#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ggf s SER 321 N 0.00 4.63 0.67 1.61 0.01 -1.26 -5.10 113.70 114.27 2ggf s SER 321 Ca 0.00 -3.56 -0.17 0.00 1.31 0.00 0.00 55.95 53.53 2ggf s SER 321 Cb 0.00 -1.63 -0.01 0.00 0.21 0.00 0.00 66.02 64.60 2ggf s SER 321 CO 0.00 -0.14 1.11 -0.24 0.41 0.00 0.00 173.24 174.39 2ggf n SER 322 N 2.37 1.22 -0.12 2.44 2.88 -1.26 -4.78 113.62 116.37 2ggf n SER 322 Ca 0.15 0.75 0.01 0.00 -1.33 0.00 0.00 58.87 58.45 2ggf n SER 322 Cb 0.34 -1.47 -0.01 0.00 -0.75 0.00 0.00 64.21 62.32 2ggf n SER 322 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ggf n GLY 323 N 1.03 -2.70 3.50 0.46 0.00 -1.26 -5.09 105.19 101.13 2ggf n GLY 323 Ca 0.14 -1.41 -0.14 0.00 0.00 0.00 0.00 46.02 44.62 2ggf n GLY 323 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ggf s SER 324 N -4.21 -0.55 0.30 1.61 0.01 -1.26 -5.18 113.70 104.42 2ggf s SER 324 Ca 0.00 0.37 0.10 0.00 1.31 0.00 0.00 55.95 57.73 2ggf s SER 324 Cb 0.00 0.50 -0.06 0.00 0.21 0.00 0.00 66.02 66.68 2ggf s SER 324 CO 0.00 -0.68 -0.13 -0.44 0.41 0.00 0.00 173.24 172.40 2ggf s SER 325 N -1.81 3.43 0.17 2.44 0.01 -1.26 -5.16 113.70 111.52 2ggf s SER 325 Ca -0.04 -1.13 -0.02 0.00 1.31 0.00 0.00 55.95 56.07 2ggf s SER 325 Cb -0.00 -0.29 0.01 0.00 0.21 0.00 0.00 66.02 65.95 2ggf s SER 325 CO -0.00 -0.15 0.25 0.61 0.41 0.00 0.00 173.24 174.36 2ggf n GLY 326 N -0.67 2.47 0.13 3.44 0.00 -1.26 -5.09 105.19 104.22 2ggf n GLY 326 Ca -0.05 -1.43 -0.27 0.00 0.00 0.00 0.00 46.02 44.27 2ggf n GLY 326 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ggf n LEU 327 N 0.00 2.03 -0.37 0.99 7.99 -1.26 -3.73 117.00 122.65 2ggf n LEU 327 Ca -0.00 0.32 -0.08 0.00 -0.01 0.00 0.00 56.01 56.24 2ggf n LEU 327 Cb 0.27 -0.87 -0.06 0.00 -0.11 0.00 0.00 43.42 42.65 2ggf n LEU 327 CO 0.13 0.54 0.46 0.52 -1.51 0.00 0.00 177.39 177.53 2ggf n VAL 328 N -4.20 -0.58 -0.00 4.08 0.31 -1.26 -0.74 118.33 115.93 2ggf n VAL 328 Ca -0.48 2.17 -0.12 0.00 -0.01 0.00 0.00 64.34 65.90 2ggf n VAL 328 Cb 0.85 -2.73 -0.08 0.00 -0.91 0.00 0.00 33.84 30.97 2ggf n VAL 328 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2ggf h LYS 329 N 0.00 0.06 -0.81 5.55 1.63 -2.01 -3.04 116.57 117.94 2ggf h LYS 329 Ca 0.19 -0.02 0.32 0.00 -0.85 0.00 0.00 60.65 60.28 2ggf h LYS 329 Cb 0.41 -0.01 -0.15 0.00 -0.60 0.00 0.00 32.23 31.89 2ggf h LYS 329 CO -0.86 0.33 0.35 -1.91 -3.45 0.00 0.00 179.45 173.91 2ggf n GLU 330 N -4.91 -0.05 0.24 1.90 4.07 0.08 -0.25 120.64 121.72 2ggf n GLU 330 Ca -0.07 1.14 -0.12 0.00 -0.06 0.00 0.00 57.16 58.06 2ggf n GLU 330 Cb 0.17 -2.00 -0.06 0.00 -0.06 0.00 0.00 31.44 29.49 2ggf n GLU 330 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 2ggf h ILE 331 N 0.00 0.00 -0.22 6.31 2.04 -1.22 -2.57 117.51 121.85 2ggf h ILE 331 Ca 0.65 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.54 2ggf h ILE 331 Cb 1.66 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.67 2ggf h ILE 331 CO -0.66 0.00 -0.52 -0.78 0.00 0.00 0.00 178.15 176.20 2ggf h ASP 332 N -0.70 -1.67 -0.84 1.72 3.58 -0.73 -2.23 116.42 115.54 2ggf h ASP 332 Ca -0.06 0.21 0.08 0.00 0.42 0.00 0.00 57.03 57.68 2ggf h ASP 332 Cb 0.57 0.67 -0.11 0.00 1.72 0.00 0.00 39.33 42.18 2ggf h ASP 332 CO 0.04 -0.43 -0.47 0.23 -2.88 0.00 0.00 179.24 175.73 2ggf n MET 333 N -5.24 -0.35 -0.34 0.28 2.81 -0.82 0.74 117.12 114.21 2ggf n MET 333 Ca -0.05 1.27 0.09 0.00 -1.81 0.00 0.00 57.70 57.20 2ggf n MET 333 Cb 0.34 -1.87 0.20 0.00 -0.71 0.00 0.00 33.22 31.18 2ggf n MET 333 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2ggf h LEU 334 N 0.00 -0.68 -1.17 4.03 5.85 -0.97 1.35 115.31 123.72 2ggf h LEU 334 Ca 0.15 0.28 -0.06 0.00 0.84 0.00 0.00 57.88 59.09 2ggf h LEU 334 Cb 0.36 0.53 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 2ggf h LEU 334 CO -0.79 -0.32 -0.11 -0.07 -0.34 0.00 0.00 178.44 176.80 2ggf h LEU 335 N 0.01 0.43 0.83 2.25 3.38 0.42 -1.97 115.31 120.66 2ggf h LEU 335 Ca 0.52 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.34 2ggf h LEU 335 Cb 0.93 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.57 2ggf h LEU 335 CO -0.94 0.58 -0.40 0.11 0.09 0.00 0.00 178.44 177.88 2ggf h LYS 336 N 0.41 -1.08 -0.51 1.13 1.79 0.29 -1.64 116.57 116.96 2ggf h LYS 336 Ca 0.08 0.07 0.03 0.00 -2.18 0.00 0.00 60.65 58.65 2ggf h LYS 336 Cb 0.45 0.25 -0.03 0.00 -1.58 0.00 0.00 32.23 31.32 2ggf h LYS 336 CO 0.03 -0.71 0.34 0.93 -1.08 0.00 0.00 179.45 178.95 2ggf h GLU 337 N -1.17 0.59 -0.65 3.15 5.08 -1.24 -0.97 114.58 119.37 2ggf h GLU 337 Ca -0.11 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 2ggf h GLU 337 Cb 0.86 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 2ggf h GLU 337 CO 0.19 0.39 0.27 -0.92 -1.00 0.00 0.00 179.01 177.94 2ggf h TYR 338 N 0.61 0.96 0.00 4.33 3.20 -1.14 0.16 116.97 125.08 2ggf h TYR 338 Ca 0.20 -0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.86 2ggf h TYR 338 Cb 0.07 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 2ggf h TYR 338 CO -0.00 0.73 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.42 2ggf h LEU 339 N 0.94 0.00 -0.06 2.82 3.38 -0.31 0.55 115.31 122.63 2ggf h LEU 339 Ca 0.22 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 2ggf h LEU 339 Cb 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2ggf h LEU 339 CO -0.02 0.76 -0.68 -0.07 0.09 0.00 0.00 178.44 178.51 2ggf h LEU 340 N 0.00 0.00 0.00 1.67 3.38 -0.69 -3.37 115.31 116.30 2ggf h LEU 340 Ca -0.01 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 2ggf h LEU 340 Cb 1.52 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.21 2ggf h LEU 340 CO 0.10 0.68 -2.51 -0.24 0.09 0.00 0.00 178.44 176.56 2ggf n SER 341 N -3.30 1.96 -0.52 -0.43 2.88 0.51 -5.05 113.62 109.67 2ggf n SER 341 Ca 0.01 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2ggf n SER 341 Cb 0.80 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2ggf n SER 341 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ggf n GLY 342 N 1.36 0.73 2.63 0.46 0.00 0.19 -5.07 105.19 105.49 2ggf n GLY 342 Ca -0.53 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.80 2ggf n GLY 342 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ggf s ASP 343 N -2.57 2.93 0.22 1.61 2.15 -1.24 -5.01 116.67 114.75 2ggf s ASP 343 Ca 0.00 -0.92 -0.09 0.00 0.43 0.00 0.00 52.55 51.97 2ggf s ASP 343 Cb 0.00 -0.40 0.24 0.00 -0.30 0.00 0.00 42.92 42.46 2ggf s ASP 343 CO 0.00 -0.37 1.84 0.40 -0.17 0.00 0.00 175.17 176.87 2ggf h ILE 344 N 6.44 1.05 -0.40 4.11 2.04 -1.97 -2.59 117.51 126.20 2ggf h ILE 344 Ca -0.16 -0.29 0.08 0.00 1.00 0.00 0.00 64.86 65.49 2ggf h ILE 344 Cb 1.09 0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 37.22 2ggf h ILE 344 CO 0.36 0.15 -0.17 -1.28 0.00 0.00 0.00 178.15 177.21 2ggf h SER 345 N 0.85 -0.60 0.11 1.72 0.87 -1.99 -0.23 113.55 114.27 2ggf h SER 345 Ca 0.31 0.15 0.02 0.00 -1.23 0.00 0.00 61.79 61.04 2ggf h SER 345 Cb 0.10 0.33 -0.05 0.00 -0.44 0.00 0.00 62.40 62.35 2ggf h SER 345 CO -0.14 -0.21 -0.39 -0.08 -0.53 0.00 0.00 176.83 175.48 2ggf h GLU 346 N -0.10 -0.59 -0.45 2.24 4.81 -1.90 -2.12 114.58 116.48 2ggf h GLU 346 Ca 0.19 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.55 2ggf h GLU 346 Cb 0.40 0.13 -0.08 0.00 0.63 0.00 0.00 28.75 29.83 2ggf h GLU 346 CO -0.46 -0.39 -0.07 0.00 -0.73 0.00 0.00 179.01 177.35 2ggf h ALA 347 N -0.06 0.34 -0.33 2.92 0.00 -1.25 -1.83 119.26 119.05 2ggf h ALA 347 Ca 0.03 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.16 2ggf h ALA 347 Cb 0.65 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 2ggf h ALA 347 CO -0.24 -0.43 -0.40 1.49 0.00 0.00 0.00 179.25 179.67 2ggf h GLU 348 N 0.03 -0.34 -0.78 0.00 4.81 -0.57 0.23 114.58 117.96 2ggf h GLU 348 Ca 0.22 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.58 2ggf h GLU 348 Cb 0.33 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.71 2ggf h GLU 348 CO -0.43 -0.23 0.40 1.25 -0.73 0.00 0.00 179.01 179.27 2ggf h HIS 349 N -0.36 0.71 -0.02 0.92 2.76 -0.83 -0.11 115.15 118.24 2ggf h HIS 349 Ca 0.13 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2ggf h HIS 349 Cb 0.58 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.34 2ggf h HIS 349 CO -0.57 0.24 0.01 0.00 -1.30 0.00 0.00 177.93 176.31 2ggf h LEU 351 N -0.06 -0.61 -0.86 0.00 5.85 0.05 -2.60 115.31 117.08 2ggf h LEU 351 Ca 0.01 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2ggf h LEU 351 Cb 0.09 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 2ggf h LEU 351 CO -0.00 -0.35 0.55 0.11 -0.34 0.00 0.00 178.44 178.41 2ggf h LYS 352 N -0.53 1.02 -0.82 1.25 1.57 -1.00 -1.44 116.57 116.62 2ggf h LYS 352 Ca -0.02 -0.06 0.18 0.00 -1.87 0.00 0.00 60.65 58.89 2ggf h LYS 352 Cb 0.47 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 2ggf h LYS 352 CO -0.02 0.68 0.55 0.93 -0.57 0.00 0.00 179.45 181.02 2ggf h GLU 353 N 1.05 0.33 0.00 3.15 4.39 -0.40 0.43 114.58 123.53 2ggf h GLU 353 Ca 0.35 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 60.00 2ggf h GLU 353 Cb 0.05 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2ggf h GLU 353 CO -0.13 0.22 -0.14 -0.07 -1.16 0.00 0.00 179.01 177.72 2ggf h LEU 354 N 0.34 0.00 -1.69 1.33 3.38 -0.90 -3.47 115.31 114.31 2ggf h LEU 354 Ca 0.41 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.90 2ggf h LEU 354 Cb 1.09 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.80 2ggf h LEU 354 CO -0.12 0.14 -0.85 -0.62 0.09 0.00 0.00 178.44 177.07 2ggf n GLU 355 N -3.59 -3.93 -3.56 1.13 1.02 0.15 -4.93 120.64 106.92 2ggf n GLU 355 Ca -0.01 0.48 -0.27 0.00 -0.02 0.00 0.00 57.16 57.33 2ggf n GLU 355 Cb 0.27 -4.86 -0.10 0.00 -0.02 0.00 0.00 31.44 26.73 2ggf n GLU 355 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2ggf n VAL 356 N -4.40 0.23 0.97 2.62 0.24 -1.26 -4.93 118.33 111.80 2ggf n VAL 356 Ca -0.23 -4.19 0.08 0.00 -2.04 0.00 0.00 64.34 57.96 2ggf n VAL 356 Cb 0.65 -1.92 0.46 0.00 -1.47 0.00 0.00 33.84 31.55 2ggf n VAL 356 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2ggf n PRO 357 N 2.16 0.49 -0.06 7.34 -0.04 -1.26 -2.52 135.00 141.11 2ggf n PRO 357 Ca 0.25 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.55 2ggf n PRO 357 Cb 0.43 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.25 2ggf n PRO 357 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2ggf n HIS 358 N -1.00 0.62 -0.28 0.54 1.44 -1.26 -4.24 115.22 111.04 2ggf n HIS 358 Ca 0.12 0.16 -0.10 0.00 -2.01 0.00 0.00 57.72 55.88 2ggf n HIS 358 Cb 0.05 -1.09 0.05 0.00 0.12 0.00 0.00 29.99 29.12 2ggf n HIS 358 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2ggf n PHE 359 N -3.22 1.10 -0.10 -1.40 3.72 -1.05 -4.15 117.46 112.36 2ggf n PHE 359 Ca -0.34 -1.34 -0.20 0.00 -0.05 0.00 0.00 57.45 55.52 2ggf n PHE 359 Cb 1.05 -0.66 -0.10 0.00 -0.94 0.00 0.00 39.48 38.83 2ggf n PHE 359 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 2ggf n HIS 360 N 0.29 0.89 -0.40 1.38 8.25 -1.26 -3.93 115.22 120.45 2ggf n HIS 360 Ca 0.21 0.39 0.35 0.00 -0.26 0.00 0.00 57.72 58.41 2ggf n HIS 360 Cb 0.73 -1.04 0.60 0.00 1.12 0.00 0.00 29.99 31.40 2ggf n HIS 360 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2ggf n HIS 361 N -4.44 0.75 0.15 4.41 -0.00 -1.26 0.18 115.22 115.02 2ggf n HIS 361 Ca -0.31 0.76 -0.11 0.00 -0.00 0.00 0.00 57.72 58.06 2ggf n HIS 361 Cb 0.65 -1.18 -0.07 0.00 -0.00 0.00 0.00 29.99 29.39 2ggf n HIS 361 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 2ggf h GLU 362 N 0.00 -0.42 -0.11 -1.40 4.57 -1.87 -3.21 114.58 112.14 2ggf h GLU 362 Ca 0.80 0.03 0.01 0.00 -1.18 0.00 0.00 59.36 59.02 2ggf h GLU 362 Cb 2.48 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 31.15 2ggf h GLU 362 CO -0.50 -0.11 -0.06 -0.11 -1.18 0.00 0.00 179.01 177.05 2ggf n LEU 363 N -5.09 -0.11 -0.39 1.64 7.94 0.13 -0.64 117.00 120.47 2ggf n LEU 363 Ca -0.08 0.90 -0.07 0.00 -1.11 0.00 0.00 56.01 55.64 2ggf n LEU 363 Cb 0.26 -0.38 -0.04 0.00 0.53 0.00 0.00 43.42 43.79 2ggf n LEU 363 CO 0.24 -0.51 0.53 0.58 -1.11 0.00 0.00 177.39 177.12 2ggf h VAL 364 N 0.00 0.00 -0.74 1.96 2.07 -1.65 0.38 116.25 118.28 2ggf h VAL 364 Ca 0.02 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.70 2ggf h VAL 364 Cb 0.04 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.69 2ggf h VAL 364 CO -0.10 0.00 0.04 0.22 0.02 0.00 0.00 177.57 177.75 2ggf h TYR 365 N -0.02 0.02 0.25 1.57 5.03 -0.88 -0.92 116.97 122.01 2ggf h TYR 365 Ca 0.23 0.05 -0.00 0.00 2.58 0.00 0.00 58.73 61.59 2ggf h TYR 365 Cb 0.49 0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.87 2ggf h TYR 365 CO -0.95 -0.21 -0.19 0.93 -1.32 0.00 0.00 178.16 176.42 2ggf h GLU 366 N 0.13 -0.43 -0.75 1.82 3.07 0.12 -2.30 114.58 116.25 2ggf h GLU 366 Ca 0.41 0.03 0.16 0.00 -0.50 0.00 0.00 59.36 59.46 2ggf h GLU 366 Cb 0.72 0.10 -0.14 0.00 -0.84 0.00 0.00 28.75 28.59 2ggf h GLU 366 CO -0.62 -0.29 -0.09 0.00 -1.40 0.00 0.00 179.01 176.61 2ggf h ALA 367 N 0.27 0.64 -0.83 3.43 0.00 0.06 0.36 119.26 123.18 2ggf h ALA 367 Ca -0.02 0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2ggf h ALA 367 Cb 0.39 0.49 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2ggf h ALA 367 CO -0.01 -0.42 0.55 0.82 0.00 0.00 0.00 179.25 180.19 2ggf h ILE 368 N 0.05 1.21 -0.71 0.00 2.04 -1.11 -2.00 117.51 117.00 2ggf h ILE 368 Ca 0.39 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 2ggf h ILE 368 Cb 0.64 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2ggf h ILE 368 CO -0.71 0.21 0.42 0.40 0.00 0.00 0.00 178.15 178.46 2ggf h ILE 369 N 1.13 1.20 -0.45 -0.67 1.08 0.24 -1.90 117.51 118.14 2ggf h ILE 369 Ca 0.30 -0.45 -0.06 0.00 -0.39 0.00 0.00 64.86 64.27 2ggf h ILE 369 Cb -0.13 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 33.81 2ggf h ILE 369 CO -0.07 0.21 0.05 0.24 -0.69 0.00 0.00 178.15 177.90 2ggf h MET 370 N 0.97 0.71 -0.27 2.37 2.86 -0.58 0.03 114.93 121.02 2ggf h MET 370 Ca 0.25 -0.16 -0.11 0.00 -2.06 0.00 0.00 59.70 57.63 2ggf h MET 370 Cb -0.03 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.53 2ggf h MET 370 CO -0.05 0.69 -0.26 0.28 1.06 0.00 0.00 176.91 178.63 2ggf h VAL 371 N 0.68 1.31 -0.43 -2.22 2.07 -1.18 0.12 116.25 116.60 2ggf h VAL 371 Ca 0.14 -1.43 -0.12 0.00 0.82 0.00 0.00 66.70 66.12 2ggf h VAL 371 Cb 0.34 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2ggf h VAL 371 CO 0.01 0.45 -0.19 -0.07 0.02 0.00 0.00 177.57 177.79 2ggf h LEU 372 N 0.39 0.91 -0.17 2.57 3.38 -1.17 -3.21 115.31 118.01 2ggf h LEU 372 Ca 0.04 -0.40 -0.10 0.00 0.09 0.00 0.00 57.88 57.52 2ggf h LEU 372 Cb 0.83 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2ggf h LEU 372 CO 0.07 1.11 -0.27 -0.33 0.09 0.00 0.00 178.44 179.10 2ggf h GLU 373 N 0.71 0.49 -6.47 1.13 5.08 -0.99 -3.45 114.58 111.08 2ggf h GLU 373 Ca 0.10 -0.30 -0.49 0.00 -1.00 0.00 0.00 59.36 57.67 2ggf h GLU 373 Cb 0.76 0.03 0.24 0.00 0.50 0.00 0.00 28.75 30.27 2ggf h GLU 373 CO 0.06 0.89 -1.44 -1.13 -1.00 0.00 0.00 179.01 176.39 2ggf n SER 374 N -4.39 -2.90 -0.03 1.42 3.41 0.43 -4.99 113.62 106.57 2ggf n SER 374 Ca -0.06 0.04 -0.07 0.00 -0.26 0.00 0.00 58.87 58.51 2ggf n SER 374 Cb 0.45 -0.88 -0.02 0.00 -0.26 0.00 0.00 64.21 63.50 2ggf n SER 374 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2ggf n THR 375 N -3.82 0.57 -1.79 6.66 -2.24 -1.26 -4.97 114.28 107.43 2ggf n THR 375 Ca 0.01 -0.03 -0.29 0.00 -2.27 0.00 0.00 64.05 61.46 2ggf n THR 375 Cb 0.63 -1.64 0.08 0.00 -2.10 0.00 0.00 70.33 67.30 2ggf n THR 375 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2ggf s GLY 376 N -4.99 1.60 -0.12 3.38 0.00 -1.26 -4.93 107.32 101.01 2ggf s GLY 376 Ca -0.10 -0.47 -0.01 0.00 0.00 0.00 0.00 44.72 44.14 2ggf s GLY 376 CO 0.13 -0.02 2.10 -1.84 0.00 0.00 0.00 173.10 173.47 2ggf n GLU 377 N -3.31 1.36 -0.08 2.90 0.28 -1.26 -4.14 120.64 116.39 2ggf n GLU 377 Ca 0.07 -0.64 -0.08 0.00 -0.16 0.00 0.00 57.16 56.35 2ggf n GLU 377 Cb 0.59 -1.28 -0.03 0.00 1.43 0.00 0.00 31.44 32.15 2ggf n GLU 377 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2ggf n SER 378 N 1.13 1.69 0.09 -1.84 7.64 -1.26 -4.23 113.62 116.83 2ggf n SER 378 Ca 0.13 0.29 0.19 0.00 1.01 0.00 0.00 58.87 60.49 2ggf n SER 378 Cb 0.55 -0.70 0.74 0.00 -1.01 0.00 0.00 64.21 63.79 2ggf n SER 378 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2ggf h THR 379 N -0.85 0.60 0.04 0.44 2.02 -1.92 -1.28 112.91 111.96 2ggf h THR 379 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2ggf h THR 379 Cb 0.85 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2ggf h THR 379 CO 0.00 0.00 -0.02 0.15 0.37 0.00 0.00 175.52 176.02 2ggf h PHE 380 N 0.00 -0.05 0.30 3.16 3.04 -1.80 -0.30 116.94 121.29 2ggf h PHE 380 Ca 0.18 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.12 2ggf h PHE 380 Cb 0.84 0.02 0.00 0.00 2.56 0.00 0.00 35.95 39.37 2ggf h PHE 380 CO 0.00 0.19 -0.14 -0.22 -2.02 0.00 0.00 178.31 176.12 2ggf h LYS 381 N -0.29 -0.39 0.18 1.11 3.64 -1.47 -0.76 116.57 118.60 2ggf h LYS 381 Ca -0.01 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2ggf h LYS 381 Cb 0.26 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 2ggf h LYS 381 CO 0.01 -0.06 -0.35 0.52 -2.27 0.00 0.00 179.45 177.30 2ggf h MET 382 N -0.77 -0.55 -0.55 1.90 2.86 -1.35 0.80 114.93 117.27 2ggf h MET 382 Ca -0.04 0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.74 2ggf h MET 382 Cb 0.51 0.12 -0.08 0.00 0.06 0.00 0.00 31.60 32.21 2ggf h MET 382 CO 0.07 -0.36 0.09 0.82 1.06 0.00 0.00 176.91 178.58 2ggf h ILE 383 N -0.57 0.65 0.01 -1.22 1.08 -1.15 0.83 117.51 117.14 2ggf h ILE 383 Ca -0.02 -0.07 0.03 0.00 -0.39 0.00 0.00 64.86 64.41 2ggf h ILE 383 Cb 0.54 0.41 -0.05 0.00 -3.07 0.00 0.00 36.82 34.65 2ggf h ILE 383 CO -0.14 0.04 -0.31 0.25 -0.69 0.00 0.00 178.15 177.30 2ggf h LEU 384 N 0.22 -0.93 -0.86 1.44 5.85 -0.77 -1.93 115.31 118.33 2ggf h LEU 384 Ca 0.29 0.12 0.02 0.00 0.84 0.00 0.00 57.88 59.15 2ggf h LEU 384 Cb 0.42 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.77 2ggf h LEU 384 CO -0.39 -0.38 0.56 -0.78 -0.34 0.00 0.00 178.44 177.12 2ggf h ASP 385 N -0.47 0.96 -0.01 1.25 1.82 -0.25 -2.25 116.42 117.47 2ggf h ASP 385 Ca 0.06 -0.02 0.02 0.00 -0.39 0.00 0.00 57.03 56.70 2ggf h ASP 385 Cb 0.55 -0.23 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 2ggf h ASP 385 CO -0.26 0.68 -0.38 0.25 -1.61 0.00 0.00 179.24 177.92 2ggf h LEU 386 N 1.13 -1.19 -0.43 2.28 5.85 -0.12 0.27 115.31 123.11 2ggf h LEU 386 Ca 0.33 0.13 0.07 0.00 0.84 0.00 0.00 57.88 59.26 2ggf h LEU 386 Cb -0.07 0.45 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2ggf h LEU 386 CO -0.09 -0.37 0.05 -0.07 -0.34 0.00 0.00 178.44 177.62 2ggf h LEU 387 N -0.47 -0.07 0.00 2.25 3.38 -1.30 -1.69 115.31 117.41 2ggf h LEU 387 Ca 0.01 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ggf h LEU 387 Cb 0.51 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2ggf h LEU 387 CO -0.26 -0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.56 2ggf n LYS 388 N -5.15 0.00 -0.13 1.13 5.02 -0.86 -0.14 118.16 118.03 2ggf n LYS 388 Ca 0.03 0.70 -0.08 0.00 -2.02 0.00 0.00 58.31 56.94 2ggf n LYS 388 Cb 0.21 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.70 2ggf n LYS 388 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 2ggf h SER 389 N 0.00 -1.18 -0.80 4.39 0.02 -0.88 0.20 113.55 115.30 2ggf h SER 389 Ca 0.00 0.16 0.15 0.00 -0.84 0.00 0.00 61.79 61.27 2ggf h SER 389 Cb 0.00 0.50 -0.15 0.00 0.14 0.00 0.00 62.40 62.89 2ggf h SER 389 CO 0.00 -0.21 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.17 2ggf h LEU 390 N -0.17 -0.86 0.46 5.07 3.38 -1.25 0.40 115.31 122.34 2ggf h LEU 390 Ca 0.06 0.25 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2ggf h LEU 390 Cb 0.33 0.53 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2ggf h LEU 390 CO -0.42 -0.27 -0.28 -0.25 0.09 0.00 0.00 178.44 177.31 2ggf h TRP 391 N -0.02 -0.73 0.00 1.13 7.01 0.11 -1.77 115.95 121.67 2ggf h TRP 391 Ca 0.37 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.36 2ggf h TRP 391 Cb 0.59 0.26 0.00 0.00 -2.10 0.00 0.00 29.16 27.91 2ggf h TRP 391 CO -0.66 -0.41 0.25 0.87 -2.79 0.00 0.00 178.44 175.70 2ggf h LYS 392 N -0.69 0.00 -1.23 2.65 6.56 0.05 -0.52 116.57 123.39 2ggf h LYS 392 Ca -0.06 0.00 -0.32 0.00 -1.06 0.00 0.00 60.65 59.21 2ggf h LYS 392 Cb 0.55 0.00 -0.16 0.00 -0.57 0.00 0.00 32.23 32.05 2ggf h LYS 392 CO 0.07 0.00 0.41 0.45 -2.06 0.00 0.00 179.45 178.32 2ggf n SER 393 N -2.34 5.01 -4.43 0.86 2.88 0.13 -4.84 113.62 110.89 2ggf n SER 393 Ca -0.01 -3.00 -0.39 0.00 -1.33 0.00 0.00 58.87 54.14 2ggf n SER 393 Cb 0.28 -0.87 -0.08 0.00 -0.75 0.00 0.00 64.21 62.79 2ggf n SER 393 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ggf n SER 394 N -0.08 -1.02 -0.06 -3.46 2.88 -0.21 -4.77 113.62 106.90 2ggf n SER 394 Ca 0.33 -1.23 -0.05 0.00 -1.33 0.00 0.00 58.87 56.58 2ggf n SER 394 Cb 0.86 -1.56 -0.09 0.00 -0.75 0.00 0.00 64.21 62.66 2ggf n SER 394 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2ggf n THR 395 N -4.13 0.76 -4.06 2.46 -1.04 -1.00 -5.01 114.28 102.26 2ggf n THR 395 Ca -0.01 -0.49 -0.15 0.00 -2.04 0.00 0.00 64.05 61.37 2ggf n THR 395 Cb 0.51 -0.64 -0.14 0.00 -1.82 0.00 0.00 70.33 68.23 2ggf n THR 395 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2ggf s ILE 396 N -2.31 0.28 0.29 12.58 1.01 -1.25 -4.97 121.20 126.82 2ggf s ILE 396 Ca -0.06 -0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.52 2ggf s ILE 396 Cb 0.04 -0.25 -0.02 0.00 0.01 0.00 0.00 42.46 42.23 2ggf s ILE 396 CO 0.48 0.09 0.36 0.28 0.00 0.00 0.00 174.94 176.15 2ggf s THR 397 N 0.00 4.52 0.05 2.92 -1.32 -1.26 -4.73 115.64 115.82 2ggf s THR 397 Ca 0.00 -1.10 -0.15 0.00 -1.21 0.00 0.00 61.69 59.23 2ggf s THR 397 Cb -0.02 -3.55 -0.07 0.00 -1.51 0.00 0.00 72.50 67.35 2ggf s THR 397 CO -0.00 -0.26 1.25 0.58 -2.21 0.00 0.00 174.62 173.98 2ggf h VAL 398 N 1.13 0.00 -0.38 5.08 2.07 -1.97 -1.05 116.25 121.14 2ggf h VAL 398 Ca -0.48 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.07 2ggf h VAL 398 Cb 1.24 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2ggf h VAL 398 CO 0.58 0.00 -0.23 -0.67 0.02 0.00 0.00 177.57 177.27 2ggf n ASP 399 N -3.78 -0.41 0.01 0.57 -0.08 -1.26 0.20 116.55 111.80 2ggf n ASP 399 Ca -0.04 1.00 -0.01 0.00 -1.51 0.00 0.00 54.79 54.23 2ggf n ASP 399 Cb 0.18 -0.25 -0.01 0.00 2.34 0.00 0.00 41.12 43.39 2ggf n ASP 399 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 2ggf h GLN 400 N 0.00 -0.06 0.00 -0.67 4.20 -1.94 -0.04 115.11 116.60 2ggf h GLN 400 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2ggf h GLN 400 Cb 0.16 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2ggf h GLN 400 CO -0.36 -0.04 0.36 1.98 -0.67 0.00 0.00 178.83 180.10 2ggf h MET 401 N -0.06 0.00 0.73 1.46 4.05 -0.18 -2.07 114.93 118.86 2ggf h MET 401 Ca -0.00 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 2ggf h MET 401 Cb 0.06 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 30.86 2ggf h MET 401 CO -0.02 0.00 -0.35 -0.22 0.23 0.00 0.00 176.91 176.55 2ggf h LYS 402 N 0.00 -0.94 -0.80 0.39 3.64 0.43 -3.21 116.57 116.08 2ggf h LYS 402 Ca 0.00 0.06 0.11 0.00 -1.27 0.00 0.00 60.65 59.55 2ggf h LYS 402 Cb 0.72 0.21 -0.13 0.00 -0.41 0.00 0.00 32.23 32.63 2ggf h LYS 402 CO 0.00 -0.63 -0.45 0.00 -2.27 0.00 0.00 179.45 176.10 2ggf h ARG 403 N -1.04 -0.10 -0.02 1.90 2.47 -1.25 -2.32 114.38 114.02 2ggf h ARG 403 Ca -0.10 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 2ggf h ARG 403 Cb 0.75 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.09 2ggf h ARG 403 CO 0.16 -0.07 -0.01 0.41 0.56 0.00 0.00 179.97 181.02 2ggf n GLY 404 N -1.40 -2.18 0.35 0.04 0.00 -1.21 -0.01 105.19 100.78 2ggf n GLY 404 Ca 0.05 0.42 -0.09 0.00 0.00 0.00 0.00 46.02 46.40 2ggf n GLY 404 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ggf h TYR 405 N 0.00 -1.00 -0.12 1.61 0.05 -1.46 -2.61 116.97 113.43 2ggf h TYR 405 Ca 0.00 0.06 0.02 0.00 0.05 0.00 0.00 58.73 58.86 2ggf h TYR 405 Cb 0.01 0.49 -0.04 0.00 1.01 0.00 0.00 36.73 38.19 2ggf h TYR 405 CO -0.66 -0.41 -0.31 0.93 -1.05 0.00 0.00 178.16 176.67 2ggf h GLU 406 N -0.32 -0.29 -0.85 4.88 5.08 -0.50 -0.72 114.58 121.87 2ggf h GLU 406 Ca 0.14 0.02 0.26 0.00 -1.00 0.00 0.00 59.36 58.78 2ggf h GLU 406 Cb 0.56 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 29.72 2ggf h GLU 406 CO -0.50 -0.19 0.11 0.54 -1.00 0.00 0.00 179.01 177.97 2ggf n ARG 407 N -4.19 -0.06 0.07 2.33 3.00 0.99 0.92 116.66 119.72 2ggf n ARG 407 Ca -0.03 1.25 -0.13 0.00 -0.01 0.00 0.00 57.85 58.93 2ggf n ARG 407 Cb 0.21 -2.04 -0.08 0.00 0.00 0.00 0.00 32.46 30.55 2ggf n ARG 407 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2ggf h ILE 408 N 0.00 0.97 -0.92 0.55 1.08 -0.81 0.83 117.51 119.22 2ggf h ILE 408 Ca 0.56 -0.24 0.16 0.00 -0.39 0.00 0.00 64.86 64.96 2ggf h ILE 408 Cb 1.25 1.13 -0.10 0.00 -3.07 0.00 0.00 36.82 36.03 2ggf h ILE 408 CO -0.77 0.06 0.51 1.88 -0.69 0.00 0.00 178.15 179.14 2ggf h TYR 409 N -0.23 0.90 0.00 1.37 0.05 0.14 1.23 116.97 120.42 2ggf h TYR 409 Ca -0.01 0.03 -0.21 0.00 0.05 0.00 0.00 58.73 58.59 2ggf h TYR 409 Cb 0.19 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.64 2ggf h TYR 409 CO -0.04 0.21 -1.09 -0.91 -1.05 0.00 0.00 178.16 175.28 2ggf h ASN 410 N 0.69 0.00 -0.65 3.88 2.35 -1.02 -3.26 115.58 117.57 2ggf h ASN 410 Ca 0.51 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.17 2ggf h ASN 410 Cb 0.74 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.06 2ggf h ASN 410 CO -0.37 0.93 0.11 -0.62 -1.65 0.00 0.00 177.43 175.83 2ggf n GLU 411 N -3.26 4.48 0.13 0.81 1.02 0.29 -4.35 120.64 119.76 2ggf n GLU 411 Ca -0.03 -3.15 -0.00 0.00 -0.02 0.00 0.00 57.16 53.95 2ggf n GLU 411 Cb 0.93 -2.26 0.13 0.00 -0.02 0.00 0.00 31.44 30.23 2ggf n GLU 411 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 2ggf h ILE 412 N 3.51 1.31 0.37 -3.67 6.09 0.14 -3.32 117.51 121.93 2ggf h ILE 412 Ca 0.11 -2.27 -0.01 0.00 -1.37 0.00 0.00 64.86 61.31 2ggf h ILE 412 Cb 2.14 2.28 -0.01 0.00 0.47 0.00 0.00 36.82 41.70 2ggf h ILE 412 CO 0.60 0.62 -0.32 -0.65 -3.07 0.00 0.00 178.15 175.33 2ggf h PRO 413 N 0.00 -0.65 -0.04 2.19 0.11 -1.84 0.74 132.00 132.52 2ggf h PRO 413 Ca -0.01 0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.16 2ggf h PRO 413 Cb 1.23 0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.48 2ggf h PRO 413 CO 0.08 -0.43 0.37 -0.44 -0.21 0.00 0.00 178.00 177.38 2ggf h ASP 414 N -0.67 0.00 0.65 -2.05 3.32 -1.90 0.43 116.42 116.20 2ggf h ASP 414 Ca -0.05 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.74 2ggf h ASP 414 Cb 0.57 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.08 2ggf h ASP 414 CO -0.01 0.00 -1.46 0.40 -1.72 0.00 0.00 179.24 176.45 2ggf h ILE 415 N 0.00 1.17 0.00 0.35 2.04 -1.42 -3.28 117.51 116.36 2ggf h ILE 415 Ca 0.02 -2.95 0.00 0.00 1.00 0.00 0.00 64.86 62.93 2ggf h ILE 415 Cb 0.77 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.45 2ggf h ILE 415 CO -0.00 0.69 0.00 -0.46 0.00 0.00 0.00 178.15 178.38 2ggf n ASN 416 N -3.20 0.00 0.30 1.72 0.23 0.15 -0.99 115.26 113.48 2ggf n ASN 416 Ca -0.11 0.31 -0.13 0.00 -0.53 0.00 0.00 54.58 54.12 2ggf n ASN 416 Cb 1.01 -0.39 -0.06 0.00 -2.08 0.00 0.00 39.78 38.26 2ggf n ASN 416 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2ggf h LEU 417 N 0.00 -0.69 0.08 -4.53 -0.00 -1.61 -3.35 115.31 105.21 2ggf h LEU 417 Ca 0.00 0.01 -0.35 0.00 -0.00 0.00 0.00 57.88 57.54 2ggf h LEU 417 Cb 0.13 0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 40.94 2ggf h LEU 417 CO 0.00 -0.30 -2.02 0.47 -0.00 0.00 0.00 178.44 176.59 2ggf n ASP 418 N -5.32 1.74 -4.19 -0.43 8.00 -1.18 -4.71 116.55 110.45 2ggf n ASP 418 Ca -0.10 0.20 -0.41 0.00 0.71 0.00 0.00 54.79 55.19 2ggf n ASP 418 Cb 0.33 -0.55 -0.07 0.00 -0.02 0.00 0.00 41.12 40.81 2ggf n ASP 418 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ggf s VAL 419 N -2.56 4.34 -0.02 2.53 1.01 -0.16 -4.94 120.40 120.60 2ggf s VAL 419 Ca -0.20 -2.40 -0.24 0.00 0.00 0.00 0.00 61.98 59.15 2ggf s VAL 419 Cb 0.07 -3.80 -0.17 0.00 0.00 0.00 0.00 36.38 32.48 2ggf s VAL 419 CO 0.76 -0.87 1.11 1.55 0.00 0.00 0.00 175.10 177.65 2ggf h PRO 420 N 7.75 -0.23 0.00 2.72 0.13 -1.78 -3.01 132.00 137.58 2ggf h PRO 420 Ca -0.06 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2ggf h PRO 420 Cb 1.02 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2ggf h PRO 420 CO 0.78 0.17 0.06 -2.39 -0.23 0.00 0.00 178.00 176.38 2ggf n HIS 421 N -4.99 0.34 -0.29 1.56 1.44 -1.26 -3.07 115.22 108.96 2ggf n HIS 421 Ca -0.09 0.18 0.12 0.00 -2.01 0.00 0.00 57.72 55.92 2ggf n HIS 421 Cb 0.26 -0.74 0.23 0.00 0.12 0.00 0.00 29.99 29.86 2ggf n HIS 421 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2ggf n SER 422 N -1.84 -0.12 0.20 4.39 3.41 -1.14 -0.21 113.62 118.31 2ggf n SER 422 Ca -0.01 1.43 -0.15 0.00 -0.26 0.00 0.00 58.87 59.88 2ggf n SER 422 Cb 0.07 -0.51 -0.08 0.00 -0.26 0.00 0.00 64.21 63.43 2ggf n SER 422 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2ggf h TYR 423 N 0.00 -1.21 0.14 7.33 -1.99 -1.80 0.19 116.97 119.62 2ggf h TYR 423 Ca 0.50 0.02 0.01 0.00 2.00 0.00 0.00 58.73 61.25 2ggf h TYR 423 Cb 1.00 0.49 -0.01 0.00 2.00 0.00 0.00 36.73 40.21 2ggf h TYR 423 CO -0.45 -0.54 -0.15 0.77 -0.00 0.00 0.00 178.16 177.79 2ggf h SER 424 N -0.78 -0.39 -0.97 3.88 0.02 -0.86 -1.59 113.55 112.86 2ggf h SER 424 Ca -0.04 0.04 0.22 0.00 -0.84 0.00 0.00 61.79 61.17 2ggf h SER 424 Cb 0.70 0.14 -0.08 0.00 0.14 0.00 0.00 62.40 63.30 2ggf h SER 424 CO -0.11 -0.22 0.62 0.58 -1.14 0.00 0.00 176.83 176.56 2ggf h VAL 425 N -0.32 0.64 -0.21 2.27 2.07 -0.53 -0.14 116.25 120.03 2ggf h VAL 425 Ca 0.01 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 2ggf h VAL 425 Cb 0.31 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2ggf h VAL 425 CO -0.05 0.09 -0.19 0.25 0.02 0.00 0.00 177.57 177.69 2ggf h LEU 426 N 0.47 0.53 -1.29 2.57 5.85 0.07 -2.15 115.31 121.37 2ggf h LEU 426 Ca 0.53 -0.47 0.10 0.00 0.84 0.00 0.00 57.88 58.88 2ggf h LEU 426 Cb 1.22 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.04 2ggf h LEU 426 CO -0.25 0.89 0.55 -0.08 -0.34 0.00 0.00 178.44 179.21 2ggf h GLU 427 N 0.18 0.75 0.15 1.25 4.81 -0.11 0.11 114.58 121.73 2ggf h GLU 427 Ca 0.04 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2ggf h GLU 427 Cb 0.73 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2ggf h GLU 427 CO 0.05 0.50 -0.07 -0.09 -0.73 0.00 0.00 179.01 178.66 2ggf h ARG 428 N 0.77 -0.19 -0.31 1.92 2.43 -1.30 -2.56 114.38 115.15 2ggf h ARG 428 Ca 0.40 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.63 2ggf h ARG 428 Cb 0.48 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.03 2ggf h ARG 428 CO -0.16 0.25 -0.00 0.35 -1.51 0.00 0.00 179.97 178.90 2ggf h PHE 429 N -0.79 -0.02 -0.40 2.20 3.04 -1.02 -2.32 116.94 117.63 2ggf h PHE 429 Ca -0.02 0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.01 2ggf h PHE 429 Cb 0.53 0.05 -0.05 0.00 2.56 0.00 0.00 35.95 39.05 2ggf h PHE 429 CO 0.09 -0.05 0.11 0.28 -2.02 0.00 0.00 178.31 176.71 2ggf h VAL 430 N 0.09 0.83 -0.18 1.41 2.07 -0.88 -2.01 116.25 117.58 2ggf h VAL 430 Ca 0.15 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.61 2ggf h VAL 430 Cb 0.20 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 2ggf h VAL 430 CO -0.25 0.05 -0.50 -0.08 0.02 0.00 0.00 177.57 176.81 2ggf h GLU 431 N 0.25 -0.48 -0.54 1.57 4.22 -0.98 -1.09 114.58 117.53 2ggf h GLU 431 Ca 0.19 0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.76 2ggf h GLU 431 Cb 0.21 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 2ggf h GLU 431 CO -0.23 -0.32 0.06 0.93 -2.18 0.00 0.00 179.01 177.28 2ggf h GLU 432 N -0.50 0.18 -0.22 1.92 4.39 -1.29 -1.93 114.58 117.13 2ggf h GLU 432 Ca 0.04 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.77 2ggf h GLU 432 Cb 0.61 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.14 2ggf h GLU 432 CO -0.43 0.12 -0.45 0.00 -1.16 0.00 0.00 179.01 177.08 2ggf h PHE 434 N -0.46 -0.21 -0.74 0.00 3.57 -0.70 -0.42 116.94 117.97 2ggf h PHE 434 Ca 0.08 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.70 2ggf h PHE 434 Cb 0.63 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2ggf h PHE 434 CO -0.55 -0.16 0.49 1.96 -2.23 0.00 0.00 178.31 177.81 2ggf h GLN 435 N -0.01 0.66 0.00 1.11 1.08 -0.59 0.59 115.11 117.96 2ggf h GLN 435 Ca 0.17 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.29 2ggf h GLN 435 Cb 0.27 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 2ggf h GLN 435 CO -0.37 0.44 -0.20 0.00 -0.95 0.00 0.00 178.83 177.76 2ggf h ALA 436 N 1.62 1.32 -1.49 3.87 0.00 0.93 -3.47 119.26 122.04 2ggf h ALA 436 Ca 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ggf h ALA 436 Cb 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2ggf h ALA 436 CO -0.12 0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.79 2ggf n GLY 437 N -0.57 0.68 0.00 0.00 0.00 0.20 -5.03 105.19 100.47 2ggf n GLY 437 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2ggf n GLY 437 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ggf n ILE 438 N -0.74 0.00 -3.81 -0.61 -5.35 -1.23 -4.89 119.36 102.72 2ggf n ILE 438 Ca 0.00 0.00 -0.20 0.00 -0.27 0.00 0.00 62.75 62.28 2ggf n ILE 438 Cb 0.30 -0.53 -0.00 0.00 -1.74 0.00 0.00 39.64 37.67 2ggf n ILE 438 CO 0.00 0.00 0.00 2.30 -1.76 0.00 0.00 176.55 177.09 2ggf n ILE 439 N -1.81 0.00 -4.11 7.28 -5.35 -1.26 -4.62 119.36 109.49 2ggf n ILE 439 Ca 0.00 -1.63 -0.23 0.00 -0.27 0.00 0.00 62.75 60.61 2ggf n ILE 439 Cb 0.34 -0.13 -0.06 0.00 -1.74 0.00 0.00 39.64 38.05 2ggf n ILE 439 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2ggf s SER 440 N -3.40 4.65 0.52 7.28 1.04 -1.26 -4.87 113.70 117.66 2ggf s SER 440 Ca 0.22 -0.79 0.21 0.00 0.48 0.00 0.00 55.95 56.07 2ggf s SER 440 Cb -0.02 -0.71 1.37 0.00 0.10 0.00 0.00 66.02 66.76 2ggf s SER 440 CO 0.14 -0.30 2.12 0.11 0.98 0.00 0.00 173.24 176.29 2ggf h LYS 441 N 1.56 0.00 -0.49 4.02 1.79 -1.99 -2.41 116.57 119.05 2ggf h LYS 441 Ca -0.44 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.06 2ggf h LYS 441 Cb 1.25 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.87 2ggf h LYS 441 CO 0.64 0.07 0.27 0.37 -1.08 0.00 0.00 179.45 179.72 2ggf h GLN 442 N 0.00 0.53 0.02 3.15 4.15 -1.99 -1.27 115.11 119.69 2ggf h GLN 442 Ca -0.00 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 2ggf h GLN 442 Cb 0.14 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2ggf h GLN 442 CO 0.01 0.35 -0.01 -0.07 -1.93 0.00 0.00 178.83 177.18 2ggf h LEU 443 N 0.54 -0.02 -1.46 -2.39 3.38 -1.85 -1.65 115.31 111.86 2ggf h LEU 443 Ca 0.20 -0.51 0.24 0.00 0.09 0.00 0.00 57.88 57.91 2ggf h LEU 443 Cb 0.05 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 2ggf h LEU 443 CO -0.11 0.50 0.65 -0.09 0.09 0.00 0.00 178.44 179.48 2ggf h ARG 444 N -0.55 0.37 0.13 1.13 2.43 -1.35 0.16 114.38 116.69 2ggf h ARG 444 Ca -0.00 -0.02 -0.28 0.00 -0.81 0.00 0.00 59.98 58.87 2ggf h ARG 444 Cb 0.53 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2ggf h ARG 444 CO 0.00 0.24 -1.24 0.22 -1.51 0.00 0.00 179.97 177.68 2ggf h ASP 445 N 0.38 0.52 -1.00 -3.80 1.82 -1.18 -3.29 116.42 109.87 2ggf h ASP 445 Ca 0.54 -0.54 0.10 0.00 -0.39 0.00 0.00 57.03 56.74 2ggf h ASP 445 Cb 1.40 -0.17 -0.08 0.00 0.68 0.00 0.00 39.33 41.17 2ggf h ASP 445 CO -0.23 1.41 0.64 -0.07 -1.61 0.00 0.00 179.24 179.38 2ggf h LEU 446 N 0.11 0.98 -8.56 2.28 3.38 0.29 -3.43 115.31 110.36 2ggf h LEU 446 Ca -0.15 0.03 -0.83 0.00 0.09 0.00 0.00 57.88 57.02 2ggf h LEU 446 Cb 1.95 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 42.55 2ggf h LEU 446 CO 0.21 0.56 0.60 0.00 0.09 0.00 0.00 178.44 179.91 2ggf s PRO 448 N 2.58 4.41 -0.04 0.00 0.04 -1.26 -5.04 135.00 135.70 2ggf s PRO 448 Ca 0.99 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 64.06 2ggf s PRO 448 Cb -1.41 -3.18 0.03 0.00 0.04 0.00 0.00 34.50 29.99 2ggf s PRO 448 CO 0.76 -0.19 0.05 -1.54 0.04 0.00 0.00 177.00 176.11 2ggf s SER 449 N 0.09 0.94 0.51 6.66 1.04 -1.26 -4.84 113.70 116.84 2ggf s SER 449 Ca 0.54 0.06 0.04 0.00 0.48 0.00 0.00 55.95 57.07 2ggf s SER 449 Cb -0.36 -0.15 -0.00 0.00 0.10 0.00 0.00 66.02 65.60 2ggf s SER 449 CO 0.41 -0.22 0.18 -0.13 0.98 0.00 0.00 173.24 174.46 2ggf s ARG 450 N 1.91 2.21 0.01 4.02 3.00 -1.26 -5.16 118.95 123.68 2ggf s ARG 450 Ca 0.02 -2.17 -0.00 0.00 0.00 0.00 0.00 55.73 53.58 2ggf s ARG 450 Cb -0.12 -1.81 -0.01 0.00 0.00 0.00 0.00 34.95 33.01 2ggf s ARG 450 CO -0.03 -0.41 -0.01 0.45 0.00 0.00 0.00 175.30 175.30 2ggf s SER 451 N -4.02 0.09 0.00 0.23 0.15 -1.26 -5.10 113.70 103.79 2ggf s SER 451 Ca 0.22 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2ggf s SER 451 Cb 0.01 0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.36 2ggf s SER 451 CO 0.13 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2ggf n GLY 452 N 2.47 4.40 3.55 9.45 0.00 -1.26 -5.08 105.19 118.72 2ggf n GLY 452 Ca -0.17 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.82 2ggf n GLY 452 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ggf s PRO 453 N -1.28 2.61 -0.31 1.61 0.04 -1.26 -4.95 135.00 131.47 2ggf s PRO 453 Ca 0.00 0.42 -0.02 0.00 0.04 0.00 0.00 61.00 61.44 2ggf s PRO 453 Cb 0.00 -4.53 0.06 0.00 0.04 0.00 0.00 34.50 30.06 2ggf s PRO 453 CO 0.00 -2.87 0.02 0.45 0.04 0.00 0.00 177.00 174.63 2ggf s SER 454 N 8.10 4.91 -0.36 6.66 0.15 -1.26 -5.06 113.70 126.84 2ggf s SER 454 Ca 0.68 -1.37 -0.28 0.00 0.70 0.00 0.00 55.95 55.67 2ggf s SER 454 Cb -0.11 -1.72 -0.02 0.00 -1.71 0.00 0.00 66.02 62.46 2ggf s SER 454 CO 0.16 -0.29 1.80 -0.44 1.20 0.00 0.00 173.24 175.67 2ggf s SER 455 N 1.29 5.84 0.00 5.45 0.01 -1.26 -5.31 113.70 119.72 2ggf s SER 455 Ca -0.04 1.20 0.26 0.00 1.31 0.00 0.00 55.95 58.68 2ggf s SER 455 Cb -0.20 -2.53 1.54 0.00 0.21 0.00 0.00 66.02 65.04 2ggf s SER 455 CO -0.02 -1.77 1.89 0.61 0.41 0.00 0.00 173.24 174.37