54.58 53.89 3h73 n ASN 625 Cb 0.45 -3.20 -0.06 0.00 -0.53 0.00 0.00 39.78 36.44 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 -3.91 4.81 -0.30 1.20 3.52 -0.96 -4.74 118.95 118.57 3h73 s ARG 626 Ca 0.00 1.51 -0.22 0.00 -0.13 0.00 0.00 55.73 56.89 3h73 s ARG 626 Cb 0.00 -3.23 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 3h73 s ARG 626 CO 0.00 0.47 0.71 -0.65 -0.81 0.00 0.00 175.30 175.01 3h73 s GLN 627 N -1.28 3.95 -0.23 5.12 -1.52 -1.26 -1.31 119.66 123.14 3h73 s GLN 627 Ca 0.42 0.47 -0.01 0.00 -1.95 0.00 0.00 55.36 54.29 3h73 s GLN 627 Cb -0.26 -3.72 0.06 0.00 -0.22 0.00 0.00 33.01 28.88 3h73 s GLN 627 CO 0.32 -0.60 -0.00 0.08 -0.25 0.00 0.00 175.29 174.84 3h73 s VAL 628 N 2.76 1.09 -1.08 1.09 1.01 -0.07 -4.81 120.40 120.40 3h73 s VAL 628 Ca 0.29 -1.00 -0.05 0.00 0.00 0.00 0.00 61.98 61.21 3h73 s VAL 628 Cb -0.15 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.74 3h73 s VAL 628 CO 0.12 -0.21 0.93 0.47 0.00 0.00 0.00 175.10 176.41 3h73 n ASP 629 N 4.83 -4.64 0.00 3.32 8.00 -1.26 -2.86 116.55 123.94 3h73 n ASP 629 Ca -0.10 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 54.95 3h73 n ASP 629 Cb 0.45 -4.24 0.00 0.00 -0.02 0.00 0.00 41.12 37.31 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 -1.57 0.89 3.02 0.44 0.00 -1.26 -5.02 105.19 101.70 3h73 n GLY 630 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 3h73 n GLY 630 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3h73 s GLN 631 N -0.02 0.48 0.26 1.61 0.74 -1.14 -5.12 119.66 116.47 3h73 s GLN 631 Ca 0.00 -0.57 -0.30 0.00 0.05 0.00 0.00 55.36 54.55 3h73 s GLN 631 Cb 0.00 -0.30 -0.09 0.00 1.10 0.00 0.00 33.01 33.71 3h73 s GLN 631 CO 0.00 0.06 0.97 0.15 -0.55 0.00 0.00 175.29 175.93 3h73 s LYS 632 N -1.11 4.79 0.37 1.67 -0.14 -1.26 -0.89 119.74 123.17 3h73 s LYS 632 Ca -0.06 1.54 0.05 0.00 -1.36 0.00 0.00 55.97 56.14 3h73 s LYS 632 Cb -0.07 -3.22 -0.07 0.00 -1.68 0.00 0.00 37.83 32.79 3h73 s LYS 632 CO 0.00 0.44 0.04 0.96 -0.76 0.00 0.00 175.35 176.02 3h73 s ILE 633 N -1.21 1.54 0.01 2.17 -4.36 -0.43 -4.95 121.20 113.98 3h73 s ILE 633 Ca 0.42 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.81 3h73 s ILE 633 Cb -0.27 -2.85 -0.01 0.00 1.25 0.00 0.00 42.46 40.58 3h73 s ILE 633 CO 0.33 0.00 -0.01 -2.28 0.24 0.00 0.00 174.94 173.22 3h73 s HIS 634 N -3.01 0.09 0.60 1.37 2.46 -1.25 -0.30 115.29 115.24 3h73 s HIS 634 Ca 0.34 -0.18 0.30 0.00 0.47 0.00 0.00 55.06 55.99 3h73 s HIS 634 Cb 0.09 -0.07 1.77 0.00 -0.13 0.00 0.00 32.58 34.25 3h73 s HIS 634 CO 0.16 -0.07 2.18 0.66 -2.47 0.00 0.00 174.74 175.20 3h73 h SER 635 N 5.61 0.00 1.50 9.88 4.64 -1.94 0.15 113.55 133.39 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 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3h73 h SER 635 CO 0.47 0.00 -0.19 0.77 -0.87 0.00 0.00 176.83 177.01 3h73 h SER 636 N 0.00 0.00 0.00 4.97 4.64 -1.95 -3.38 113.55 117.82 3h73 h SER 636 Ca 0.04 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3h73 h SER 636 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3h73 h SER 636 CO -0.00 0.02 0.00 0.35 -0.87 0.00 0.00 176.83 176.33 3h73 n THR 637 N -2.54 0.00 -1.64 2.95 -2.24 -0.74 -4.59 114.28 105.47 3h73 n THR 637 Ca 0.04 -0.33 -0.35 0.00 -2.27 0.00 0.00 64.05 61.14 3h73 n THR 637 Cb 0.47 1.07 0.07 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 -0.53 2.44 -0.45 -0.78 0.00 -0.03 -4.90 119.30 115.05 3h73 s MET 638 Ca 0.00 1.82 0.06 0.00 0.00 0.00 0.00 55.69 57.57 3h73 s MET 638 Cb 0.00 -1.86 0.22 0.00 0.00 0.00 0.00 34.83 33.19 3h73 s MET 638 CO 0.00 -1.62 0.63 -1.71 0.00 0.00 0.00 175.02 172.32 3h73 n ASN 639 N -2.29 -1.49 -3.44 -1.18 2.85 -1.21 -4.28 115.26 104.23 3h73 n ASN 639 Ca 0.14 -2.85 -0.18 0.00 -0.11 0.00 0.00 54.58 51.57 3h73 n ASN 639 Cb 0.50 0.52 -0.11 0.00 1.24 0.00 0.00 39.78 41.93 3h73 n ASN 639 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 3h73 s ASN 640 N -0.76 1.67 0.16 1.20 3.84 -0.45 -4.97 114.94 115.62 3h73 s ASN 640 Ca 0.33 -0.57 -0.22 0.00 0.21 0.00 0.00 52.86 52.61 3h73 s ASN 640 Cb 0.14 0.42 0.05 0.00 -0.55 0.00 0.00 41.25 41.30 3h73 s ASN 640 CO -0.16 -0.37 1.62 -0.09 -2.79 0.00 0.00 177.10 175.31 3h73 h ARG 641 N 8.29 -0.23 0.00 0.43 2.43 -1.77 -2.39 114.38 121.14 3h73 h ARG 641 Ca -0.15 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 3h73 h ARG 641 Cb 1.10 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3h73 h ARG 641 CO 0.32 -0.15 -0.05 -0.09 -1.51 0.00 0.00 179.97 178.49 3h73 h ARG 642 N -0.24 0.00 -0.01 0.20 2.43 -1.92 -2.54 114.38 112.31 3h73 h ARG 642 Ca 0.15 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3h73 h ARG 642 Cb 0.48 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3h73 h ARG 642 CO -0.44 0.05 -0.06 0.00 -1.51 0.00 0.00 179.97 178.01 3h73 n ALA 643 N -2.13 2.71 -1.47 2.80 0.00 -0.91 -4.70 120.51 116.80 3h73 n ALA 643 Ca -0.00 -0.29 -0.33 0.00 0.00 0.00 0.00 53.44 52.83 3h73 n ALA 643 Cb 0.29 -1.34 0.05 0.00 0.00 0.00 0.00 19.45 18.44 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 -2.27 2.73 -0.15 0.00 -0.21 -0.96 -4.96 119.66 113.83 3h73 s GLN 644 Ca 0.35 1.33 -0.08 0.00 0.02 0.00 0.00 55.36 56.97 3h73 s GLN 644 Cb 0.21 -1.95 0.06 0.00 1.00 0.00 0.00 33.01 32.33 3h73 s GLN 644 CO 0.42 -1.30 0.37 0.54 -2.12 0.00 0.00 175.29 173.21 3h73 s ASN 645 N -2.78 -0.46 0.00 5.90 2.20 -0.31 -4.56 114.94 114.94 3h73 s ASN 645 Ca 0.65 0.81 0.00 0.00 -0.94 0.00 0.00 52.86 53.38 3h73 s ASN 645 Cb -0.19 0.69 0.00 0.00 -2.00 0.00 0.00 41.25 39.74 3h73 s ASN 645 CO 0.44 -0.19 0.00 0.35 -2.94 0.00 0.00 177.10 174.77 3h73 n THR 646 N 4.26 0.00 -1.95 0.54 -2.24 -0.28 -1.40 114.28 113.21 3h73 n THR 646 Ca -0.24 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.17 3h73 n THR 646 Cb 0.55 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.81 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 2.10 3.08 0.23 -0.78 2.02 -1.26 -4.26 118.70 119.83 3h73 s GLU 647 Ca 0.00 1.97 -0.12 0.00 0.02 0.00 0.00 54.97 56.84 3h73 s GLU 647 Cb 0.00 -2.08 -0.00 0.00 0.10 0.00 0.00 34.13 32.14 3h73 s GLU 647 CO 0.00 -1.16 0.43 -1.54 0.02 0.00 0.00 175.26 173.01 3h73 s SER 648 N -1.35 -0.07 -0.01 -0.19 1.04 -1.26 -0.55 113.70 111.31 3h73 s SER 648 Ca 0.75 -0.92 0.05 0.00 0.48 0.00 0.00 55.95 56.31 3h73 s SER 648 Cb -0.34 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 3h73 s SER 648 CO 0.38 -1.08 -0.15 0.28 0.98 0.00 0.00 173.24 173.65 3h73 s THR 649 N -4.01 1.22 -0.05 2.02 -1.32 -0.35 -4.71 115.64 108.44 3h73 s THR 649 Ca 0.22 -0.66 0.04 0.00 -1.21 0.00 0.00 61.69 60.08 3h73 s THR 649 Cb 0.00 -1.02 -0.02 0.00 -1.51 0.00 0.00 72.50 69.95 3h73 s THR 649 CO 0.07 0.35 -0.15 0.54 -2.21 0.00 0.00 174.62 173.21 3h73 s VAL 650 N -0.33 2.97 -0.02 5.08 0.11 -1.26 -1.19 120.40 125.77 3h73 s VAL 650 Ca 0.05 -0.76 -0.02 0.00 -2.93 0.00 0.00 61.98 58.33 3h73 s VAL 650 Cb -0.06 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.63 3h73 s VAL 650 CO -0.00 0.59 0.05 -0.69 -3.33 0.00 0.00 175.10 171.71 3h73 s VAL 651 N -0.67 0.01 -0.11 2.04 1.01 -0.55 -4.76 120.40 117.36 3h73 s VAL 651 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 3h73 s VAL 651 Cb -0.11 -0.09 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 3h73 s VAL 651 CO 0.01 -0.03 0.03 -1.58 0.00 0.00 0.00 175.10 173.52 3h73 s GLN 652 N -0.08 3.27 0.49 2.72 0.74 -1.26 -0.21 119.66 125.33 3h73 s GLN 652 Ca -0.01 -0.36 -0.01 0.00 0.05 0.00 0.00 55.36 55.03 3h73 s GLN 652 Cb -0.01 -2.93 0.01 0.00 1.10 0.00 0.00 33.01 31.17 3h73 s GLN 652 CO 0.00 0.61 0.73 -0.51 -0.55 0.00 0.00 175.29 175.57 3h73 s LEU 653 N -0.62 3.51 0.51 3.68 1.43 0.75 -4.87 118.68 123.06 3h73 s LEU 653 Ca 0.11 0.30 0.33 0.00 -1.03 0.00 0.00 54.13 53.84 3h73 s LEU 653 Cb -0.12 -3.17 1.53 0.00 0.03 0.00 0.00 46.19 44.46 3h73 s LEU 653 CO 0.02 -0.84 2.00 0.78 0.23 0.00 0.00 176.35 178.54 3h73 h ASN 654 N 0.25 0.00 -0.10 2.29 2.35 -1.94 -1.94 115.58 116.49 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 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 3h73 h ASN 654 CO 0.57 0.00 0.00 -0.46 -1.65 0.00 0.00 177.43 175.89 3h73 n ASN 655 N -2.87 0.89 0.00 5.81 2.04 -1.26 -4.89 115.26 114.98 3h73 n ASN 655 Ca -0.00 -1.65 0.00 0.00 -0.44 0.00 0.00 54.58 52.49 3h73 n ASN 655 Cb 0.22 -0.07 0.00 0.00 -2.53 0.00 0.00 39.78 37.40 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 0.93 2.45 3.77 4.83 0.00 -0.73 -5.04 105.19 111.41 3h73 n GLY 656 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.54 5.92 -0.16 1.61 1.01 -1.26 -4.75 116.67 117.51 3h73 s ASP 657 Ca 0.00 2.22 -0.03 0.00 0.71 0.00 0.00 52.55 55.45 3h73 s ASP 657 Cb 0.00 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.32 3h73 s ASP 657 CO 0.00 -1.09 -0.05 -0.69 0.21 0.00 0.00 175.17 173.55 3h73 s VAL 658 N -1.68 3.76 -0.10 -1.27 1.01 -0.01 -0.18 120.40 121.93 3h73 s VAL 658 Ca 0.69 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 3h73 s VAL 658 Cb -0.26 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 3h73 s VAL 658 CO 0.30 0.49 -0.06 -0.54 0.00 0.00 0.00 175.10 175.29 3h73 s LYS 659 N 0.42 3.11 -0.24 2.72 -0.14 0.71 -0.04 119.74 126.28 3h73 s LYS 659 Ca -0.05 -0.55 0.02 0.00 -1.36 0.00 0.00 55.97 54.03 3h73 s LYS 659 Cb -0.14 -2.70 0.05 0.00 -1.68 0.00 0.00 37.83 33.36 3h73 s LYS 659 CO 0.03 0.49 -0.09 -1.17 -0.76 0.00 0.00 175.35 173.85 3h73 s LEU 660 N -0.34 2.89 -0.28 3.17 2.96 0.01 -1.49 118.68 125.61 3h73 s LEU 660 Ca 0.05 -1.20 -0.19 0.00 -0.22 0.00 0.00 54.13 52.57 3h73 s LEU 660 Cb -0.12 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.18 3h73 s LEU 660 CO 0.02 -0.19 0.59 -0.36 -1.32 0.00 0.00 176.35 175.09 3h73 s PHE 661 N 1.26 3.25 -0.12 5.38 0.40 -0.33 -1.11 117.98 126.71 3h73 s PHE 661 Ca -0.06 0.66 -0.00 0.00 -0.60 0.00 0.00 56.93 56.92 3h73 s PHE 661 Cb -0.19 -2.85 -0.02 0.00 0.51 0.00 0.00 43.02 40.47 3h73 s PHE 661 CO -0.06 -0.37 -0.11 -1.64 0.70 0.00 0.00 175.22 173.74 3h73 s MET 662 N 2.47 3.31 0.11 0.44 -1.94 -0.43 -1.22 119.30 122.04 3h73 s MET 662 Ca 0.24 -0.65 -0.31 0.00 -1.71 0.00 0.00 55.69 53.26 3h73 s MET 662 Cb -0.15 -2.66 -0.08 0.00 2.01 0.00 0.00 34.83 33.95 3h73 s MET 662 CO 0.10 0.29 1.48 0.50 -0.01 0.00 0.00 175.02 177.38 3h73 s ARG 663 N 0.17 4.27 0.00 2.03 3.52 0.29 -4.12 118.95 125.11 3h73 s ARG 663 Ca -0.06 2.18 0.00 0.00 -0.13 0.00 0.00 55.73 57.72 3h73 s ARG 663 Cb -0.15 -3.32 0.00 0.00 -1.56 0.00 0.00 34.95 29.92 3h73 s ARG 663 CO 0.04 -0.55 0.00 0.41 -0.81 0.00 0.00 175.30 174.40 3h73 n GLY 664 N 3.66 3.52 0.81 8.12 0.00 -1.26 -1.13 105.19 118.91 3h73 n GLY 664 Ca 0.13 -1.34 0.03 0.00 0.00 0.00 0.00 46.02 44.84 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 3.54 0.01 0.99 4.77 -1.26 -4.10 117.00 120.95 3h73 n LEU 665 Ca 0.00 -3.46 0.11 0.00 -0.03 0.00 0.00 56.01 52.63 3h73 n LEU 665 Cb 0.00 -0.56 0.13 0.00 -2.33 0.00 0.00 43.42 40.66 3h73 n LEU 665 CO 0.00 1.02 0.26 0.35 -1.33 0.00 0.00 177.39 177.69 3h73 n THR 666 N -1.01 0.06 -0.05 -5.08 -2.24 -1.26 -4.95 114.28 99.75 3h73 n THR 666 Ca 0.25 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3h73 n THR 666 Cb 0.88 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 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 1.46 1.38 3.26 3.38 0.00 -1.25 -5.01 105.19 108.40 3h73 n GLY 667 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.97 0.91 -0.07 1.61 1.47 -1.26 -1.72 116.67 114.64 3h73 s ASP 668 Ca 0.00 -1.53 -0.30 0.00 1.18 0.00 0.00 52.55 51.91 3h73 s ASP 668 Cb 0.00 0.42 -0.05 0.00 -0.34 0.00 0.00 42.92 42.95 3h73 s ASP 668 CO 0.00 -0.91 1.57 -0.22 0.68 0.00 0.00 175.17 176.29 3h73 s LEU 669 N -3.27 4.30 -0.15 2.11 2.96 -0.13 -4.54 118.68 119.95 3h73 s LEU 669 Ca 0.39 2.13 -0.05 0.00 -0.22 0.00 0.00 54.13 56.38 3h73 s LEU 669 Cb 0.05 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.17 3h73 s LEU 669 CO 0.18 -0.88 0.03 -1.10 -1.32 0.00 0.00 176.35 173.26 3h73 s GLN 670 N 3.81 3.66 -0.04 1.98 -0.21 -1.26 -0.84 119.66 126.76 3h73 s GLN 670 Ca 0.69 -0.38 0.01 0.00 0.02 0.00 0.00 55.36 55.70 3h73 s GLN 670 Cb -0.31 -3.06 0.02 0.00 1.00 0.00 0.00 33.01 30.67 3h73 s GLN 670 CO 0.27 0.40 -0.03 0.08 -2.12 0.00 0.00 175.29 173.89 3h73 s VAL 671 N -0.02 0.41 0.21 1.09 1.01 0.02 -1.32 120.40 121.79 3h73 s VAL 671 Ca 0.05 -0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.05 3h73 s VAL 671 Cb -0.12 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 3h73 s VAL 671 CO 0.01 0.20 0.22 0.00 0.00 0.00 0.00 175.10 175.54 3h73 s ALA 672 N 1.07 3.69 -0.05 5.51 0.00 -0.26 -2.14 121.76 129.58 3h73 s ALA 672 Ca -0.09 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.63 3h73 s ALA 672 Cb -0.14 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.53 3h73 s ALA 672 CO -0.01 0.37 -0.13 0.99 0.00 0.00 0.00 175.76 176.98 3h73 s THR 673 N -1.93 1.14 -0.10 0.00 2.01 -1.26 -0.81 115.64 114.69 3h73 s THR 673 Ca 0.33 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.83 3h73 s THR 673 Cb -0.09 -1.02 -0.01 0.00 0.01 0.00 0.00 72.50 71.39 3h73 s THR 673 CO 0.26 0.35 -0.16 -0.55 -0.69 0.00 0.00 174.62 173.82 3h73 s SER 674 N 0.42 3.76 0.00 3.53 0.15 0.94 -1.18 113.70 121.33 3h73 s SER 674 Ca -0.10 -0.36 0.19 0.00 0.70 0.00 0.00 55.95 56.39 3h73 s SER 674 Cb -0.13 -1.35 0.17 0.00 -1.71 0.00 0.00 66.02 63.00 3h73 s SER 674 CO 0.03 0.21 1.13 0.29 1.20 0.00 0.00 173.24 176.09 3h73 n LYS 675 N 3.23 1.74 -2.40 5.44 4.76 -1.26 -0.83 118.16 128.84 3h73 n LYS 675 Ca -0.18 -1.69 -0.16 0.00 -2.87 0.00 0.00 58.31 53.41 3h73 n LYS 675 Cb 0.53 -1.38 0.03 0.00 -1.84 0.00 0.00 35.03 32.37 3h73 n LYS 675 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3h73 n ASP 676 N 1.10 3.51 -0.37 4.39 5.68 -1.26 -4.96 116.55 124.65 3h73 n ASP 676 Ca 0.12 -3.11 -0.05 0.00 -0.50 0.00 0.00 54.79 51.25 3h73 n ASP 676 Cb 0.49 -0.42 -0.02 0.00 -1.14 0.00 0.00 41.12 40.03 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 -0.58 0.74 0.50 6.12 0.00 -1.26 -3.57 105.19 107.15 3h73 n GLY 677 Ca 0.28 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.22 0.78 0.07 -0.02 0.00 -1.26 -5.00 105.19 97.55 3h73 n GLY 678 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 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 1.18 -2.14 1.61 2.07 -1.92 -3.41 116.25 113.64 3h73 h VAL 679 Ca 0.00 -1.79 -0.59 0.00 0.82 0.00 0.00 66.70 65.14 3h73 h VAL 679 Cb 0.00 2.19 -0.12 0.00 -1.52 0.00 0.00 31.29 31.84 3h73 h VAL 679 CO 0.00 0.39 -0.69 0.42 0.02 0.00 0.00 177.57 177.70 3h73 s THR 680 N -2.25 2.82 -0.04 2.57 -4.23 -1.26 0.09 115.64 113.34 3h73 s THR 680 Ca -0.13 -2.15 0.05 0.00 -1.18 0.00 0.00 61.69 58.28 3h73 s THR 680 Cb -0.02 -2.59 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 3h73 s THR 680 CO 0.47 -0.35 -0.20 0.26 -0.54 0.00 0.00 174.62 174.27 3h73 s TRP 681 N -2.45 1.96 0.86 3.99 0.52 -1.26 -4.36 118.94 118.19 3h73 s TRP 681 Ca 0.31 -0.54 -0.12 0.00 0.02 0.00 0.00 56.10 55.78 3h73 s TRP 681 Cb -0.04 -1.30 0.11 0.00 -1.15 0.00 0.00 33.47 31.09 3h73 s TRP 681 CO 0.18 -0.16 1.17 -1.21 0.02 0.00 0.00 176.95 176.95 3h73 s GLU 682 N -0.12 1.36 0.39 4.98 0.41 -0.32 -4.93 118.70 120.46 3h73 s GLU 682 Ca -0.01 1.63 0.15 0.00 -0.41 0.00 0.00 54.97 56.33 3h73 s GLU 682 Cb -0.12 -1.76 0.79 0.00 -1.78 0.00 0.00 34.13 31.27 3h73 s GLU 682 CO 0.02 -2.39 1.83 1.57 -0.49 0.00 0.00 175.26 175.80 3h73 h LYS 683 N -1.38 0.00 -5.82 1.61 2.10 -1.97 -3.42 116.57 107.69 3h73 h LYS 683 Ca -0.45 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 57.61 3h73 h LYS 683 Cb 1.28 0.00 -0.12 0.00 -0.90 0.00 0.00 32.23 32.49 3h73 h LYS 683 CO 0.44 0.35 0.72 0.34 -2.00 0.00 0.00 179.45 179.30 3h73 s ASP 684 N -6.75 6.20 -0.55 7.07 2.15 -1.26 -4.91 116.67 118.63 3h73 s ASP 684 Ca -0.02 -0.69 -0.20 0.00 0.43 0.00 0.00 52.55 52.06 3h73 s ASP 684 Cb 0.14 -2.47 0.07 0.00 -0.30 0.00 0.00 42.92 40.35 3h73 s ASP 684 CO 0.70 -1.54 0.72 -0.63 -0.17 0.00 0.00 175.17 174.26 3h73 s ILE 685 N 4.60 4.73 0.28 4.11 1.01 -1.26 -4.63 121.20 130.04 3h73 s ILE 685 Ca 0.28 -0.47 -0.27 0.00 0.00 0.00 0.00 60.65 60.19 3h73 s ILE 685 Cb -0.13 -4.41 -0.09 0.00 0.01 0.00 0.00 42.46 37.83 3h73 s ILE 685 CO 0.13 -0.99 0.93 -0.75 0.00 0.00 0.00 174.94 174.27 3h73 s LYS 686 N 2.99 4.66 -0.06 2.79 2.47 -0.91 -4.83 119.74 126.86 3h73 s LYS 686 Ca 0.17 1.36 0.04 0.00 -1.56 0.00 0.00 55.97 55.98 3h73 s LYS 686 Cb -0.19 -2.98 -0.02 0.00 -1.46 0.00 0.00 37.83 33.18 3h73 s LYS 686 CO 0.12 0.38 -0.17 1.03 0.16 0.00 0.00 175.35 176.87 3h73 s ARG 687 N -1.72 2.63 -0.41 4.03 0.52 -1.26 -0.80 118.95 121.94 3h73 s ARG 687 Ca 0.46 -0.74 0.02 0.00 -0.52 0.00 0.00 55.73 54.95 3h73 s ARG 687 Cb -0.21 -2.36 0.11 0.00 0.52 0.00 0.00 34.95 33.01 3h73 s ARG 687 CO 0.27 0.51 0.15 0.71 0.02 0.00 0.00 175.30 176.96 3h73 s TYR 688 N -0.44 3.59 0.22 -0.53 2.02 -0.02 -4.95 117.35 117.24 3h73 s TYR 688 Ca 0.05 -2.90 0.30 0.00 -0.37 0.00 0.00 57.07 54.15 3h73 s TYR 688 Cb -0.12 -2.99 1.61 0.00 -0.40 0.00 0.00 41.96 40.06 3h73 s TYR 688 CO 0.02 -0.91 1.90 -1.35 -1.57 0.00 0.00 175.55 173.64 3h73 h PRO 689 N 7.44 0.00 0.00 -1.71 0.11 -1.96 -0.84 132.00 135.04 3h73 h PRO 689 Ca -0.06 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.97 3h73 h PRO 689 Cb 1.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 3h73 h PRO 689 CO 0.61 0.00 -0.38 1.96 -0.21 0.00 0.00 178.00 179.98 3h73 h GLN 690 N 0.00 0.00 -4.70 1.05 7.50 -1.98 -3.39 115.11 113.59 3h73 h GLN 690 Ca 0.00 0.00 -0.69 0.00 0.50 0.00 0.00 58.65 58.46 3h73 h GLN 690 Cb 0.14 0.00 -0.33 0.00 0.05 0.00 0.00 27.48 27.34 3h73 h GLN 690 CO 0.00 0.38 -0.66 0.08 -1.50 0.00 0.00 178.83 177.12 3h73 s VAL 691 N -4.05 3.09 0.53 -0.54 1.01 -0.32 -5.08 120.40 115.03 3h73 s VAL 691 Ca -0.02 -1.52 -0.20 0.00 0.00 0.00 0.00 61.98 60.24 3h73 s VAL 691 Cb 0.14 -2.86 -0.07 0.00 0.00 0.00 0.00 36.38 33.59 3h73 s VAL 691 CO 0.71 -0.24 1.10 -0.75 0.00 0.00 0.00 175.10 175.93 3h73 s LYS 692 N 1.23 3.49 -0.19 2.72 2.20 -1.26 -0.96 119.74 126.97 3h73 s LYS 692 Ca -0.02 1.55 -0.03 0.00 -0.36 0.00 0.00 55.97 57.11 3h73 s LYS 692 Cb -0.20 -2.04 0.06 0.00 -1.51 0.00 0.00 37.83 34.14 3h73 s LYS 692 CO -0.02 -0.73 0.04 0.34 -0.36 0.00 0.00 175.35 174.63 3h73 s ASP 693 N -1.82 2.80 -0.06 1.43 2.15 -0.70 -4.68 116.67 115.79 3h73 s ASP 693 Ca 0.71 -0.77 0.08 0.00 0.43 0.00 0.00 52.55 53.00 3h73 s ASP 693 Cb -0.22 -0.56 0.35 0.00 -0.30 0.00 0.00 42.92 42.19 3h73 s ASP 693 CO 0.25 -0.30 1.16 1.33 -0.17 0.00 0.00 175.17 177.43 3h73 n VAL 694 N 5.07 0.92 -1.90 1.11 0.24 -1.26 -3.96 118.33 118.54 3h73 n VAL 694 Ca -0.09 -0.56 -0.01 0.00 -2.04 0.00 0.00 64.34 61.63 3h73 n VAL 694 Cb 0.47 -0.12 0.01 0.00 -1.47 0.00 0.00 33.84 32.73 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 0.39 -0.69 -3.65 6.34 9.36 -1.26 -4.92 117.16 122.74 3h73 n TYR 695 Ca 0.12 0.25 -0.11 0.00 3.32 0.00 0.00 57.90 61.48 3h73 n TYR 695 Cb 0.51 -2.44 -0.05 0.00 -0.63 0.00 0.00 39.34 36.73 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 -3.04 0.06 0.79 2.97 0.11 -1.26 -5.01 120.40 115.03 3h73 s VAL 696 Ca 0.04 -0.52 -0.14 0.00 -2.93 0.00 0.00 61.98 58.44 3h73 s VAL 696 Cb -0.01 -1.07 0.07 0.00 -1.53 0.00 0.00 36.38 33.84 3h73 s VAL 696 CO 0.18 -0.29 1.21 1.67 -3.33 0.00 0.00 175.10 174.55 3h73 n GLN 697 N 0.09 0.27 -4.09 1.54 0.00 -1.26 -4.77 117.38 109.16 3h73 n GLN 697 Ca -0.17 0.17 -0.10 0.00 -0.00 0.00 0.00 57.00 56.89 3h73 n GLN 697 Cb 0.62 -2.45 -0.08 0.00 0.00 0.00 0.00 30.24 28.33 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 -4.04 1.20 0.03 3.69 0.23 -1.26 -4.59 119.30 114.56 3h73 s MET 698 Ca 0.74 -1.41 0.01 0.00 -1.03 0.00 0.00 55.69 54.00 3h73 s MET 698 Cb -0.30 0.33 -0.02 0.00 -1.53 0.00 0.00 34.83 33.31 3h73 s MET 698 CO 0.50 -0.42 -0.05 -1.54 -2.03 0.00 0.00 175.02 171.48 3h73 s SER 699 N -3.06 0.51 -0.06 -1.18 1.04 -1.09 -4.54 113.70 105.32 3h73 s SER 699 Ca 0.27 -0.59 -0.14 0.00 0.48 0.00 0.00 55.95 55.97 3h73 s SER 699 Cb 0.05 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.28 3h73 s SER 699 CO 0.06 -0.31 0.33 0.00 0.98 0.00 0.00 173.24 174.31 3h73 s ALA 700 N -1.79 -0.84 0.02 5.32 0.00 -1.26 -1.06 121.76 122.16 3h73 s ALA 700 Ca -0.10 0.58 0.01 0.00 0.00 0.00 0.00 51.96 52.44 3h73 s ALA 700 Cb -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 3h73 s ALA 700 CO -0.02 -0.23 -0.04 0.96 0.00 0.00 0.00 175.76 176.43 3h73 s ILE 701 N -0.80 0.23 0.31 0.00 -4.36 0.06 -4.73 121.20 111.89 3h73 s ILE 701 Ca -0.09 -0.88 -0.23 0.00 -0.26 0.00 0.00 60.65 59.19 3h73 s ILE 701 Cb -0.04 -0.34 -0.09 0.00 1.25 0.00 0.00 42.46 43.24 3h73 s ILE 701 CO 0.03 -0.42 0.87 -2.28 0.24 0.00 0.00 174.94 173.38 3h73 s HIS 702 N -1.31 3.63 -0.01 1.37 5.65 -1.26 -1.46 115.29 121.90 3h73 s HIS 702 Ca -0.13 1.63 -0.23 0.00 0.25 0.00 0.00 55.06 56.58 3h73 s HIS 702 Cb -0.09 -2.81 0.05 0.00 -1.18 0.00 0.00 32.58 28.55 3h73 s HIS 702 CO -0.01 0.21 0.51 -0.08 -0.65 0.00 0.00 174.74 174.72 3h73 s THR 703 N -1.66 0.03 0.01 0.89 -1.32 -0.76 -4.94 115.64 107.89 3h73 s THR 703 Ca 0.50 -0.24 0.05 0.00 -1.21 0.00 0.00 61.69 60.79 3h73 s THR 703 Cb -0.17 -0.86 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 3h73 s THR 703 CO 0.22 -0.13 -0.15 -0.04 -2.21 0.00 0.00 174.62 172.31 3h73 s MET 704 N -1.57 2.28 -0.20 7.08 -1.94 -1.26 -0.79 119.30 122.90 3h73 s MET 704 Ca -0.10 -0.86 -0.05 0.00 -1.71 0.00 0.00 55.69 52.97 3h73 s MET 704 Cb -0.02 -2.30 0.10 0.00 2.01 0.00 0.00 34.83 34.62 3h73 s MET 704 CO 0.05 0.57 0.34 -1.58 -0.01 0.00 0.00 175.02 174.40 3h73 s HIS 705 N -0.89 -0.65 -1.42 -0.03 5.04 -0.12 -4.91 115.29 112.30 3h73 s HIS 705 Ca 0.14 1.02 -0.09 0.00 -1.54 0.00 0.00 55.06 54.59 3h73 s HIS 705 Cb -0.11 0.05 0.04 0.00 0.04 0.00 0.00 32.58 32.61 3h73 s HIS 705 CO 0.05 -0.54 0.99 0.39 -2.34 0.00 0.00 174.74 173.29 3h73 n GLU 706 N 5.36 -6.16 -0.82 2.88 1.02 -1.26 -1.46 120.64 120.20 3h73 n GLU 706 Ca -0.06 0.68 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 3h73 n GLU 706 Cb 0.50 -5.57 0.00 0.00 -0.02 0.00 0.00 31.44 26.35 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 -1.72 1.22 3.69 0.62 0.00 -1.26 -5.01 105.19 102.73 3h73 n GLY 707 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.05 2.97 -0.09 1.61 1.02 -0.54 -5.10 119.74 119.56 3h73 s LYS 708 Ca 0.00 -0.42 -0.20 0.00 0.02 0.00 0.00 55.97 55.37 3h73 s LYS 708 Cb 0.00 -2.79 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 3h73 s LYS 708 CO 0.00 0.70 0.54 -2.00 -0.92 0.00 0.00 175.35 173.67 3h73 s GLU 709 N -0.97 4.35 0.30 1.68 2.12 -1.26 -0.95 118.70 123.96 3h73 s GLU 709 Ca 0.14 0.59 0.03 0.00 0.36 0.00 0.00 54.97 56.09 3h73 s GLU 709 Cb -0.11 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 3h73 s GLU 709 CO 0.03 0.18 0.15 0.71 -0.54 0.00 0.00 175.26 175.80 3h73 s TYR 710 N 0.50 1.59 -0.02 5.30 2.02 0.03 -1.38 117.35 125.40 3h73 s TYR 710 Ca 0.29 -1.34 0.00 0.00 -0.37 0.00 0.00 57.07 55.65 3h73 s TYR 710 Cb -0.16 -0.87 0.02 0.00 -0.40 0.00 0.00 41.96 40.55 3h73 s TYR 710 CO 0.13 -0.49 0.02 0.42 -1.57 0.00 0.00 175.55 174.06 3h73 s ILE 711 N -3.62 -0.01 -0.16 2.71 1.01 -0.06 -1.84 121.20 119.24 3h73 s ILE 711 Ca 0.36 0.16 -0.02 0.00 0.00 0.00 0.00 60.65 61.14 3h73 s ILE 711 Cb 0.05 -0.10 -0.02 0.00 0.01 0.00 0.00 42.46 42.41 3h73 s ILE 711 CO 0.17 0.08 -0.08 -0.63 0.00 0.00 0.00 174.94 174.48 3h73 s ILE 712 N 0.88 3.44 -0.04 2.92 1.01 -0.53 -0.82 121.20 128.06 3h73 s ILE 712 Ca -0.08 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.09 3h73 s ILE 712 Cb -0.11 -2.49 0.01 0.00 0.01 0.00 0.00 42.46 39.88 3h73 s ILE 712 CO -0.02 0.49 -0.10 -0.22 0.00 0.00 0.00 174.94 175.09 3h73 s LEU 713 N 0.54 1.74 -0.03 2.97 0.20 0.07 -0.76 118.68 123.41 3h73 s LEU 713 Ca -0.05 -0.22 0.05 0.00 0.69 0.00 0.00 54.13 54.60 3h73 s LEU 713 Cb -0.15 -0.64 -0.01 0.00 -0.43 0.00 0.00 46.19 44.96 3h73 s LEU 713 CO 0.03 0.06 -0.19 -0.55 -0.29 0.00 0.00 176.35 175.41 3h73 s SER 714 N 0.31 2.31 0.17 3.68 0.15 -0.23 0.68 113.70 120.77 3h73 s SER 714 Ca -0.06 -0.37 -0.23 0.00 0.70 0.00 0.00 55.95 55.99 3h73 s SER 714 Cb -0.11 -0.45 0.07 0.00 -1.71 0.00 0.00 66.02 63.83 3h73 s SER 714 CO 0.01 0.20 1.03 0.54 1.20 0.00 0.00 173.24 176.22 3h73 s ASN 715 N -0.23 -0.05 0.39 5.45 6.03 -0.89 -2.66 114.94 122.99 3h73 s ASN 715 Ca 0.02 -0.59 -0.27 0.00 -1.03 0.00 0.00 52.86 50.99 3h73 s ASN 715 Cb -0.10 0.49 -0.09 0.00 -3.03 0.00 0.00 41.25 38.52 3h73 s ASN 715 CO 0.01 -0.95 1.32 0.00 -2.03 0.00 0.00 177.10 175.44 3h73 s ALA 716 N -2.48 3.33 -0.82 3.54 0.00 -1.26 -0.77 121.76 123.30 3h73 s ALA 716 Ca 0.19 1.26 0.24 0.00 0.00 0.00 0.00 51.96 53.65 3h73 s ALA 716 Cb -0.02 -3.49 0.24 0.00 0.00 0.00 0.00 23.12 19.84 3h73 s ALA 716 CO 0.04 -0.80 1.21 0.41 0.00 0.00 0.00 175.76 176.61 3h73 n GLY 717 N 0.68 -1.22 0.54 0.00 0.00 0.72 -4.66 105.19 101.24 3h73 n GLY 717 Ca 0.03 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3h73 n GLY 717 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h73 n GLY 718 N 1.44 -3.18 0.26 -0.02 0.00 -0.71 -4.92 105.19 98.05 3h73 n GLY 718 Ca 0.04 -1.84 0.02 0.00 0.00 0.00 0.00 46.02 44.23 3h73 n GLY 718 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3h73 h PRO 719 N 0.00 0.47 0.00 1.61 0.11 -1.98 -3.41 132.00 128.81 3h73 h PRO 719 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3h73 h PRO 719 Cb 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 3h73 h PRO 719 CO 0.00 0.31 0.00 1.63 -0.21 0.00 0.00 178.00 179.73 3h73 n LYS 720 N -4.95 3.69 -2.36 1.05 5.02 -1.26 -4.90 118.16 114.45 3h73 n LYS 720 Ca 0.11 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.97 3h73 n LYS 720 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.32 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 3.19 -3.89 1.97 1.74 -1.26 -4.67 116.66 113.73 3h73 n ARG 721 Ca 0.00 -3.22 -0.08 0.00 -0.77 0.00 0.00 57.85 53.78 3h73 n ARG 721 Cb 0.00 -3.28 -0.03 0.00 -1.02 0.00 0.00 32.46 28.13 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 2.93 1.64 -0.68 5.56 -1.05 -1.18 -0.99 118.70 124.94 3h73 s GLU 722 Ca 0.48 -1.07 -0.03 0.00 -0.15 0.00 0.00 54.97 54.20 3h73 s GLU 722 Cb 0.06 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 34.31 3h73 s GLU 722 CO 0.01 -0.72 0.68 0.09 0.95 0.00 0.00 175.26 176.26 3h73 n ASN 723 N -0.42 -7.73 -4.73 0.83 3.02 -0.11 -1.74 115.26 104.38 3h73 n ASN 723 Ca -0.04 0.01 -0.42 0.00 -0.03 0.00 0.00 54.58 54.10 3h73 n ASN 723 Cb 0.61 -5.20 -0.01 0.00 -0.61 0.00 0.00 39.78 34.56 3h73 n ASN 723 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h73 n GLY 724 N -1.49 1.12 3.29 7.41 0.00 -0.10 -0.20 105.19 115.22 3h73 n GLY 724 Ca 0.01 0.42 -0.22 0.00 0.00 0.00 0.00 46.02 46.23 3h73 n GLY 724 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h73 s MET 725 N -0.94 1.14 -0.26 1.61 -1.94 0.05 -0.86 119.30 118.10 3h73 s MET 725 Ca 0.62 -1.23 0.02 0.00 -1.71 0.00 0.00 55.69 53.38 3h73 s MET 725 Cb -0.53 -1.27 0.07 0.00 2.01 0.00 0.00 34.83 35.11 3h73 s MET 725 CO 0.53 0.28 -0.04 0.08 -0.01 0.00 0.00 175.02 175.85 3h73 s VAL 726 N -1.57 1.75 -0.02 -6.03 1.01 0.18 -2.09 120.40 113.63 3h73 s VAL 726 Ca 0.09 -1.49 -0.14 0.00 0.00 0.00 0.00 61.98 60.44 3h73 s VAL 726 Cb -0.08 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 3h73 s VAL 726 CO 0.05 -0.19 0.38 -1.00 0.00 0.00 0.00 175.10 174.34 3h73 s HIS 727 N 1.27 3.70 -0.12 5.22 0.09 0.21 -2.14 115.29 123.52 3h73 s HIS 727 Ca -0.03 0.94 0.01 0.00 -0.00 0.00 0.00 55.06 55.97 3h73 s HIS 727 Cb -0.19 -2.27 -0.01 0.00 -0.00 0.00 0.00 32.58 30.11 3h73 s HIS 727 CO -0.07 0.62 -0.16 -1.17 -0.00 0.00 0.00 174.74 173.95 3h73 s LEU 728 N -0.96 2.51 0.03 0.89 2.96 -0.15 -0.75 118.68 123.20 3h73 s LEU 728 Ca 0.23 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.78 3h73 s LEU 728 Cb -0.16 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.96 3h73 s LEU 728 CO 0.12 0.15 -0.16 0.00 -1.32 0.00 0.00 176.35 175.14 3h73 s ALA 729 N 0.40 1.36 -0.07 5.97 0.00 -0.00 -0.65 121.76 128.76 3h73 s ALA 729 Ca -0.13 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.83 3h73 s ALA 729 Cb -0.16 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 3h73 s ALA 729 CO 0.06 0.29 0.40 0.50 0.00 0.00 0.00 175.76 177.01 3h73 s ARG 730 N -0.97 4.10 -0.17 0.00 6.06 0.42 -0.88 118.95 127.50 3h73 s ARG 730 Ca 0.04 0.34 -0.05 0.00 -2.50 0.00 0.00 55.73 53.56 3h73 s ARG 730 Cb -0.08 -3.33 -0.03 0.00 0.06 0.00 0.00 34.95 31.58 3h73 s ARG 730 CO 0.01 0.44 -0.01 0.08 -2.50 0.00 0.00 175.30 173.33 3h73 s VAL 731 N -0.26 4.06 0.69 7.11 1.01 -0.48 -1.54 120.40 131.00 3h73 s VAL 731 Ca 0.23 -0.29 0.03 0.00 0.00 0.00 0.00 61.98 61.94 3h73 s VAL 731 Cb -0.15 -2.81 0.13 0.00 0.00 0.00 0.00 36.38 33.55 3h73 s VAL 731 CO 0.10 0.47 0.96 -1.61 0.00 0.00 0.00 175.10 175.01 3h73 s GLU 732 N 0.56 1.77 0.44 2.72 0.41 -0.89 -4.55 118.70 119.15 3h73 s GLU 732 Ca -0.01 -1.35 0.18 0.00 -0.41 0.00 0.00 54.97 53.38 3h73 s GLU 732 Cb -0.14 -2.42 1.01 0.00 -1.78 0.00 0.00 34.13 30.80 3h73 s GLU 732 CO 0.02 -1.35 1.94 0.93 -0.49 0.00 0.00 175.26 176.31 3h73 h GLU 733 N -0.37 0.00 -0.01 1.61 5.08 -2.00 -1.87 114.58 117.03 3h73 h GLU 733 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3h73 h GLU 733 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3h73 h GLU 733 CO 0.39 0.24 -0.07 0.27 -1.00 0.00 0.00 179.01 178.83 3h73 n ASN 734 N -4.00 0.65 0.00 1.42 6.94 -1.26 -4.76 115.26 114.24 3h73 n ASN 734 Ca -0.02 -0.88 0.00 0.00 -0.02 0.00 0.00 54.58 53.66 3h73 n ASN 734 Cb 0.31 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.71 3h73 n ASN 734 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h73 n GLY 735 N 1.21 0.76 3.80 4.83 0.00 -0.70 -5.05 105.19 110.03 3h73 n GLY 735 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.48 3.90 -0.06 1.61 0.41 -1.26 -4.77 118.70 118.05 3h73 s GLU 736 Ca 0.00 1.38 -0.00 0.00 -0.41 0.00 0.00 54.97 55.93 3h73 s GLU 736 Cb 0.00 -2.19 -0.03 0.00 -1.78 0.00 0.00 34.13 30.13 3h73 s GLU 736 CO 0.00 -0.35 -0.02 -0.51 -0.49 0.00 0.00 175.26 173.89 3h73 s LEU 737 N -3.30 3.42 -0.23 1.80 1.43 -1.26 -2.10 118.68 118.44 3h73 s LEU 737 Ca 0.65 0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.80 3h73 s LEU 737 Cb -0.17 -1.81 0.07 0.00 0.03 0.00 0.00 46.19 44.31 3h73 s LEU 737 CO 0.21 0.35 0.01 -0.89 0.23 0.00 0.00 176.35 176.26 3h73 s THR 738 N -0.90 1.00 -0.15 5.49 2.01 -0.59 -4.95 115.64 117.54 3h73 s THR 738 Ca 0.14 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.87 3h73 s THR 738 Cb -0.11 -1.45 -0.02 0.00 0.01 0.00 0.00 72.50 70.92 3h73 s THR 738 CO 0.04 -0.25 1.32 0.26 -0.69 0.00 0.00 174.62 175.30 3h73 s TRP 739 N 1.62 2.71 -0.26 4.92 0.52 -1.26 -0.44 118.94 126.76 3h73 s TRP 739 Ca -0.01 0.89 -0.09 0.00 0.02 0.00 0.00 56.10 56.91 3h73 s TRP 739 Cb -0.18 -3.58 -0.15 0.00 -1.15 0.00 0.00 33.47 28.42 3h73 s TRP 739 CO -0.10 -2.01 -0.25 1.28 0.02 0.00 0.00 176.95 175.89 3h73 n LEU 740 N 6.73 2.33 -4.13 2.99 4.77 0.17 -4.98 117.00 124.88 3h73 n LEU 740 Ca 0.14 0.18 -0.12 0.00 -0.03 0.00 0.00 56.01 56.18 3h73 n LEU 740 Cb 0.45 -0.87 -0.11 0.00 -2.33 0.00 0.00 43.42 40.56 3h73 n LEU 740 CO 0.57 0.69 -0.40 -0.54 -1.33 0.00 0.00 177.39 176.38 3h73 s LYS 741 N -2.51 0.72 -0.31 3.23 3.01 -1.16 -5.00 119.74 117.73 3h73 s LYS 741 Ca -0.36 -1.07 -0.02 0.00 -1.01 0.00 0.00 55.97 53.50 3h73 s LYS 741 Cb 0.12 -0.32 0.12 0.00 -1.01 0.00 0.00 37.83 36.74 3h73 s LYS 741 CO 0.55 0.03 0.19 -1.01 0.51 0.00 0.00 175.35 175.62 3h73 s HIS 742 N -2.49 0.22 -0.08 3.18 3.76 -1.26 -0.98 115.29 117.63 3h73 s HIS 742 Ca 0.02 -0.89 0.02 0.00 -0.15 0.00 0.00 55.06 54.06 3h73 s HIS 742 Cb -0.02 -0.80 -0.02 0.00 1.11 0.00 0.00 32.58 32.85 3h73 s HIS 742 CO -0.02 -0.85 -0.12 -0.80 -0.85 0.00 0.00 174.74 172.10 3h73 s ASN 743 N 1.92 4.14 0.45 1.40 0.01 -0.91 -4.93 114.94 117.03 3h73 s ASN 743 Ca 0.11 -0.21 -0.23 0.00 -0.71 0.00 0.00 52.86 51.82 3h73 s ASN 743 Cb -0.17 -1.19 -0.07 0.00 0.41 0.00 0.00 41.25 40.23 3h73 s ASN 743 CO -0.27 0.28 1.19 -2.84 -1.51 0.00 0.00 177.10 173.94 3h73 s PRO 744 N -0.32 3.76 0.00 -0.60 0.02 -1.26 -0.65 135.00 135.95 3h73 s PRO 744 Ca 0.03 1.84 0.00 0.00 0.02 0.00 0.00 61.00 62.89 3h73 s PRO 744 Cb -0.13 -2.45 0.00 0.00 0.02 0.00 0.00 34.50 31.94 3h73 s PRO 744 CO 0.02 -0.57 0.00 1.51 -0.33 0.00 0.00 177.00 177.64 3h73 n ILE 745 N -0.42 0.00 -3.47 2.83 3.06 -0.04 -4.87 119.36 116.47 3h73 n ILE 745 Ca 0.07 -0.04 -0.01 0.00 -2.50 0.00 0.00 62.75 60.28 3h73 n ILE 745 Cb 0.47 0.37 -0.04 0.00 0.54 0.00 0.00 39.64 40.99 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 -1.02 0.54 0.88 9.51 2.00 -1.22 -4.98 119.66 125.36 3h73 s GLN 746 Ca 0.00 1.22 -0.12 0.00 -2.00 0.00 0.00 55.36 54.46 3h73 s GLN 746 Cb 0.00 0.64 0.12 0.00 0.80 0.00 0.00 33.01 34.57 3h73 s GLN 746 CO 0.00 -0.37 1.12 -1.59 -0.50 0.00 0.00 175.29 173.95 3h73 s LYS 747 N 2.84 1.42 2.25 1.67 -2.85 -1.26 -0.93 119.74 122.88 3h73 s LYS 747 Ca 0.04 0.44 0.00 0.00 -1.00 0.00 0.00 55.97 55.45 3h73 s LYS 747 Cb -0.13 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.78 3h73 s LYS 747 CO -0.19 -2.04 0.00 0.41 0.10 0.00 0.00 175.35 173.63 3h73 n GLY 748 N -2.07 -0.70 3.69 0.59 0.00 -1.26 -4.70 105.19 100.73 3h73 n GLY 748 Ca 0.07 -1.14 -0.44 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.11 2.14 -3.67 1.61 -0.58 -1.26 -0.93 120.64 117.85 3h73 n GLU 749 Ca 0.00 0.76 -0.08 0.00 -0.42 0.00 0.00 57.16 57.42 3h73 n GLU 749 Cb 0.00 -2.41 -0.09 0.00 -0.57 0.00 0.00 31.44 28.37 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 -0.34 -0.86 0.00 -0.32 5.36 -0.16 -4.10 117.98 117.56 3h73 s PHE 750 Ca 0.64 1.72 0.00 0.00 -0.96 0.00 0.00 56.93 58.34 3h73 s PHE 750 Cb -0.61 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 42.53 3h73 s PHE 750 CO 0.53 -0.46 0.00 0.00 -1.46 0.00 0.00 175.22 173.83 3h73 n ALA 751 N 4.50 0.00 -1.76 11.12 0.00 -0.88 -3.09 120.51 130.40 3h73 n ALA 751 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.86 3h73 n ALA 751 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 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 2.60 2.59 0.19 0.00 1.51 -1.26 -4.58 117.35 118.40 3h73 s TYR 752 Ca 0.00 1.43 -0.13 0.00 -1.01 0.00 0.00 57.07 57.36 3h73 s TYR 752 Cb 0.00 -3.63 0.01 0.00 -0.11 0.00 0.00 41.96 38.22 3h73 s TYR 752 CO 0.00 -2.27 0.42 0.54 -1.11 0.00 0.00 175.55 173.13 3h73 s ASN 753 N -1.05 -0.11 -0.14 2.29 4.22 -1.26 -0.28 114.94 118.61 3h73 s ASN 753 Ca 0.66 -0.72 -0.04 0.00 -2.14 0.00 0.00 52.86 50.62 3h73 s ASN 753 Cb -0.36 0.52 0.07 0.00 1.28 0.00 0.00 41.25 42.76 3h73 s ASN 753 CO 0.44 -1.01 0.25 -0.55 -2.04 0.00 0.00 177.10 174.19 3h73 s SER 754 N -2.94 0.53 0.09 3.54 0.15 0.95 -4.23 113.70 111.80 3h73 s SER 754 Ca 0.15 0.44 -0.07 0.00 0.70 0.00 0.00 55.95 57.17 3h73 s SER 754 Cb 0.01 0.63 -0.05 0.00 -1.71 0.00 0.00 66.02 64.89 3h73 s SER 754 CO 0.00 -0.25 0.35 -0.76 1.20 0.00 0.00 173.24 173.79 3h73 s LEU 755 N 2.40 4.32 -0.05 3.45 1.43 -1.26 -1.57 118.68 127.39 3h73 s LEU 755 Ca 0.03 0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 53.68 3h73 s LEU 755 Cb -0.13 -3.06 0.02 0.00 0.03 0.00 0.00 46.19 43.05 3h73 s LEU 755 CO -0.09 0.14 0.20 -1.10 0.23 0.00 0.00 176.35 175.73 3h73 s GLN 756 N -2.23 0.35 -0.06 1.70 -1.52 -0.21 -4.88 119.66 112.82 3h73 s GLN 756 Ca 0.35 0.07 -0.23 0.00 -1.95 0.00 0.00 55.36 53.61 3h73 s GLN 756 Cb -0.13 0.16 -0.04 0.00 -0.22 0.00 0.00 33.01 32.78 3h73 s GLN 756 CO 0.21 -0.07 0.68 -2.00 -0.25 0.00 0.00 175.29 173.87 3h73 s GLU 757 N -0.40 4.43 0.00 2.91 2.12 -1.26 -0.27 118.70 126.23 3h73 s GLU 757 Ca -0.05 0.85 0.22 0.00 0.36 0.00 0.00 54.97 56.35 3h73 s GLU 757 Cb -0.03 -3.43 -0.28 0.00 0.26 0.00 0.00 34.13 30.64 3h73 s GLU 757 CO 0.01 0.10 0.58 1.28 -0.54 0.00 0.00 175.26 176.70 3h73 n LEU 758 N 3.65 0.17 0.00 2.70 4.77 -0.27 -4.89 117.00 123.13 3h73 n LEU 758 Ca -0.02 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3h73 n LEU 758 Cb 0.51 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3h73 n LEU 758 CO 0.47 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 3h73 n GLY 759 N 1.26 1.95 2.41 -0.72 0.00 -1.08 -4.91 105.19 104.09 3h73 n GLY 759 Ca -0.03 -1.95 -0.20 0.00 0.00 0.00 0.00 46.02 43.84 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 -5.58 0.00 1.61 5.15 -1.26 -1.59 115.26 113.59 3h73 n ASN 760 Ca 0.00 0.08 0.00 0.00 -0.60 0.00 0.00 54.58 54.06 3h73 n ASN 760 Cb 0.00 -4.65 0.00 0.00 -0.53 0.00 0.00 39.78 34.60 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 -0.93 0.65 3.77 8.20 0.00 -1.26 -5.01 105.19 110.61 3h73 n GLY 761 Ca -0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.12 2.81 0.05 1.61 2.02 -0.62 -2.47 118.70 121.98 3h73 s GLU 762 Ca 0.00 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.08 3h73 s GLU 762 Cb 0.00 -2.59 -0.03 0.00 0.10 0.00 0.00 34.13 31.60 3h73 s GLU 762 CO 0.00 0.48 -0.04 0.71 0.02 0.00 0.00 175.26 176.43 3h73 s TYR 763 N -1.74 0.53 0.15 1.61 2.02 0.11 -1.11 117.35 118.91 3h73 s TYR 763 Ca 0.30 -0.84 0.07 0.00 -0.37 0.00 0.00 57.07 56.23 3h73 s TYR 763 Cb -0.10 -0.36 -0.04 0.00 -0.40 0.00 0.00 41.96 41.06 3h73 s TYR 763 CO 0.22 -0.26 -0.15 0.20 -1.57 0.00 0.00 175.55 173.99 3h73 s GLY 764 N -2.42 1.21 -0.12 0.71 0.00 0.63 -1.16 107.32 106.17 3h73 s GLY 764 Ca 0.00 -1.41 -0.08 0.00 0.00 0.00 0.00 44.72 43.23 3h73 s GLY 764 CO -0.06 -1.47 0.29 -1.50 0.00 0.00 0.00 173.10 170.36 3h73 s ILE 765 N -2.31 -0.02 -0.19 0.90 2.07 -0.57 -1.04 121.20 120.05 3h73 s ILE 765 Ca 0.13 0.08 -0.04 0.00 -1.41 0.00 0.00 60.65 59.41 3h73 s ILE 765 Cb -0.04 -0.43 -0.02 0.00 0.13 0.00 0.00 42.46 42.10 3h73 s ILE 765 CO 0.04 0.03 -0.04 -0.22 -1.91 0.00 0.00 174.94 172.84 3h73 s LEU 766 N 0.83 3.04 0.12 8.50 2.96 -0.61 -1.88 118.68 131.63 3h73 s LEU 766 Ca -0.06 -0.27 -0.06 0.00 -0.22 0.00 0.00 54.13 53.53 3h73 s LEU 766 Cb -0.07 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 3h73 s LEU 766 CO -0.06 0.07 0.15 -0.72 -1.32 0.00 0.00 176.35 174.48 3h73 s TYR 767 N 0.93 0.48 -0.04 5.38 1.13 -0.52 -0.03 117.35 124.69 3h73 s TYR 767 Ca -0.00 -0.89 -0.21 0.00 -1.41 0.00 0.00 57.07 54.56 3h73 s TYR 767 Cb -0.15 -0.22 -0.05 0.00 -1.10 0.00 0.00 41.96 40.44 3h73 s TYR 767 CO 0.01 -0.57 0.59 -1.21 -2.51 0.00 0.00 175.55 171.86 3h73 s GLU 768 N -3.96 4.34 0.07 -3.49 2.02 0.61 -1.68 118.70 116.61 3h73 s GLU 768 Ca 0.14 0.71 -0.26 0.00 0.02 0.00 0.00 54.97 55.58 3h73 s GLU 768 Cb 0.06 -3.38 0.07 0.00 0.10 0.00 0.00 34.13 30.98 3h73 s GLU 768 CO -0.04 0.27 0.63 -1.58 0.02 0.00 0.00 175.26 174.57 3h73 s HIS 769 N 0.14 -0.59 0.04 1.61 2.46 -0.78 -2.07 115.29 116.10 3h73 s HIS 769 Ca 0.31 0.67 -0.05 0.00 0.47 0.00 0.00 55.06 56.47 3h73 s HIS 769 Cb -0.18 0.49 -0.01 0.00 -0.13 0.00 0.00 32.58 32.75 3h73 s HIS 769 CO 0.16 -0.74 0.07 0.95 -2.47 0.00 0.00 174.74 172.71 3h73 s THR 770 N -2.62 0.14 0.01 0.89 -4.23 -1.26 -1.35 115.64 107.21 3h73 s THR 770 Ca -0.04 -1.14 -0.29 0.00 -1.18 0.00 0.00 61.69 59.04 3h73 s THR 770 Cb -0.01 -0.90 0.10 0.00 1.34 0.00 0.00 72.50 73.04 3h73 s THR 770 CO -0.03 -0.63 1.01 -1.83 -0.54 0.00 0.00 174.62 172.60 3h73 s GLU 771 N -2.63 0.78 -1.46 3.99 -1.05 -1.26 -4.33 118.70 112.74 3h73 s GLU 771 Ca -0.05 -0.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.41 3h73 s GLU 771 Cb -0.01 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 34.00 3h73 s GLU 771 CO -0.05 -0.35 0.00 0.36 0.95 0.00 0.00 175.26 176.17 3h73 n LYS 772 N -0.31 -1.58 -0.13 -4.83 2.85 -1.26 -1.49 118.16 111.41 3h73 n LYS 772 Ca -0.06 0.94 0.00 0.00 -1.05 0.00 0.00 58.31 58.13 3h73 n LYS 772 Cb 0.61 -5.28 0.00 0.00 -0.65 0.00 0.00 35.03 29.71 3h73 n LYS 772 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3h73 n GLY 773 N -0.01 0.91 3.75 2.58 0.00 -1.26 -4.92 105.19 106.25 3h73 n GLY 773 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.87 3.24 0.52 1.61 -0.21 -0.56 -1.38 119.66 122.02 3h73 s GLN 774 Ca 0.00 2.24 -0.19 0.00 0.02 0.00 0.00 55.36 57.42 3h73 s GLN 774 Cb 0.00 -2.32 -0.07 0.00 1.00 0.00 0.00 33.01 31.63 3h73 s GLN 774 CO 0.00 -1.11 1.08 -0.80 -2.12 0.00 0.00 175.29 172.33 3h73 s ASN 775 N -0.91 6.02 -0.20 5.90 0.02 0.69 -4.65 114.94 121.81 3h73 s ASN 775 Ca 0.70 2.01 -0.29 0.00 -1.02 0.00 0.00 52.86 54.26 3h73 s ASN 775 Cb -0.40 -2.57 -0.02 0.00 0.02 0.00 0.00 41.25 38.28 3h73 s ASN 775 CO 0.48 -1.01 1.51 0.00 0.02 0.00 0.00 177.10 178.11 3h73 s ALA 776 N -1.96 3.41 0.27 0.60 0.00 -1.26 -3.86 121.76 118.96 3h73 s ALA 776 Ca 0.69 0.48 0.02 0.00 0.00 0.00 0.00 51.96 53.15 3h73 s ALA 776 Cb -0.19 -3.78 -0.04 0.00 0.00 0.00 0.00 23.12 19.11 3h73 s ALA 776 CO 0.25 -1.70 0.16 0.71 0.00 0.00 0.00 175.76 175.18 3h73 s TYR 777 N 4.59 1.47 -0.18 0.00 2.02 0.16 -4.29 117.35 121.12 3h73 s TYR 777 Ca 0.66 -1.39 -0.03 0.00 -0.37 0.00 0.00 57.07 55.94 3h73 s TYR 777 Cb -0.24 -0.75 -0.02 0.00 -0.40 0.00 0.00 41.96 40.55 3h73 s TYR 777 CO 0.26 -0.59 -0.05 0.99 -1.57 0.00 0.00 175.55 174.59 3h73 s THR 778 N -3.78 3.62 -0.31 -0.71 2.01 -0.46 -3.11 115.64 112.90 3h73 s THR 778 Ca 0.38 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 61.76 3h73 s THR 778 Cb 0.06 -2.60 -0.01 0.00 0.01 0.00 0.00 72.50 69.95 3h73 s THR 778 CO 0.17 0.46 0.51 -0.76 -0.69 0.00 0.00 174.62 174.31 3h73 s LEU 779 N 0.81 4.21 0.27 4.42 1.02 -0.19 -1.87 118.68 127.34 3h73 s LEU 779 Ca -0.01 0.21 0.10 0.00 0.02 0.00 0.00 54.13 54.45 3h73 s LEU 779 Cb -0.15 -2.62 -0.05 0.00 0.02 0.00 0.00 46.19 43.40 3h73 s LEU 779 CO 0.02 -0.40 -0.05 -0.44 0.02 0.00 0.00 176.35 175.50 3h73 s SER 780 N 1.68 4.27 -0.02 2.29 0.01 -0.68 -0.47 113.70 120.78 3h73 s SER 780 Ca 0.20 -0.77 0.07 0.00 1.31 0.00 0.00 55.95 56.76 3h73 s SER 780 Cb -0.15 -0.68 -0.02 0.00 0.21 0.00 0.00 66.02 65.38 3h73 s SER 780 CO 0.12 -0.01 -0.24 0.12 0.41 0.00 0.00 173.24 173.64 3h73 s PHE 781 N -2.39 2.17 0.04 2.43 5.36 0.21 -1.43 117.98 124.37 3h73 s PHE 781 Ca 0.31 -0.45 -0.00 0.00 -0.96 0.00 0.00 56.93 55.82 3h73 s PHE 781 Cb -0.06 -1.41 -0.03 0.00 -0.34 0.00 0.00 43.02 41.19 3h73 s PHE 781 CO 0.19 -0.07 -0.03 1.03 -1.46 0.00 0.00 175.22 174.88 3h73 s ARG 782 N -0.48 0.47 0.07 10.12 0.52 -0.79 -1.06 118.95 127.80 3h73 s ARG 782 Ca 0.07 -0.93 0.07 0.00 -0.52 0.00 0.00 55.73 54.42 3h73 s ARG 782 Cb -0.10 0.15 -0.03 0.00 0.52 0.00 0.00 34.95 35.49 3h73 s ARG 782 CO -0.00 -0.08 -0.19 0.21 0.02 0.00 0.00 175.30 175.26 3h73 s LYS 783 N -2.74 1.14 0.11 3.54 2.20 -1.26 -1.51 119.74 121.22 3h73 s LYS 783 Ca -0.04 -1.00 -0.13 0.00 -0.36 0.00 0.00 55.97 54.44 3h73 s LYS 783 Cb -0.01 -1.29 0.02 0.00 -1.51 0.00 0.00 37.83 35.04 3h73 s LYS 783 CO -0.06 0.31 0.32 -0.59 -0.36 0.00 0.00 175.35 174.98 3h73 s PHE 784 N -1.01 -0.07 0.34 4.03 -0.71 -0.31 -0.89 117.98 119.36 3h73 s PHE 784 Ca 0.05 -0.29 0.01 0.00 -1.04 0.00 0.00 56.93 55.66 3h73 s PHE 784 Cb -0.09 0.14 0.01 0.00 -1.21 0.00 0.00 43.02 41.87 3h73 s PHE 784 CO 0.03 -0.64 0.10 0.27 -1.34 0.00 0.00 175.22 173.64 3h73 n ASN 785 N -0.16 2.60 -0.09 1.98 2.04 -1.10 0.03 115.26 120.56 3h73 n ASN 785 Ca -0.16 -2.35 0.03 0.00 -0.44 0.00 0.00 54.58 51.66 3h73 n ASN 785 Cb 0.63 0.13 0.36 0.00 -2.53 0.00 0.00 39.78 38.37 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 0.95 0.68 -0.60 -2.53 2.91 -1.85 -1.64 115.95 113.88 3h73 h TRP 786 Ca -0.25 0.02 0.07 0.00 1.13 0.00 0.00 58.89 59.85 3h73 h TRP 786 Cb 0.82 -0.23 -0.04 0.00 -0.51 0.00 0.00 29.16 29.21 3h73 h TRP 786 CO 0.00 0.42 0.40 -0.44 -1.03 0.00 0.00 178.44 177.79 3h73 h ASP 787 N 0.73 0.48 0.43 2.65 3.32 -1.90 0.11 116.42 122.25 3h73 h ASP 787 Ca 0.21 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.11 3h73 h ASP 787 Cb -0.06 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3h73 h ASP 787 CO -0.05 0.31 -0.65 0.15 -1.72 0.00 0.00 179.24 177.29 3h73 h PHE 788 N 0.55 0.27 -0.04 4.55 3.57 -1.54 -3.23 116.94 121.07 3h73 h PHE 788 Ca 0.26 -0.11 -0.10 0.00 3.53 0.00 0.00 57.97 61.55 3h73 h PHE 788 Cb 0.32 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 39.02 3h73 h PHE 788 CO -0.00 0.79 -0.36 -0.07 -2.23 0.00 0.00 178.31 176.44 3h73 h LEU 789 N 0.15 0.39 0.00 0.59 3.38 -0.62 -3.44 115.31 115.76 3h73 h LEU 789 Ca -0.01 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.27 3h73 h LEU 789 Cb 1.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3h73 h LEU 789 CO 0.10 1.02 0.00 -1.54 0.09 0.00 0.00 178.44 178.11 3h73 n SER 790 N -4.40 0.00 -4.37 -0.43 3.41 -0.16 -4.77 113.62 102.89 3h73 n SER 790 Ca -0.09 0.00 -0.46 0.00 -0.26 0.00 0.00 58.87 58.06 3h73 n SER 790 Cb 0.53 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.46 3h73 n SER 790 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h73 n LYS 791 N -0.53 0.03 -2.13 4.33 5.02 -1.22 -4.86 118.16 118.80 3h73 n LYS 791 Ca 0.00 0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 3h73 n LYS 791 Cb 0.00 -1.02 -0.02 0.00 -0.02 0.00 0.00 35.03 33.96 3h73 n LYS 791 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3h73 s ASP 792 N -0.99 6.80 0.00 4.39 1.01 -1.26 -4.80 116.67 121.81 3h73 s ASP 792 Ca 0.62 2.59 0.26 0.00 0.71 0.00 0.00 52.55 56.73 3h73 s ASP 792 Cb -0.82 -2.63 1.55 0.00 1.01 0.00 0.00 42.92 42.03 3h73 s ASP 792 CO 0.58 -0.56 1.90 0.18 0.21 0.00 0.00 175.17 177.49