#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ggf n SER 321 N 0.00 -4.51 -0.07 1.61 2.88 -1.26 -4.96 113.62 107.31 2ggf n SER 321 Ca 0.00 -0.44 -0.10 0.00 -1.33 0.00 0.00 58.87 57.00 2ggf n SER 321 Cb 0.00 -4.08 -0.07 0.00 -0.75 0.00 0.00 64.21 59.31 2ggf n SER 321 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2ggf h SER 322 N -1.96 0.00 -1.25 -3.46 0.87 -2.12 -3.46 113.55 102.17 2ggf h SER 322 Ca -0.45 -0.44 -0.78 0.00 -1.23 0.00 0.00 61.79 58.89 2ggf h SER 322 Cb 1.28 0.00 0.04 0.00 -0.44 0.00 0.00 62.40 63.28 2ggf h SER 322 CO 0.43 0.90 0.44 0.61 -0.53 0.00 0.00 176.83 178.68 2ggf n GLY 323 N 1.63 0.20 3.55 5.77 0.00 -1.26 -4.78 105.19 110.30 2ggf n GLY 323 Ca -0.11 0.83 -0.38 0.00 0.00 0.00 0.00 46.02 46.36 2ggf n GLY 323 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ggf s SER 324 N 1.41 5.21 0.28 1.61 0.15 -1.26 -4.94 113.70 116.15 2ggf s SER 324 Ca 0.94 0.44 -0.30 0.00 0.70 0.00 0.00 55.95 57.73 2ggf s SER 324 Cb -1.21 -2.53 -0.12 0.00 -1.71 0.00 0.00 66.02 60.45 2ggf s SER 324 CO 0.62 -2.40 1.60 -1.54 1.20 0.00 0.00 173.24 172.72 2ggf n SER 325 N 12.98 3.80 0.00 5.45 3.41 -1.26 -4.82 113.62 133.17 2ggf n SER 325 Ca 0.22 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.96 2ggf n SER 325 Cb 0.52 -1.58 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 2ggf n SER 325 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ggf n GLY 326 N 2.44 1.17 0.79 5.00 0.00 -1.26 -5.10 105.19 108.22 2ggf n GLY 326 Ca 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.63 -0.25 0.99 4.32 -1.26 -4.75 117.00 116.67 2ggf n LEU 327 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.96 2ggf n LEU 327 Cb 0.00 -0.01 0.07 0.00 -1.62 0.00 0.00 43.42 41.86 2ggf n LEU 327 CO 0.00 0.11 1.15 1.62 -1.22 0.00 0.00 177.39 179.05 2ggf h VAL 328 N -0.01 1.12 -0.88 4.08 3.04 -2.02 -2.55 116.25 119.02 2ggf h VAL 328 Ca -0.01 -0.30 0.23 0.00 -1.01 0.00 0.00 66.70 65.61 2ggf h VAL 328 Cb 1.01 0.15 -0.15 0.00 -2.01 0.00 0.00 31.29 30.29 2ggf h VAL 328 CO -0.01 0.16 0.10 0.50 -1.01 0.00 0.00 177.57 177.31 2ggf h LYS 329 N 0.89 0.10 -0.76 4.17 3.64 -2.00 0.12 116.57 122.72 2ggf h LYS 329 Ca 0.28 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.80 2ggf h LYS 329 Cb -0.01 -0.02 -0.14 0.00 -0.41 0.00 0.00 32.23 31.64 2ggf h LYS 329 CO -0.10 0.07 -0.24 0.93 -2.27 0.00 0.00 179.45 177.84 2ggf h GLU 330 N 0.10 -0.03 -0.54 1.90 4.39 -1.75 -0.21 114.58 118.44 2ggf h GLU 330 Ca 0.53 0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.32 2ggf h GLU 330 Cb 1.06 0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 29.61 2ggf h GLU 330 CO -0.76 -0.02 -0.41 0.82 -1.16 0.00 0.00 179.01 177.48 2ggf h ILE 331 N -0.03 0.11 0.14 3.13 2.04 -0.89 0.20 117.51 122.20 2ggf h ILE 331 Ca 0.35 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.20 2ggf h ILE 331 Cb 0.57 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2ggf h ILE 331 CO -0.80 0.00 -0.07 -0.78 0.00 0.00 0.00 178.15 176.50 2ggf h ASP 332 N -0.24 -0.17 -0.89 1.72 1.82 -1.13 -2.97 116.42 114.57 2ggf h ASP 332 Ca 0.18 0.01 0.15 0.00 -0.39 0.00 0.00 57.03 56.98 2ggf h ASP 332 Cb 0.56 0.04 -0.15 0.00 0.68 0.00 0.00 39.33 40.47 2ggf h ASP 332 CO -0.66 -0.11 -0.30 0.23 -1.61 0.00 0.00 179.24 176.79 2ggf n MET 333 N -2.53 -0.16 -0.27 0.28 2.81 -0.56 0.32 117.12 117.02 2ggf n MET 333 Ca -0.02 1.37 -0.02 0.00 -1.81 0.00 0.00 57.70 57.22 2ggf n MET 333 Cb 0.07 -2.04 0.04 0.00 -0.71 0.00 0.00 33.22 30.58 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 -1.11 -1.25 4.03 5.85 -0.54 0.48 115.31 122.77 2ggf h LEU 334 Ca 0.35 0.25 0.03 0.00 0.84 0.00 0.00 57.88 59.35 2ggf h LEU 334 Cb 0.58 0.60 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 2ggf h LEU 334 CO -0.89 -0.29 0.52 -0.07 -0.34 0.00 0.00 178.44 177.37 2ggf h LEU 335 N -0.08 0.85 0.42 2.25 3.38 0.03 -2.27 115.31 119.90 2ggf h LEU 335 Ca 0.30 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 2ggf h LEU 335 Cb 0.57 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2ggf h LEU 335 CO -0.79 0.60 -0.40 0.11 0.09 0.00 0.00 178.44 178.04 2ggf h LYS 336 N 1.00 -0.79 -0.97 1.13 1.79 0.60 -1.35 116.57 117.97 2ggf h LYS 336 Ca 0.31 0.05 0.15 0.00 -2.18 0.00 0.00 60.65 58.98 2ggf h LYS 336 Cb -0.01 0.18 -0.09 0.00 -1.58 0.00 0.00 32.23 30.73 2ggf h LYS 336 CO -0.08 -0.53 0.59 0.93 -1.08 0.00 0.00 179.45 179.28 2ggf h GLU 337 N -0.82 0.82 -0.98 3.15 5.08 -1.23 0.25 114.58 120.85 2ggf h GLU 337 Ca -0.05 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.32 2ggf h GLU 337 Cb 0.70 -0.18 -0.07 0.00 0.50 0.00 0.00 28.75 29.70 2ggf h GLU 337 CO -0.04 0.54 0.63 -0.92 -1.00 0.00 0.00 179.01 178.22 2ggf h TYR 338 N 0.84 1.16 0.00 4.33 3.20 -0.98 0.49 116.97 126.01 2ggf h TYR 338 Ca 0.52 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.42 2ggf h TYR 338 Cb 0.66 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 38.55 2ggf h TYR 338 CO -0.02 0.59 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.00 2ggf h LEU 339 N 1.13 0.00 0.00 2.82 3.38 0.10 0.73 115.31 123.48 2ggf h LEU 339 Ca 0.42 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.16 2ggf h LEU 339 Cb 0.18 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2ggf h LEU 339 CO -0.18 0.00 -1.37 -0.07 0.09 0.00 0.00 178.44 176.92 2ggf h LEU 340 N 0.00 0.00 0.00 1.67 3.38 0.65 -3.39 115.31 117.62 2ggf h LEU 340 Ca 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 2ggf h LEU 340 Cb 0.97 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 2ggf h LEU 340 CO 0.00 0.90 -2.19 -0.24 0.09 0.00 0.00 178.44 177.00 2ggf n SER 341 N -3.12 2.17 -0.58 -0.43 2.88 0.15 -5.05 113.62 109.64 2ggf n SER 341 Ca -0.09 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 2ggf n SER 341 Cb 0.96 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 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 2.27 0.71 2.78 0.46 0.00 0.26 -5.07 105.19 106.59 2ggf n GLY 342 Ca -0.38 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.65 2.31 0.03 1.61 2.15 -1.23 -5.02 116.67 113.86 2ggf s ASP 343 Ca 0.00 -0.47 -0.20 0.00 0.43 0.00 0.00 52.55 52.31 2ggf s ASP 343 Cb 0.00 -0.58 -0.16 0.00 -0.30 0.00 0.00 42.92 41.88 2ggf s ASP 343 CO 0.00 -0.24 1.29 0.40 -0.17 0.00 0.00 175.17 176.46 2ggf h ILE 344 N 6.40 1.37 -0.85 4.11 2.04 -1.98 -3.02 117.51 125.58 2ggf h ILE 344 Ca -0.19 -1.45 0.18 0.00 1.00 0.00 0.00 64.86 64.40 2ggf h ILE 344 Cb 1.12 2.01 -0.11 0.00 -0.74 0.00 0.00 36.82 39.11 2ggf h ILE 344 CO 0.32 0.42 0.39 -1.28 0.00 0.00 0.00 178.15 178.00 2ggf h SER 345 N -0.04 0.39 0.51 1.72 0.87 -2.00 -0.06 113.55 114.94 2ggf h SER 345 Ca 0.01 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 2ggf h SER 345 Cb 0.78 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2ggf h SER 345 CO 0.05 0.10 -0.24 -0.08 -0.53 0.00 0.00 176.83 176.13 2ggf h GLU 346 N 0.49 -0.66 -0.19 2.24 4.81 -1.99 -3.01 114.58 116.28 2ggf h GLU 346 Ca 0.50 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.83 2ggf h GLU 346 Cb 0.83 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 2ggf h GLU 346 CO -0.44 -0.38 -0.25 0.00 -0.73 0.00 0.00 179.01 177.20 2ggf h ALA 347 N -0.36 -0.18 -0.90 2.92 0.00 -1.22 -2.31 119.26 117.20 2ggf h ALA 347 Ca -0.07 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.00 2ggf h ALA 347 Cb 0.57 0.50 -0.13 0.00 0.00 0.00 0.00 17.79 18.74 2ggf h ALA 347 CO 0.11 -0.69 -0.51 1.49 0.00 0.00 0.00 179.25 179.65 2ggf h GLU 348 N -0.28 -0.06 -0.26 0.00 4.81 -1.02 0.17 114.58 117.93 2ggf h GLU 348 Ca 0.12 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 2ggf h GLU 348 Cb 0.46 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.80 2ggf h GLU 348 CO -0.35 -0.04 -0.14 1.25 -0.73 0.00 0.00 179.01 179.00 2ggf h HIS 349 N -0.06 -0.34 -0.88 0.92 2.76 -1.31 0.20 115.15 116.44 2ggf h HIS 349 Ca 0.20 0.03 0.14 0.00 -2.20 0.00 0.00 60.37 58.55 2ggf h HIS 349 Cb 0.49 0.19 -0.07 0.00 1.55 0.00 0.00 27.41 29.58 2ggf h HIS 349 CO -0.92 -0.21 0.57 0.00 -1.30 0.00 0.00 177.93 176.07 2ggf h LEU 351 N 0.67 0.48 -1.71 0.00 5.85 0.74 -3.20 115.31 118.14 2ggf h LEU 351 Ca 0.44 -0.67 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2ggf h LEU 351 Cb 0.73 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 2ggf h LEU 351 CO -0.20 1.07 0.16 0.11 -0.34 0.00 0.00 178.44 179.25 2ggf h LYS 352 N -0.08 0.36 -0.97 1.25 1.57 0.26 -2.07 116.57 116.89 2ggf h LYS 352 Ca -0.03 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 2ggf h LYS 352 Cb 1.07 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 33.23 2ggf h LYS 352 CO 0.08 0.25 0.62 0.93 -0.57 0.00 0.00 179.45 180.76 2ggf h GLU 353 N 0.36 1.06 -0.13 3.15 5.08 -0.99 -0.44 114.58 122.68 2ggf h GLU 353 Ca 0.10 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2ggf h GLU 353 Cb -0.02 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 2ggf h GLU 353 CO -0.02 0.70 0.09 -0.07 -1.00 0.00 0.00 179.01 178.71 2ggf h LEU 354 N 1.09 0.05 -1.55 1.33 3.38 -1.45 -3.46 115.31 114.70 2ggf h LEU 354 Ca 0.43 -0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.97 2ggf h LEU 354 Cb 0.23 -0.01 0.04 0.00 0.09 0.00 0.00 40.66 41.01 2ggf h LEU 354 CO -0.19 0.03 -0.80 -0.62 0.09 0.00 0.00 178.44 176.95 2ggf n GLU 355 N -4.51 -5.27 -3.63 1.13 1.02 -0.18 -4.96 120.64 104.24 2ggf n GLU 355 Ca -0.00 0.64 -0.29 0.00 -0.02 0.00 0.00 57.16 57.49 2ggf n GLU 355 Cb 0.17 -5.31 -0.12 0.00 -0.02 0.00 0.00 31.44 26.15 2ggf n GLU 355 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2ggf s VAL 356 N -3.56 1.18 -1.28 2.62 -7.23 -1.26 -4.95 120.40 105.93 2ggf s VAL 356 Ca 0.18 -2.72 0.14 0.00 -1.81 0.00 0.00 61.98 57.77 2ggf s VAL 356 Cb -0.09 -1.82 0.21 0.00 0.56 0.00 0.00 36.38 35.24 2ggf s VAL 356 CO 0.81 -1.01 1.42 -0.81 -0.31 0.00 0.00 175.10 175.20 2ggf n PRO 357 N 3.20 0.13 -0.05 4.82 -0.04 -1.26 -2.90 135.00 138.90 2ggf n PRO 357 Ca 0.16 0.19 -0.22 0.00 -0.04 0.00 0.00 63.50 63.59 2ggf n PRO 357 Cb 0.38 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 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 -1.36 1.05 0.31 0.54 1.44 -1.26 -4.08 115.22 111.85 2ggf n HIS 358 Ca 0.06 0.31 0.19 0.00 -2.01 0.00 0.00 57.72 56.26 2ggf n HIS 358 Cb 0.13 -1.12 0.90 0.00 0.12 0.00 0.00 29.99 30.02 2ggf n HIS 358 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 2ggf h PHE 359 N -0.41 0.00 -0.92 -1.40 0.04 -1.96 -3.04 116.94 109.26 2ggf h PHE 359 Ca -0.42 0.00 0.26 0.00 2.80 0.00 0.00 57.97 60.62 2ggf h PHE 359 Cb 1.72 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.72 2ggf h PHE 359 CO 0.07 0.00 0.27 0.45 -0.60 0.00 0.00 178.31 178.50 2ggf h HIS 360 N 0.00 0.39 -1.06 -0.55 3.86 -1.69 0.38 115.15 116.48 2ggf h HIS 360 Ca 0.00 0.05 0.39 0.00 -1.16 0.00 0.00 60.37 59.65 2ggf h HIS 360 Cb 0.24 -0.02 -0.16 0.00 1.06 0.00 0.00 27.41 28.53 2ggf h HIS 360 CO 0.00 -0.26 0.61 1.12 0.86 0.00 0.00 177.93 180.26 2ggf h HIS 361 N 0.18 0.81 0.27 2.45 2.07 -1.80 0.97 115.15 120.09 2ggf h HIS 361 Ca 0.60 0.04 -0.01 0.00 -2.85 0.00 0.00 60.37 58.15 2ggf h HIS 361 Cb 1.28 -0.20 0.00 0.00 2.57 0.00 0.00 27.41 31.07 2ggf h HIS 361 CO -0.25 -0.31 -0.13 1.49 -3.07 0.00 0.00 177.93 175.66 2ggf h GLU 362 N 0.14 -0.35 -0.81 5.12 4.57 -0.50 -3.08 114.58 119.68 2ggf h GLU 362 Ca 0.80 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 59.08 2ggf h GLU 362 Cb 2.09 0.08 -0.10 0.00 -0.16 0.00 0.00 28.75 30.66 2ggf h GLU 362 CO -0.64 0.00 -0.48 -0.11 -1.18 0.00 0.00 179.01 176.61 2ggf n LEU 363 N -5.05 -0.86 -0.13 1.64 7.94 0.30 -0.33 117.00 120.51 2ggf n LEU 363 Ca -0.09 1.56 -0.05 0.00 -1.11 0.00 0.00 56.01 56.32 2ggf n LEU 363 Cb 0.26 -0.25 0.01 0.00 0.53 0.00 0.00 43.42 43.98 2ggf n LEU 363 CO 0.27 -1.23 0.69 0.58 -1.11 0.00 0.00 177.39 176.59 2ggf h VAL 364 N 0.00 0.34 -0.76 1.96 2.07 -1.56 0.10 116.25 118.40 2ggf h VAL 364 Ca 0.13 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.75 2ggf h VAL 364 Cb 0.33 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.37 2ggf h VAL 364 CO -0.76 0.00 0.39 0.22 0.02 0.00 0.00 177.57 177.44 2ggf h TYR 365 N -0.15 0.69 -0.46 1.57 5.03 -0.58 -1.62 116.97 121.46 2ggf h TYR 365 Ca 0.21 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.53 2ggf h TYR 365 Cb 0.47 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.53 2ggf h TYR 365 CO -0.49 0.24 0.24 0.93 -1.32 0.00 0.00 178.16 177.77 2ggf h GLU 366 N 0.64 0.64 0.02 1.82 5.08 0.10 -2.58 114.58 120.31 2ggf h GLU 366 Ca 0.38 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.69 2ggf h GLU 366 Cb 0.41 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.49 2ggf h GLU 366 CO -0.28 0.52 -0.31 0.00 -1.00 0.00 0.00 179.01 177.94 2ggf h ALA 367 N 1.09 -0.47 -0.84 3.43 0.00 -0.11 -1.17 119.26 121.19 2ggf h ALA 367 Ca 0.16 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.18 2ggf h ALA 367 Cb 0.08 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 18.32 2ggf h ALA 367 CO -0.02 -0.83 0.44 0.82 0.00 0.00 0.00 179.25 179.65 2ggf h ILE 368 N -0.48 0.76 -0.54 0.00 2.04 -1.33 0.30 117.51 118.27 2ggf h ILE 368 Ca 0.05 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2ggf h ILE 368 Cb 0.55 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2ggf h ILE 368 CO -0.25 0.12 0.27 0.40 0.00 0.00 0.00 178.15 178.69 2ggf h ILE 369 N 0.65 1.17 -0.30 -0.67 1.08 -0.95 -2.15 117.51 116.35 2ggf h ILE 369 Ca 0.45 -0.47 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 2ggf h ILE 369 Cb 0.59 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.80 2ggf h ILE 369 CO -0.34 0.20 0.18 0.24 -0.69 0.00 0.00 178.15 177.73 2ggf h MET 370 N 0.75 0.41 -0.78 2.37 2.86 0.24 0.18 114.93 120.96 2ggf h MET 370 Ca 0.19 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2ggf h MET 370 Cb 0.05 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 2ggf h MET 370 CO -0.03 0.32 0.28 0.28 1.06 0.00 0.00 176.91 178.83 2ggf h VAL 371 N 0.38 1.26 -0.00 -2.22 2.07 -1.13 0.37 116.25 116.98 2ggf h VAL 371 Ca 0.11 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 2ggf h VAL 371 Cb 0.03 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2ggf h VAL 371 CO -0.02 0.35 -0.00 -0.07 0.02 0.00 0.00 177.57 177.85 2ggf h LEU 372 N 1.14 0.01 -0.69 2.57 3.38 -1.11 -3.21 115.31 117.40 2ggf h LEU 372 Ca 0.26 -0.40 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 2ggf h LEU 372 Cb 0.26 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2ggf h LEU 372 CO -0.02 0.41 -0.00 -0.33 0.09 0.00 0.00 178.44 178.59 2ggf h GLU 373 N -0.39 1.01 -6.78 1.13 4.39 -0.57 -3.43 114.58 109.94 2ggf h GLU 373 Ca 0.00 -0.31 -0.49 0.00 0.34 0.00 0.00 59.36 58.90 2ggf h GLU 373 Cb 0.40 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2ggf h GLU 373 CO 0.00 0.99 0.39 -1.12 -1.16 0.00 0.00 179.01 178.11 2ggf s SER 374 N -6.60 7.49 0.00 1.42 0.01 0.13 -5.05 113.70 111.11 2ggf s SER 374 Ca -0.11 2.06 -0.08 0.00 1.31 0.00 0.00 55.95 59.12 2ggf s SER 374 Cb 0.14 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.71 2ggf s SER 374 CO 0.85 0.04 0.29 0.28 0.41 0.00 0.00 173.24 175.11 2ggf s THR 375 N -1.20 5.26 0.00 1.44 -1.32 -1.26 -4.78 115.64 113.78 2ggf s THR 375 Ca 0.43 0.30 0.00 0.00 -1.21 0.00 0.00 61.69 61.20 2ggf s THR 375 Cb -0.28 -3.58 0.00 0.00 -1.51 0.00 0.00 72.50 67.14 2ggf s THR 375 CO 0.35 0.41 0.00 0.61 -2.21 0.00 0.00 174.62 173.77 2ggf n GLY 376 N 1.27 -0.25 0.00 6.08 0.00 -1.26 -4.73 105.19 106.29 2ggf n GLY 376 Ca -0.12 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2ggf n GLY 376 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2ggf n GLU 377 N 0.00 4.01 0.00 1.61 0.00 -1.26 -4.72 120.64 120.28 2ggf n GLU 377 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2ggf n GLU 377 Cb 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 31.44 30.81 2ggf n GLU 377 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2ggf n SER 378 N -1.03 0.00 -0.31 -1.84 3.41 -1.26 -0.43 113.62 112.16 2ggf n SER 378 Ca 0.00 0.77 0.12 0.00 -0.26 0.00 0.00 58.87 59.50 2ggf n SER 378 Cb 0.00 -0.27 0.29 0.00 -0.26 0.00 0.00 64.21 63.97 2ggf n SER 378 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2ggf h THR 379 N 0.00 0.57 -0.01 6.66 2.02 -1.89 -1.08 112.91 119.18 2ggf h THR 379 Ca 0.00 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.04 2ggf h THR 379 Cb 0.00 0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.38 2ggf h THR 379 CO 0.00 0.09 -0.33 0.15 0.37 0.00 0.00 175.52 175.81 2ggf h PHE 380 N 0.51 -0.90 0.95 3.16 3.04 -1.75 0.36 116.94 122.31 2ggf h PHE 380 Ca 0.54 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 62.47 2ggf h PHE 380 Cb 0.95 0.40 0.01 0.00 2.56 0.00 0.00 35.95 39.86 2ggf h PHE 380 CO -0.10 -0.42 -0.46 -0.22 -2.02 0.00 0.00 178.31 175.10 2ggf h LYS 381 N -0.47 -1.23 -0.01 1.11 3.64 0.36 -0.87 116.57 119.11 2ggf h LYS 381 Ca 0.06 0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2ggf h LYS 381 Cb 0.56 0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 32.64 2ggf h LYS 381 CO -0.28 -0.82 -0.18 0.52 -2.27 0.00 0.00 179.45 176.43 2ggf h MET 382 N -1.29 -0.21 -0.88 1.90 2.86 -1.12 -0.55 114.93 115.64 2ggf h MET 382 Ca -0.13 0.01 0.24 0.00 -2.06 0.00 0.00 59.70 57.76 2ggf h MET 382 Cb 0.98 0.05 -0.15 0.00 0.06 0.00 0.00 31.60 32.54 2ggf h MET 382 CO 0.21 -0.14 0.16 0.82 1.06 0.00 0.00 176.91 179.03 2ggf h ILE 383 N -0.22 0.25 0.41 -1.22 1.08 -0.35 0.16 117.51 117.63 2ggf h ILE 383 Ca 0.00 -0.05 -0.01 0.00 -0.39 0.00 0.00 64.86 64.41 2ggf h ILE 383 Cb 0.23 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.06 2ggf h ILE 383 CO -0.12 0.03 -0.38 0.25 -0.69 0.00 0.00 178.15 177.23 2ggf h LEU 384 N 0.14 -1.04 -1.08 1.44 5.85 -0.36 -1.97 115.31 118.28 2ggf h LEU 384 Ca 0.54 0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.48 2ggf h LEU 384 Cb 1.10 0.34 -0.08 0.00 0.37 0.00 0.00 40.66 42.38 2ggf h LEU 384 CO -0.71 -0.51 0.62 0.44 -0.34 0.00 0.00 178.44 177.93 2ggf h ASP 385 N -0.78 0.84 -0.26 1.25 5.19 -0.01 -1.77 116.42 120.89 2ggf h ASP 385 Ca -0.05 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.47 2ggf h ASP 385 Cb 0.67 -0.11 -0.06 0.00 0.18 0.00 0.00 39.33 40.00 2ggf h ASP 385 CO -0.03 0.42 -0.16 0.25 -3.12 0.00 0.00 179.24 176.60 2ggf h LEU 386 N 0.89 -0.53 -0.35 1.55 5.85 -0.29 -0.16 115.31 122.27 2ggf h LEU 386 Ca 0.50 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 59.31 2ggf h LEU 386 Cb 0.60 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.89 2ggf h LEU 386 CO -0.26 -0.20 0.14 -0.07 -0.34 0.00 0.00 178.44 177.71 2ggf h LEU 387 N -0.14 0.48 0.03 2.25 3.38 -0.60 -2.50 115.31 118.20 2ggf h LEU 387 Ca 0.14 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2ggf h LEU 387 Cb 0.35 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2ggf h LEU 387 CO -0.35 0.51 -0.04 0.11 0.09 0.00 0.00 178.44 178.77 2ggf h LYS 388 N 0.41 -0.07 -0.60 1.13 1.57 -0.76 -1.40 116.57 116.86 2ggf h LYS 388 Ca 0.12 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 2ggf h LYS 388 Cb 0.18 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.42 2ggf h LYS 388 CO -0.01 -0.05 -0.47 1.03 -0.57 0.00 0.00 179.45 179.38 2ggf h SER 389 N -0.07 -1.66 -0.92 0.86 0.87 -1.11 0.14 113.55 111.65 2ggf h SER 389 Ca -0.00 0.24 0.21 0.00 -1.23 0.00 0.00 61.79 61.00 2ggf h SER 389 Cb 0.06 0.71 -0.17 0.00 -0.44 0.00 0.00 62.40 62.57 2ggf h SER 389 CO -0.01 -0.25 -0.12 -0.07 -0.53 0.00 0.00 176.83 175.85 2ggf h LEU 390 N -0.14 -0.68 0.81 2.23 3.38 -1.41 0.63 115.31 120.14 2ggf h LEU 390 Ca 0.10 0.27 -0.04 0.00 0.09 0.00 0.00 57.88 58.30 2ggf h LEU 390 Cb 0.40 0.52 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2ggf h LEU 390 CO -0.64 -0.30 -0.42 -0.25 0.09 0.00 0.00 178.44 176.91 2ggf h TRP 391 N 0.02 -1.11 0.00 1.13 7.01 0.37 -1.74 115.95 121.63 2ggf h TRP 391 Ca 0.49 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.46 2ggf h TRP 391 Cb 0.85 0.38 0.00 0.00 -2.10 0.00 0.00 29.16 28.28 2ggf h TRP 391 CO -0.61 -0.67 0.00 0.87 -2.79 0.00 0.00 178.44 175.24 2ggf h LYS 392 N -1.13 0.00 -1.34 2.65 6.56 0.44 -2.39 116.57 121.35 2ggf h LYS 392 Ca -0.11 0.00 -0.43 0.00 -1.06 0.00 0.00 60.65 59.05 2ggf h LYS 392 Cb 0.88 0.00 -0.19 0.00 -0.57 0.00 0.00 32.23 32.36 2ggf h LYS 392 CO 0.16 0.00 0.55 0.43 -2.06 0.00 0.00 179.45 178.53 2ggf n SER 393 N -2.35 6.66 -3.96 0.86 7.64 0.20 -4.84 113.62 117.84 2ggf n SER 393 Ca -0.01 -3.28 -0.35 0.00 1.01 0.00 0.00 58.87 56.25 2ggf n SER 393 Cb 0.06 -1.02 -0.06 0.00 -1.01 0.00 0.00 64.21 62.18 2ggf n SER 393 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2ggf n SER 394 N -0.07 -1.48 -0.06 6.43 7.64 -0.90 -4.71 113.62 120.47 2ggf n SER 394 Ca 0.40 -1.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.22 2ggf n SER 394 Cb 0.64 -1.29 -0.08 0.00 -1.01 0.00 0.00 64.21 62.47 2ggf n SER 394 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2ggf n THR 395 N -3.38 0.72 -4.70 0.44 -1.04 -0.86 -5.01 114.28 100.46 2ggf n THR 395 Ca 0.10 -0.40 -0.23 0.00 -2.04 0.00 0.00 64.05 61.47 2ggf n THR 395 Cb 0.37 -0.79 -0.15 0.00 -1.82 0.00 0.00 70.33 67.94 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 -2.25 1.21 0.11 12.58 1.01 -1.21 -4.95 121.20 127.69 2ggf s ILE 396 Ca -0.08 -0.68 0.07 0.00 0.00 0.00 0.00 60.65 59.96 2ggf s ILE 396 Cb 0.03 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 2ggf s ILE 396 CO 0.40 0.32 -0.08 0.28 0.00 0.00 0.00 174.94 175.86 2ggf s THR 397 N -0.39 3.46 0.07 2.92 -1.32 -1.26 -4.65 115.64 114.47 2ggf s THR 397 Ca 0.06 -1.25 -0.14 0.00 -1.21 0.00 0.00 61.69 59.15 2ggf s THR 397 Cb -0.06 -2.63 -0.03 0.00 -1.51 0.00 0.00 72.50 68.26 2ggf s THR 397 CO -0.00 0.09 0.91 0.52 -2.21 0.00 0.00 174.62 173.93 2ggf n VAL 398 N 0.62 -0.30 -0.30 5.08 0.31 -1.26 -0.43 118.33 122.05 2ggf n VAL 398 Ca -0.13 1.42 -0.08 0.00 -0.01 0.00 0.00 64.34 65.54 2ggf n VAL 398 Cb 0.52 -1.79 -0.07 0.00 -0.91 0.00 0.00 33.84 31.59 2ggf n VAL 398 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2ggf h ASP 399 N 0.00 -1.59 0.00 4.52 3.32 -1.97 0.27 116.42 120.98 2ggf h ASP 399 Ca 0.07 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2ggf h ASP 399 Cb 0.18 0.70 0.00 0.00 0.22 0.00 0.00 39.33 40.43 2ggf h ASP 399 CO -0.42 -0.17 0.00 0.00 -1.72 0.00 0.00 179.24 176.93 2ggf n GLN 400 N -4.66 0.00 -0.47 3.56 1.13 0.43 -1.23 117.38 116.14 2ggf n GLN 400 Ca 0.01 0.58 0.40 0.00 -1.94 0.00 0.00 57.00 56.05 2ggf n GLN 400 Cb 0.19 -1.29 0.66 0.00 0.11 0.00 0.00 30.24 29.91 2ggf n GLN 400 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 2ggf n MET 401 N -1.83 -0.03 0.08 -1.09 1.56 -0.71 -0.80 117.12 114.29 2ggf n MET 401 Ca 0.00 1.20 -0.06 0.00 -0.27 0.00 0.00 57.70 58.57 2ggf n MET 401 Cb 0.00 -2.40 -0.04 0.00 2.15 0.00 0.00 33.22 32.94 2ggf n MET 401 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 2ggf h LYS 402 N 0.00 -0.31 -0.77 2.12 3.64 0.98 -2.87 116.57 119.35 2ggf h LYS 402 Ca 0.86 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 60.38 2ggf h LYS 402 Cb 2.81 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 34.56 2ggf h LYS 402 CO -0.43 -0.21 -0.37 -0.09 -2.27 0.00 0.00 179.45 176.08 2ggf h ARG 403 N -0.33 -0.09 -0.67 1.90 9.65 -0.67 -1.49 114.38 122.69 2ggf h ARG 403 Ca -0.01 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 58.93 2ggf h ARG 403 Cb 0.30 0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 28.82 2ggf h ARG 403 CO -0.06 -0.06 -0.39 0.41 2.80 0.00 0.00 179.97 182.66 2ggf n GLY 404 N -1.44 -1.92 0.41 2.80 0.00 -1.09 -0.95 105.19 103.00 2ggf n GLY 404 Ca 0.06 0.83 -0.18 0.00 0.00 0.00 0.00 46.02 46.74 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 -0.94 -0.78 1.61 -1.99 -1.22 -3.13 116.97 110.53 2ggf h TYR 405 Ca 0.11 -0.02 0.12 0.00 2.00 0.00 0.00 58.73 60.93 2ggf h TYR 405 Cb 0.27 0.31 -0.12 0.00 2.00 0.00 0.00 36.73 39.19 2ggf h TYR 405 CO -0.74 -0.56 -0.31 0.39 -0.00 0.00 0.00 178.16 176.93 2ggf n GLU 406 N -5.49 -0.19 -0.23 4.88 1.02 -0.28 0.14 120.64 120.49 2ggf n GLU 406 Ca -0.14 1.20 0.04 0.00 -0.02 0.00 0.00 57.16 58.24 2ggf n GLU 406 Cb 0.41 -1.78 0.14 0.00 -0.02 0.00 0.00 31.44 30.19 2ggf n GLU 406 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2ggf h ARG 407 N 0.00 0.15 -0.74 3.49 2.43 -0.99 0.68 114.38 119.40 2ggf h ARG 407 Ca 0.26 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2ggf h ARG 407 Cb 0.46 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 2ggf h ARG 407 CO -0.77 0.10 0.47 0.82 -1.51 0.00 0.00 179.97 179.08 2ggf h ILE 408 N 0.16 1.20 0.00 1.20 1.08 0.13 0.49 117.51 121.77 2ggf h ILE 408 Ca 0.38 -0.40 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 2ggf h ILE 408 Cb 0.64 0.14 -0.00 0.00 -3.07 0.00 0.00 36.82 34.53 2ggf h ILE 408 CO -0.56 0.20 -0.04 1.88 -0.69 0.00 0.00 178.15 178.94 2ggf h TYR 409 N 1.00 0.00 0.02 1.37 0.05 0.08 0.39 116.97 119.88 2ggf h TYR 409 Ca 0.27 0.00 -0.34 0.00 0.05 0.00 0.00 58.73 58.70 2ggf h TYR 409 Cb -0.08 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.61 2ggf h TYR 409 CO -0.02 0.04 -2.09 0.09 -1.05 0.00 0.00 178.16 175.13 2ggf n ASN 410 N -3.64 0.86 -1.85 3.88 4.13 -0.54 -4.18 115.26 113.92 2ggf n ASN 410 Ca -0.02 0.17 0.07 0.00 1.68 0.00 0.00 54.58 56.47 2ggf n ASN 410 Cb 0.14 0.18 0.39 0.00 -1.54 0.00 0.00 39.78 38.95 2ggf n ASN 410 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2ggf n GLU 411 N -3.02 4.76 0.13 3.52 1.02 0.16 -4.31 120.64 122.90 2ggf n GLU 411 Ca -0.28 -3.06 -0.01 0.00 -0.02 0.00 0.00 57.16 53.79 2ggf n GLU 411 Cb 1.08 -2.23 0.11 0.00 -0.02 0.00 0.00 31.44 30.38 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 3.90 1.30 -0.15 -3.67 6.09 -0.40 -3.28 117.51 121.30 2ggf h ILE 412 Ca 0.00 -2.36 0.05 0.00 -1.37 0.00 0.00 64.86 61.18 2ggf h ILE 412 Cb 1.92 2.33 -0.05 0.00 0.47 0.00 0.00 36.82 41.49 2ggf h ILE 412 CO 0.47 0.64 -0.17 -0.65 -3.07 0.00 0.00 178.15 175.37 2ggf h PRO 413 N 0.00 -0.20 0.36 2.19 0.11 -1.84 -2.36 132.00 130.26 2ggf h PRO 413 Ca -0.01 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 2ggf h PRO 413 Cb 1.28 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2ggf h PRO 413 CO 0.08 -0.13 -0.17 0.22 -0.21 0.00 0.00 178.00 177.79 2ggf h ASP 414 N -0.20 -0.41 -0.93 -2.05 1.82 -1.90 -3.01 116.42 109.74 2ggf h ASP 414 Ca 0.10 -0.04 0.20 0.00 -0.39 0.00 0.00 57.03 56.91 2ggf h ASP 414 Cb 0.35 0.11 -0.17 0.00 0.68 0.00 0.00 39.33 40.30 2ggf h ASP 414 CO -0.27 -0.23 -0.15 0.40 -1.61 0.00 0.00 179.24 177.38 2ggf h ILE 415 N -0.57 0.08 -0.95 2.25 2.04 -1.58 0.77 117.51 119.55 2ggf h ILE 415 Ca -0.05 -0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.01 2ggf h ILE 415 Cb 0.43 0.07 -0.11 0.00 -0.74 0.00 0.00 36.82 36.46 2ggf h ILE 415 CO 0.08 0.00 0.53 -1.13 0.00 0.00 0.00 178.15 177.63 2ggf h ASN 416 N 0.01 0.61 -0.69 1.72 -1.24 -1.28 0.41 115.58 115.11 2ggf h ASN 416 Ca 0.48 0.12 0.08 0.00 0.71 0.00 0.00 56.30 57.68 2ggf h ASN 416 Cb 0.81 0.02 -0.10 0.00 0.73 0.00 0.00 38.32 39.78 2ggf h ASN 416 CO -0.93 0.16 -0.54 -0.07 -1.29 0.00 0.00 177.43 174.76 2ggf h LEU 417 N 0.61 -1.91 0.00 0.34 3.38 0.55 -2.43 115.31 115.86 2ggf h LEU 417 Ca 0.57 0.28 -0.04 0.00 0.09 0.00 0.00 57.88 58.78 2ggf h LEU 417 Cb 0.97 0.83 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 2ggf h LEU 417 CO -0.43 -0.32 -0.24 0.44 0.09 0.00 0.00 178.44 177.97 2ggf h ASP 418 N -0.20 0.00 -3.64 -0.43 3.32 -1.44 -3.42 116.42 110.61 2ggf h ASP 418 Ca 0.14 -0.56 -0.71 0.00 0.02 0.00 0.00 57.03 55.91 2ggf h ASP 418 Cb 0.52 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 39.75 2ggf h ASP 418 CO -0.76 0.92 -0.40 0.68 -1.72 0.00 0.00 179.24 177.96 2ggf s VAL 419 N -2.06 3.87 0.30 -1.35 -7.23 0.14 -4.93 120.40 109.13 2ggf s VAL 419 Ca -0.15 -2.26 0.08 0.00 -1.81 0.00 0.00 61.98 57.83 2ggf s VAL 419 Cb -0.00 -3.56 0.02 0.00 0.56 0.00 0.00 36.38 33.40 2ggf s VAL 419 CO 0.45 -0.80 1.69 1.55 -0.31 0.00 0.00 175.10 177.67 2ggf h PRO 420 N 7.86 0.15 0.00 4.82 0.13 -1.63 -2.80 132.00 140.53 2ggf h PRO 420 Ca -0.11 -0.08 -0.03 0.00 -0.87 0.00 0.00 66.00 64.92 2ggf h PRO 420 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 2ggf h PRO 420 CO 0.76 0.60 -0.12 1.12 -0.23 0.00 0.00 178.00 180.13 2ggf h HIS 421 N 0.13 0.00 -0.83 1.56 2.07 -1.91 -3.27 115.15 112.90 2ggf h HIS 421 Ca 0.01 0.00 0.28 0.00 -2.85 0.00 0.00 60.37 57.80 2ggf h HIS 421 Cb 0.88 0.00 -0.15 0.00 2.57 0.00 0.00 27.41 30.71 2ggf h HIS 421 CO 0.01 0.12 0.19 0.43 -3.07 0.00 0.00 177.93 175.61 2ggf n SER 422 N -3.24 0.06 0.01 3.10 7.64 -1.06 0.64 113.62 120.77 2ggf n SER 422 Ca 0.01 1.39 -0.11 0.00 1.01 0.00 0.00 58.87 61.17 2ggf n SER 422 Cb 0.40 -0.57 -0.04 0.00 -1.01 0.00 0.00 64.21 62.98 2ggf n SER 422 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2ggf h TYR 423 N 0.00 -0.91 0.13 1.43 0.05 -1.79 0.10 116.97 115.99 2ggf h TYR 423 Ca 0.58 0.04 0.01 0.00 0.05 0.00 0.00 58.73 59.41 2ggf h TYR 423 Cb 1.36 0.42 -0.02 0.00 1.01 0.00 0.00 36.73 39.50 2ggf h TYR 423 CO -0.26 -0.41 -0.15 1.03 -1.05 0.00 0.00 178.16 177.33 2ggf h SER 424 N -0.41 -0.40 -0.78 3.88 0.87 -0.05 -1.70 113.55 114.95 2ggf h SER 424 Ca 0.09 0.04 0.18 0.00 -1.23 0.00 0.00 61.79 60.87 2ggf h SER 424 Cb 0.55 0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.61 2ggf h SER 424 CO -0.35 -0.23 0.53 0.58 -0.53 0.00 0.00 176.83 176.84 2ggf h VAL 425 N -0.32 0.73 0.43 2.23 2.07 -0.99 -2.16 116.25 118.24 2ggf h VAL 425 Ca 0.01 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2ggf h VAL 425 Cb 0.31 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2ggf h VAL 425 CO -0.05 0.06 -0.21 0.25 0.02 0.00 0.00 177.57 177.64 2ggf h LEU 426 N 0.32 -0.49 -0.96 2.57 5.85 0.00 -1.44 115.31 121.15 2ggf h LEU 426 Ca 0.39 -0.09 0.26 0.00 0.84 0.00 0.00 57.88 59.27 2ggf h LEU 426 Cb 1.04 0.13 -0.13 0.00 0.37 0.00 0.00 40.66 42.07 2ggf h LEU 426 CO -0.11 -0.09 0.51 -0.08 -0.34 0.00 0.00 178.44 178.33 2ggf h GLU 427 N -1.00 0.43 -0.22 1.25 4.81 -0.77 0.28 114.58 119.35 2ggf h GLU 427 Ca -0.06 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 2ggf h GLU 427 Cb 0.56 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 2ggf h GLU 427 CO 0.10 0.28 -0.20 -0.09 -0.73 0.00 0.00 179.01 178.38 2ggf h ARG 428 N 0.44 0.53 0.49 1.92 2.43 -1.40 -2.49 114.38 116.30 2ggf h ARG 428 Ca 0.64 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 59.51 2ggf h ARG 428 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2ggf h ARG 428 CO -0.53 0.85 -0.24 0.35 -1.51 0.00 0.00 179.97 178.89 2ggf h PHE 429 N 0.22 -0.61 -0.86 2.20 3.57 0.33 -2.91 116.94 118.88 2ggf h PHE 429 Ca 0.04 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.68 2ggf h PHE 429 Cb 0.74 0.20 -0.10 0.00 2.79 0.00 0.00 35.95 39.58 2ggf h PHE 429 CO 0.08 -0.34 0.44 0.28 -2.23 0.00 0.00 178.31 176.53 2ggf h VAL 430 N -0.75 0.71 0.07 1.41 2.07 -0.66 -2.20 116.25 116.90 2ggf h VAL 430 Ca -0.07 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2ggf h VAL 430 Cb 0.55 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2ggf h VAL 430 CO 0.11 0.11 -0.26 -0.08 0.02 0.00 0.00 177.57 177.47 2ggf h GLU 431 N 0.61 -0.37 -0.69 1.57 4.81 -1.26 -0.14 114.58 119.11 2ggf h GLU 431 Ca 0.48 0.03 0.15 0.00 -0.13 0.00 0.00 59.36 59.88 2ggf h GLU 431 Cb 0.70 0.08 -0.12 0.00 0.63 0.00 0.00 28.75 30.05 2ggf h GLU 431 CO -0.38 -0.25 0.02 0.93 -0.73 0.00 0.00 179.01 178.61 2ggf h GLU 432 N -0.38 0.12 -0.14 1.92 4.39 -1.29 -0.16 114.58 119.04 2ggf h GLU 432 Ca -0.01 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.74 2ggf h GLU 432 Cb 0.38 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 2ggf h GLU 432 CO -0.14 0.08 -0.24 0.00 -1.16 0.00 0.00 179.01 177.55 2ggf h PHE 434 N -0.30 1.09 -0.04 0.00 3.57 0.28 -1.29 116.94 120.24 2ggf h PHE 434 Ca 0.10 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2ggf h PHE 434 Cb 0.46 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2ggf h PHE 434 CO -0.35 0.64 -0.38 1.96 -2.23 0.00 0.00 178.31 177.96 2ggf h GLN 435 N 1.14 0.09 0.00 1.11 1.08 0.02 -2.57 115.11 115.97 2ggf h GLN 435 Ca 0.35 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.44 2ggf h GLN 435 Cb -0.00 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 2ggf h GLN 435 CO -0.10 0.46 -0.36 0.00 -0.95 0.00 0.00 178.83 177.87 2ggf h ALA 436 N 1.54 1.10 -0.58 3.87 0.00 0.50 -3.47 119.26 122.22 2ggf h ALA 436 Ca 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2ggf h ALA 436 Cb 0.71 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ggf h ALA 436 CO 0.05 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.17 2ggf n GLY 437 N -0.00 0.76 0.00 0.00 0.00 -0.97 -5.01 105.19 99.97 2ggf n GLY 437 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.35 -0.61 -5.35 -1.20 -5.05 119.36 102.06 2ggf n ILE 438 Ca 0.00 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.22 2ggf n ILE 438 Cb 0.20 0.39 -0.13 0.00 -1.74 0.00 0.00 39.64 38.36 2ggf n ILE 438 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 2ggf s ILE 439 N -1.76 1.91 0.68 7.28 -4.36 -1.26 -4.82 121.20 118.87 2ggf s ILE 439 Ca 0.00 -1.60 -0.11 0.00 -0.26 0.00 0.00 60.65 58.68 2ggf s ILE 439 Cb 0.00 -1.72 0.00 0.00 1.25 0.00 0.00 42.46 42.00 2ggf s ILE 439 CO 0.00 0.01 1.06 -0.55 0.24 0.00 0.00 174.94 175.70 2ggf s SER 440 N -1.92 5.60 0.54 4.36 0.15 -1.26 -4.70 113.70 116.46 2ggf s SER 440 Ca 0.09 1.13 0.27 0.00 0.70 0.00 0.00 55.95 58.14 2ggf s SER 440 Cb -0.10 -1.99 1.42 0.00 -1.71 0.00 0.00 66.02 63.64 2ggf s SER 440 CO 0.05 -1.22 1.98 0.11 1.20 0.00 0.00 173.24 175.35 2ggf h LYS 441 N -0.54 0.00 0.07 5.44 1.57 -2.00 -2.79 116.57 118.33 2ggf h LYS 441 Ca -0.45 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2ggf h LYS 441 Cb 1.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 2ggf h LYS 441 CO 0.63 0.00 -0.12 1.96 -0.57 0.00 0.00 179.45 181.36 2ggf h GLN 442 N 0.00 -0.19 -0.77 3.15 1.08 -1.99 -1.59 115.11 114.79 2ggf h GLN 442 Ca 0.27 0.01 0.18 0.00 -1.45 0.00 0.00 58.65 57.67 2ggf h GLN 442 Cb 1.12 0.04 -0.13 0.00 -0.05 0.00 0.00 27.48 28.46 2ggf h GLN 442 CO -0.00 -0.13 0.04 -0.07 -0.95 0.00 0.00 178.83 177.72 2ggf h LEU 443 N -0.20 -0.30 -1.28 1.46 3.38 -1.88 0.58 115.31 117.08 2ggf h LEU 443 Ca -0.01 0.20 0.19 0.00 0.09 0.00 0.00 57.88 58.34 2ggf h LEU 443 Cb 0.18 0.33 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 2ggf h LEU 443 CO -0.04 -0.17 0.60 -0.09 0.09 0.00 0.00 178.44 178.83 2ggf h ARG 444 N 0.12 0.59 0.00 1.13 9.65 -1.41 -2.28 114.38 122.18 2ggf h ARG 444 Ca 0.43 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.27 2ggf h ARG 444 Cb 0.78 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 29.22 2ggf h ARG 444 CO -0.66 0.39 -0.20 -0.44 2.80 0.00 0.00 179.97 181.86 2ggf h ASP 445 N 0.61 0.00 -0.71 -3.80 5.19 0.95 -3.35 116.42 115.31 2ggf h ASP 445 Ca 0.51 -0.12 0.27 0.00 -0.62 0.00 0.00 57.03 57.07 2ggf h ASP 445 Cb 0.98 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.36 2ggf h ASP 445 CO -0.26 0.66 0.29 0.18 -3.12 0.00 0.00 179.24 177.00 2ggf n LEU 446 N -4.70 0.17 -3.37 1.55 4.32 0.10 -4.51 117.00 110.56 2ggf n LEU 446 Ca -0.04 1.18 -0.48 0.00 -0.02 0.00 0.00 56.01 56.65 2ggf n LEU 446 Cb 0.15 -0.54 -0.07 0.00 -1.62 0.00 0.00 43.42 41.34 2ggf n LEU 446 CO 0.07 -1.29 0.77 0.00 -1.22 0.00 0.00 177.39 175.71 2ggf s PRO 448 N 1.85 2.72 -0.28 0.00 0.04 -1.26 -5.07 135.00 133.01 2ggf s PRO 448 Ca 0.74 1.36 -0.25 0.00 0.04 0.00 0.00 61.00 62.89 2ggf s PRO 448 Cb -1.05 -1.94 0.13 0.00 0.04 0.00 0.00 34.50 31.67 2ggf s PRO 448 CO 0.56 -1.31 1.05 -1.54 0.04 0.00 0.00 177.00 175.80 2ggf s SER 449 N -2.69 -0.43 0.09 6.66 1.04 -1.26 -4.87 113.70 112.23 2ggf s SER 449 Ca 0.66 0.81 -0.03 0.00 0.48 0.00 0.00 55.95 57.88 2ggf s SER 449 Cb -0.20 0.82 -0.03 0.00 0.10 0.00 0.00 66.02 66.71 2ggf s SER 449 CO 0.44 -0.15 0.05 0.00 0.98 0.00 0.00 173.24 174.56 2ggf s ARG 450 N 0.16 0.78 -0.31 4.02 1.70 -1.26 -5.14 118.95 118.90 2ggf s ARG 450 Ca 0.03 -1.24 -0.05 0.00 -0.47 0.00 0.00 55.73 54.00 2ggf s ARG 450 Cb -0.05 0.25 0.03 0.00 -0.57 0.00 0.00 34.95 34.62 2ggf s ARG 450 CO -0.06 -0.20 0.06 0.45 -1.08 0.00 0.00 175.30 174.47 2ggf s SER 451 N -2.95 5.10 0.98 -2.89 0.15 -1.26 -5.10 113.70 107.73 2ggf s SER 451 Ca 0.12 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 55.72 2ggf s SER 451 Cb 0.07 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 2ggf s SER 451 CO -0.06 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2ggf n GLY 452 N 4.77 -1.34 3.55 9.45 0.00 -1.26 -4.92 105.19 115.45 2ggf n GLY 452 Ca -0.13 -1.63 -0.39 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.95 2.69 0.19 1.61 0.04 -1.26 -4.95 135.00 130.38 2ggf s PRO 453 Ca 0.00 0.67 0.01 0.00 0.04 0.00 0.00 61.00 61.73 2ggf s PRO 453 Cb 0.00 -4.37 -0.05 0.00 0.04 0.00 0.00 34.50 30.13 2ggf s PRO 453 CO 0.00 -2.65 0.04 -1.54 0.04 0.00 0.00 177.00 172.90 2ggf s SER 454 N 7.88 0.99 0.36 6.66 1.04 -1.26 -5.17 113.70 124.21 2ggf s SER 454 Ca 0.68 -1.25 0.07 0.00 0.48 0.00 0.00 55.95 55.93 2ggf s SER 454 Cb -0.13 0.18 -0.01 0.00 0.10 0.00 0.00 66.02 66.16 2ggf s SER 454 CO 0.22 -0.65 0.48 -0.44 0.98 0.00 0.00 173.24 173.83 2ggf s SER 455 N -3.19 5.80 0.00 7.02 0.01 -1.26 -5.27 113.70 116.81 2ggf s SER 455 Ca 0.29 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.25 2ggf s SER 455 Cb 0.07 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.28 2ggf s SER 455 CO 0.07 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 173.80