#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 4.04 -0.90 1.61 1.04 -1.26 -5.07 113.70 113.17 2ggf s SER 321 Ca 0.00 -1.31 -0.25 0.00 0.48 0.00 0.00 55.95 54.87 2ggf s SER 321 Cb 0.00 -1.27 0.03 0.00 0.10 0.00 0.00 66.02 64.89 2ggf s SER 321 CO 0.00 -0.25 1.44 -0.94 0.98 0.00 0.00 173.24 174.47 2ggf s SER 322 N 1.31 6.25 -0.40 7.02 1.04 -1.26 -4.94 113.70 122.72 2ggf s SER 322 Ca -0.04 -0.97 -0.42 0.00 0.48 0.00 0.00 55.95 54.99 2ggf s SER 322 Cb -0.19 -2.56 -0.17 0.00 0.10 0.00 0.00 66.02 63.20 2ggf s SER 322 CO -0.07 -1.74 1.90 0.61 0.98 0.00 0.00 173.24 174.92 2ggf n GLY 323 N 6.30 0.36 3.63 7.32 0.00 -1.26 -4.91 105.19 116.63 2ggf n GLY 323 Ca 0.22 1.00 -0.07 0.00 0.00 0.00 0.00 46.02 47.17 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 4.80 -0.93 0.17 1.61 0.01 -1.26 -5.17 113.70 112.92 2ggf s SER 324 Ca 1.08 1.50 -0.23 0.00 1.31 0.00 0.00 55.95 59.61 2ggf s SER 324 Cb -1.25 1.37 0.06 0.00 0.21 0.00 0.00 66.02 66.42 2ggf s SER 324 CO 0.67 -0.24 0.72 -0.94 0.41 0.00 0.00 173.24 173.86 2ggf s SER 325 N 1.60 -0.40 0.00 2.44 1.04 -1.26 -5.17 113.70 111.95 2ggf s SER 325 Ca -0.10 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2ggf s SER 325 Cb -0.05 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2ggf s SER 325 CO -0.19 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 173.61 2ggf n GLY 326 N -0.39 3.64 0.06 7.32 0.00 -1.26 -4.91 105.19 109.64 2ggf n GLY 326 Ca -0.11 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.38 2ggf n GLY 326 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ggf h LEU 327 N 0.00 0.00 -1.28 0.99 3.38 -2.02 -3.33 115.31 113.05 2ggf h LEU 327 Ca 0.00 -0.35 0.45 0.00 0.09 0.00 0.00 57.88 58.07 2ggf h LEU 327 Cb 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.62 2ggf h LEU 327 CO 0.00 0.71 0.82 0.55 0.09 0.00 0.00 178.44 180.61 2ggf n VAL 328 N -4.70 -0.24 -0.17 1.22 3.14 -1.26 0.17 118.33 116.49 2ggf n VAL 328 Ca -0.05 1.70 -0.07 0.00 -2.96 0.00 0.00 64.34 62.96 2ggf n VAL 328 Cb 0.20 -2.78 0.02 0.00 -1.06 0.00 0.00 33.84 30.22 2ggf n VAL 328 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2ggf h LYS 329 N 0.00 0.64 -0.96 1.45 3.64 -1.92 -3.02 116.57 116.41 2ggf h LYS 329 Ca 0.82 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 60.27 2ggf h LYS 329 Cb 2.64 -0.14 -0.13 0.00 -0.41 0.00 0.00 32.23 34.18 2ggf h LYS 329 CO -0.45 0.42 -0.50 0.39 -2.27 0.00 0.00 179.45 177.05 2ggf n GLU 330 N -4.75 -0.35 -0.25 1.90 1.02 0.44 0.17 120.64 118.82 2ggf n GLU 330 Ca 0.03 1.46 0.02 0.00 -0.02 0.00 0.00 57.16 58.65 2ggf n GLU 330 Cb 0.03 -2.16 0.10 0.00 -0.02 0.00 0.00 31.44 29.39 2ggf n GLU 330 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2ggf h ILE 331 N 0.00 0.30 0.05 -3.67 2.04 -1.62 -0.60 117.51 114.01 2ggf h ILE 331 Ca 0.22 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 66.07 2ggf h ILE 331 Cb 0.46 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2ggf h ILE 331 CO -0.92 0.00 -0.03 0.44 0.00 0.00 0.00 178.15 177.64 2ggf h ASP 332 N 0.02 -0.07 -0.90 1.72 3.32 -0.34 -2.74 116.42 117.43 2ggf h ASP 332 Ca 0.36 0.00 0.19 0.00 0.02 0.00 0.00 57.03 57.61 2ggf h ASP 332 Cb 0.57 0.02 -0.17 0.00 0.22 0.00 0.00 39.33 39.97 2ggf h ASP 332 CO -0.72 -0.04 -0.17 0.23 -1.72 0.00 0.00 179.24 176.82 2ggf n MET 333 N -2.29 -0.08 -0.03 3.56 2.81 -0.59 -0.49 117.12 120.01 2ggf n MET 333 Ca -0.01 1.39 -0.12 0.00 -1.81 0.00 0.00 57.70 57.15 2ggf n MET 333 Cb 0.03 -2.10 -0.08 0.00 -0.71 0.00 0.00 33.22 30.36 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 -1.42 -0.35 4.03 5.85 -1.00 -0.89 115.31 121.53 2ggf h LEU 334 Ca 0.46 0.17 0.07 0.00 0.84 0.00 0.00 57.88 59.42 2ggf h LEU 334 Cb 0.76 0.56 -0.08 0.00 0.37 0.00 0.00 40.66 42.27 2ggf h LEU 334 CO -0.91 -0.38 -0.16 -0.07 -0.34 0.00 0.00 178.44 176.59 2ggf h LEU 335 N -0.44 -0.54 -0.59 2.25 3.38 -0.48 -0.42 115.31 118.46 2ggf h LEU 335 Ca 0.03 0.13 0.11 0.00 0.09 0.00 0.00 57.88 58.24 2ggf h LEU 335 Cb 0.53 0.30 -0.12 0.00 0.09 0.00 0.00 40.66 41.47 2ggf h LEU 335 CO -0.38 -0.20 -0.31 0.11 0.09 0.00 0.00 178.44 177.75 2ggf h LYS 336 N -0.10 -0.14 -0.52 1.13 6.56 -0.60 0.37 116.57 123.27 2ggf h LYS 336 Ca 0.17 0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.76 2ggf h LYS 336 Cb 0.37 0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.03 2ggf h LYS 336 CO -0.41 -0.09 0.29 0.93 -2.06 0.00 0.00 179.45 178.10 2ggf h GLU 337 N -0.14 0.72 -0.75 3.15 5.08 -0.45 -0.90 114.58 121.30 2ggf h GLU 337 Ca 0.24 -0.08 0.14 0.00 -1.00 0.00 0.00 59.36 58.66 2ggf h GLU 337 Cb 0.54 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 2ggf h GLU 337 CO -0.68 0.56 0.50 -0.92 -1.00 0.00 0.00 179.01 177.47 2ggf h TYR 338 N 0.69 0.52 0.09 4.33 3.20 0.65 0.37 116.97 126.82 2ggf h TYR 338 Ca 0.18 0.01 -0.26 0.00 3.14 0.00 0.00 58.73 61.81 2ggf h TYR 338 Cb 0.04 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2ggf h TYR 338 CO -0.02 0.21 -1.23 -0.07 -1.64 0.00 0.00 178.16 175.41 2ggf h LEU 339 N 0.45 0.29 -0.65 2.82 3.38 -0.47 0.82 115.31 121.95 2ggf h LEU 339 Ca 0.36 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2ggf h LEU 339 Cb 0.78 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2ggf h LEU 339 CO -0.12 1.26 -0.38 -0.07 0.09 0.00 0.00 178.44 179.22 2ggf h LEU 340 N 0.05 0.00 0.00 1.67 3.38 0.30 -3.34 115.31 117.36 2ggf h LEU 340 Ca -0.12 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.50 2ggf h LEU 340 Cb 1.92 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.62 2ggf h LEU 340 CO 0.18 0.38 -2.23 -0.24 0.09 0.00 0.00 178.44 176.62 2ggf n SER 341 N -3.39 1.83 -1.24 -0.43 2.88 0.11 -5.07 113.62 108.32 2ggf n SER 341 Ca 0.01 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2ggf n SER 341 Cb 0.57 -0.55 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 1.90 0.86 3.00 0.46 0.00 0.28 -5.07 105.19 106.62 2ggf n GLY 342 Ca -0.42 -0.36 -0.05 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.84 -0.32 0.06 1.61 2.15 -1.22 -5.05 116.67 111.05 2ggf s ASP 343 Ca 0.00 0.37 -0.27 0.00 0.43 0.00 0.00 52.55 53.08 2ggf s ASP 343 Cb 0.00 1.48 -0.17 0.00 -0.30 0.00 0.00 42.92 43.93 2ggf s ASP 343 CO 0.00 -0.29 1.56 0.40 -0.17 0.00 0.00 175.17 176.67 2ggf h ILE 344 N 6.12 0.74 -0.90 4.11 2.04 -1.97 -2.86 117.51 124.78 2ggf h ILE 344 Ca -0.19 -0.21 0.32 0.00 1.00 0.00 0.00 64.86 65.78 2ggf h ILE 344 Cb 1.15 0.86 -0.16 0.00 -0.74 0.00 0.00 36.82 37.93 2ggf h ILE 344 CO 0.26 0.04 0.26 -0.24 0.00 0.00 0.00 178.15 178.48 2ggf n SER 345 N -5.21 0.11 -0.03 1.72 2.88 -1.26 0.10 113.62 111.93 2ggf n SER 345 Ca -0.10 1.51 -0.12 0.00 -1.33 0.00 0.00 58.87 58.83 2ggf n SER 345 Cb 0.21 -0.65 -0.07 0.00 -0.75 0.00 0.00 64.21 62.95 2ggf n SER 345 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2ggf h GLU 346 N 0.00 0.18 0.23 -1.46 4.57 -1.95 -3.02 114.58 113.14 2ggf h GLU 346 Ca 0.66 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.76 2ggf h GLU 346 Cb 1.59 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.17 2ggf h GLU 346 CO -0.77 0.49 -0.12 0.00 -1.18 0.00 0.00 179.01 177.43 2ggf h ALA 347 N 0.69 -0.32 -0.85 2.92 0.00 0.89 -2.04 119.26 120.55 2ggf h ALA 347 Ca 0.02 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.08 2ggf h ALA 347 Cb 0.42 0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.21 2ggf h ALA 347 CO 0.01 -0.68 0.08 1.49 0.00 0.00 0.00 179.25 180.14 2ggf h GLU 348 N -0.33 0.11 0.41 0.00 4.22 -0.61 0.13 114.58 118.52 2ggf h GLU 348 Ca -0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.38 2ggf h GLU 348 Cb 0.26 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2ggf h GLU 348 CO 0.04 0.07 -0.20 1.25 -2.18 0.00 0.00 179.01 178.00 2ggf h HIS 349 N 0.11 -0.52 -1.00 0.92 2.76 -1.36 -1.17 115.15 114.89 2ggf h HIS 349 Ca 0.50 -0.01 0.21 0.00 -2.20 0.00 0.00 60.37 58.86 2ggf h HIS 349 Cb 0.95 0.17 -0.11 0.00 1.55 0.00 0.00 27.41 29.98 2ggf h HIS 349 CO -0.40 -0.22 0.61 0.00 -1.30 0.00 0.00 177.93 176.62 2ggf h LEU 351 N 0.68 -0.43 -1.49 0.00 5.85 -0.65 -3.12 115.31 116.16 2ggf h LEU 351 Ca 0.59 -0.14 0.16 0.00 0.84 0.00 0.00 57.88 59.33 2ggf h LEU 351 Cb 1.03 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 2ggf h LEU 351 CO -0.38 -0.04 0.54 0.11 -0.34 0.00 0.00 178.44 178.33 2ggf h LYS 352 N -0.89 0.47 -0.76 1.25 1.57 -0.47 0.49 116.57 118.23 2ggf h LYS 352 Ca -0.05 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.81 2ggf h LYS 352 Cb 0.54 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.69 2ggf h LYS 352 CO 0.08 0.31 0.50 0.93 -0.57 0.00 0.00 179.45 180.71 2ggf h GLU 353 N 0.48 0.61 0.00 3.15 5.08 -0.78 0.14 114.58 123.25 2ggf h GLU 353 Ca 0.41 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.69 2ggf h GLU 353 Cb 0.89 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2ggf h GLU 353 CO -0.15 0.40 -0.23 -0.07 -1.00 0.00 0.00 179.01 177.96 2ggf h LEU 354 N 0.63 0.00 -1.81 1.33 3.38 -0.89 -3.47 115.31 114.48 2ggf h LEU 354 Ca 0.36 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.82 2ggf h LEU 354 Cb 0.54 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.22 2ggf h LEU 354 CO -0.13 0.23 -0.88 -0.62 0.09 0.00 0.00 178.44 177.13 2ggf n GLU 355 N -3.57 -3.32 -3.67 1.13 1.02 0.47 -4.94 120.64 107.77 2ggf n GLU 355 Ca -0.01 0.40 -0.29 0.00 -0.02 0.00 0.00 57.16 57.24 2ggf n GLU 355 Cb 0.37 -4.60 -0.13 0.00 -0.02 0.00 0.00 31.44 27.07 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 -3.89 1.24 0.04 2.62 -7.23 -1.26 -4.98 120.40 106.94 2ggf s VAL 356 Ca 0.09 -2.54 -0.20 0.00 -1.81 0.00 0.00 61.98 57.52 2ggf s VAL 356 Cb -0.05 -1.86 -0.14 0.00 0.56 0.00 0.00 36.38 34.89 2ggf s VAL 356 CO 0.89 -0.94 1.35 1.55 -0.31 0.00 0.00 175.10 177.64 2ggf h PRO 357 N 6.63 0.38 0.00 4.82 0.13 -1.95 -2.70 132.00 139.31 2ggf h PRO 357 Ca 0.03 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2ggf h PRO 357 Cb 0.92 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2ggf h PRO 357 CO 0.46 0.76 0.19 -2.39 -0.23 0.00 0.00 178.00 176.79 2ggf n HIS 358 N -4.53 0.53 -0.02 1.56 1.44 -1.26 0.39 115.22 113.33 2ggf n HIS 358 Ca -0.06 0.28 0.07 0.00 -2.01 0.00 0.00 57.72 56.00 2ggf n HIS 358 Cb 0.37 -0.81 -0.15 0.00 0.12 0.00 0.00 29.99 29.52 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 -2.10 0.00 -0.29 -1.40 3.72 -1.11 -4.46 117.46 111.82 2ggf n PHE 359 Ca -0.01 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.51 2ggf n PHE 359 Cb 0.22 -0.51 0.28 0.00 -0.94 0.00 0.00 39.48 38.53 2ggf n PHE 359 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2ggf h HIS 360 N 0.00 0.46 -1.27 1.38 3.86 0.26 0.27 115.15 120.11 2ggf h HIS 360 Ca -0.06 0.05 0.40 0.00 -1.16 0.00 0.00 60.37 59.60 2ggf h HIS 360 Cb 1.06 -0.07 -0.12 0.00 1.06 0.00 0.00 27.41 29.34 2ggf h HIS 360 CO 0.00 -0.13 0.82 1.12 0.86 0.00 0.00 177.93 180.60 2ggf h HIS 361 N 0.29 0.54 0.48 2.45 2.07 -1.78 0.19 115.15 119.40 2ggf h HIS 361 Ca 0.54 0.02 -0.02 0.00 -2.85 0.00 0.00 60.37 58.06 2ggf h HIS 361 Cb 1.04 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 30.89 2ggf h HIS 361 CO -0.21 -0.16 -0.23 1.49 -3.07 0.00 0.00 177.93 175.74 2ggf h GLU 362 N 0.14 -0.63 -0.77 5.12 4.81 -0.77 -2.96 114.58 119.52 2ggf h GLU 362 Ca 0.78 0.04 0.16 0.00 -0.13 0.00 0.00 59.36 60.21 2ggf h GLU 362 Cb 2.38 0.14 -0.15 0.00 0.63 0.00 0.00 28.75 31.76 2ggf h GLU 362 CO -0.40 -0.35 -0.17 -0.11 -0.73 0.00 0.00 179.01 177.26 2ggf n LEU 363 N -5.23 -0.25 0.09 1.64 7.94 0.04 0.97 117.00 122.19 2ggf n LEU 363 Ca -0.09 1.32 -0.13 0.00 -1.11 0.00 0.00 56.01 55.99 2ggf n LEU 363 Cb 0.29 -0.41 -0.08 0.00 0.53 0.00 0.00 43.42 43.76 2ggf n LEU 363 CO 0.25 -1.27 0.81 0.58 -1.11 0.00 0.00 177.39 176.65 2ggf h VAL 364 N 0.00 0.93 -0.37 1.96 2.07 -1.55 -1.10 116.25 118.19 2ggf h VAL 364 Ca 0.38 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.83 2ggf h VAL 364 Cb 0.61 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2ggf h VAL 364 CO -0.78 0.03 0.08 0.22 0.02 0.00 0.00 177.57 177.14 2ggf h TYR 365 N -0.20 0.14 0.17 1.57 5.03 0.78 -2.49 116.97 121.97 2ggf h TYR 365 Ca -0.01 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.32 2ggf h TYR 365 Cb 0.16 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.42 2ggf h TYR 365 CO -0.05 0.03 -0.16 0.93 -1.32 0.00 0.00 178.16 177.58 2ggf h GLU 366 N 0.21 -0.35 -0.83 1.82 5.08 -0.56 -2.08 114.58 117.88 2ggf h GLU 366 Ca 0.18 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.77 2ggf h GLU 366 Cb 0.20 0.08 -0.14 0.00 0.50 0.00 0.00 28.75 29.39 2ggf h GLU 366 CO -0.22 -0.23 0.10 0.00 -1.00 0.00 0.00 179.01 177.65 2ggf h ALA 367 N 0.43 1.01 -0.59 3.43 0.00 -0.87 0.25 119.26 122.91 2ggf h ALA 367 Ca 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2ggf h ALA 367 Cb 0.34 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2ggf h ALA 367 CO -0.04 -0.45 0.23 0.82 0.00 0.00 0.00 179.25 179.82 2ggf h ILE 368 N 0.14 1.23 -0.88 0.00 2.04 -1.07 -2.77 117.51 116.20 2ggf h ILE 368 Ca 0.48 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.67 2ggf h ILE 368 Cb 0.92 0.59 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 2ggf h ILE 368 CO -0.68 0.28 0.56 0.40 0.00 0.00 0.00 178.15 178.70 2ggf h ILE 369 N 0.83 1.09 -0.83 -0.67 1.08 0.12 -1.92 117.51 117.21 2ggf h ILE 369 Ca 0.20 -0.36 0.03 0.00 -0.39 0.00 0.00 64.86 64.34 2ggf h ILE 369 Cb 0.21 -0.04 -0.05 0.00 -3.07 0.00 0.00 36.82 33.87 2ggf h ILE 369 CO -0.02 0.19 0.53 0.24 -0.69 0.00 0.00 178.15 178.41 2ggf h MET 370 N 1.05 1.01 -0.04 2.37 2.86 -0.93 -1.34 114.93 119.90 2ggf h MET 370 Ca 0.37 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.94 2ggf h MET 370 Cb 0.09 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 2ggf h MET 370 CO -0.15 0.67 0.02 0.28 1.06 0.00 0.00 176.91 178.80 2ggf h VAL 371 N 1.04 1.09 -0.75 -2.22 2.07 -1.19 0.20 116.25 116.49 2ggf h VAL 371 Ca 0.33 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.64 2ggf h VAL 371 Cb -0.01 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 2ggf h VAL 371 CO -0.11 0.07 0.46 -0.07 0.02 0.00 0.00 177.57 177.94 2ggf h LEU 372 N -0.03 0.74 -0.28 2.57 3.38 -1.12 -2.58 115.31 117.99 2ggf h LEU 372 Ca 0.02 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2ggf h LEU 372 Cb 0.09 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2ggf h LEU 372 CO -0.00 0.50 -0.15 -0.33 0.09 0.00 0.00 178.44 178.54 2ggf h GLU 373 N 0.88 0.59 -6.25 1.13 4.39 -1.05 -3.46 114.58 110.82 2ggf h GLU 373 Ca 0.31 -0.27 -0.34 0.00 0.34 0.00 0.00 59.36 59.40 2ggf h GLU 373 Cb 0.08 -0.01 0.18 0.00 -0.10 0.00 0.00 28.75 28.90 2ggf h GLU 373 CO -0.13 0.84 -0.92 0.45 -1.16 0.00 0.00 179.01 178.09 2ggf n SER 374 N -4.42 -2.73 0.01 1.42 2.88 0.68 -5.00 113.62 106.46 2ggf n SER 374 Ca -0.04 -0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.28 2ggf n SER 374 Cb 0.38 -0.79 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 2ggf n SER 374 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2ggf n THR 375 N -4.26 0.17 -0.74 2.46 -2.24 -1.26 -4.99 114.28 103.41 2ggf n THR 375 Ca 0.03 0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.77 2ggf n THR 375 Cb 0.50 -1.25 0.07 0.00 -2.10 0.00 0.00 70.33 67.55 2ggf n THR 375 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ggf n GLY 376 N 2.67 -2.36 2.23 3.38 0.00 -1.26 -4.94 105.19 104.91 2ggf n GLY 376 Ca 0.00 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.40 2.59 0.00 1.61 0.28 -1.26 -4.61 120.64 116.85 2ggf n GLU 377 Ca 0.05 -3.27 0.00 0.00 -0.16 0.00 0.00 57.16 53.78 2ggf n GLU 377 Cb 0.17 -2.24 0.00 0.00 1.43 0.00 0.00 31.44 30.80 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 -0.98 0.00 -0.40 -1.84 7.64 -1.26 -4.09 113.62 112.70 2ggf n SER 378 Ca 0.60 0.03 0.32 0.00 1.01 0.00 0.00 58.87 60.82 2ggf n SER 378 Cb 0.97 -0.40 0.61 0.00 -1.01 0.00 0.00 64.21 64.38 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 0.00 0.29 0.20 0.44 2.02 -1.95 0.22 112.91 114.13 2ggf h THR 379 Ca 0.00 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 2ggf h THR 379 Cb 0.00 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 2ggf h THR 379 CO 0.00 0.04 -0.10 0.15 0.37 0.00 0.00 175.52 175.98 2ggf h PHE 380 N 0.19 -0.25 0.20 3.16 3.04 -1.83 0.23 116.94 121.69 2ggf h PHE 380 Ca 0.72 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.65 2ggf h PHE 380 Cb 2.17 0.08 0.00 0.00 2.56 0.00 0.00 35.95 40.77 2ggf h PHE 380 CO -0.00 -0.11 -0.10 -0.22 -2.02 0.00 0.00 178.31 175.86 2ggf h LYS 381 N -0.33 -0.26 0.47 1.11 3.64 -0.81 -1.42 116.57 118.97 2ggf h LYS 381 Ca -0.03 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2ggf h LYS 381 Cb 0.25 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2ggf h LYS 381 CO 0.05 0.04 -0.45 0.52 -2.27 0.00 0.00 179.45 177.34 2ggf h MET 382 N -0.56 -0.88 -0.64 1.90 2.86 -1.03 -2.06 114.93 114.52 2ggf h MET 382 Ca -0.03 0.06 0.13 0.00 -2.06 0.00 0.00 59.70 57.81 2ggf h MET 382 Cb 0.42 0.20 -0.10 0.00 0.06 0.00 0.00 31.60 32.17 2ggf h MET 382 CO 0.04 -0.59 0.05 0.82 1.06 0.00 0.00 176.91 178.30 2ggf h ILE 383 N -0.92 0.52 -0.06 -1.22 1.08 -0.62 -1.19 117.51 115.10 2ggf h ILE 383 Ca -0.06 -0.06 0.02 0.00 -0.39 0.00 0.00 64.86 64.38 2ggf h ILE 383 Cb 0.79 0.33 -0.06 0.00 -3.07 0.00 0.00 36.82 34.82 2ggf h ILE 383 CO -0.05 0.03 -0.51 0.25 -0.69 0.00 0.00 178.15 177.19 2ggf h LEU 384 N 0.17 -1.59 -0.60 1.44 5.85 -0.95 -1.61 115.31 118.02 2ggf h LEU 384 Ca 0.34 0.18 0.10 0.00 0.84 0.00 0.00 57.88 59.34 2ggf h LEU 384 Cb 0.55 0.61 -0.08 0.00 0.37 0.00 0.00 40.66 42.12 2ggf h LEU 384 CO -0.51 -0.47 0.19 0.44 -0.34 0.00 0.00 178.44 177.75 2ggf h ASP 385 N -0.59 0.14 -0.08 1.25 3.32 -0.77 -2.41 116.42 117.27 2ggf h ASP 385 Ca 0.02 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.17 2ggf h ASP 385 Cb 0.66 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.28 2ggf h ASP 385 CO -0.37 0.08 -0.20 0.25 -1.72 0.00 0.00 179.24 177.28 2ggf h LEU 386 N 0.35 -0.65 -0.71 1.55 5.85 -0.34 0.85 115.31 122.21 2ggf h LEU 386 Ca 0.31 0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.25 2ggf h LEU 386 Cb 0.42 0.26 -0.13 0.00 0.37 0.00 0.00 40.66 41.57 2ggf h LEU 386 CO -0.34 -0.17 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.36 2ggf h LEU 387 N -0.19 -0.62 0.21 2.25 3.38 -1.11 -0.72 115.31 118.51 2ggf h LEU 387 Ca 0.02 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2ggf h LEU 387 Cb 0.24 0.43 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 2ggf h LEU 387 CO -0.18 -0.23 -0.41 0.11 0.09 0.00 0.00 178.44 177.82 2ggf h LYS 388 N 0.01 -0.65 -0.14 1.13 1.57 -0.85 -1.13 116.57 116.51 2ggf h LYS 388 Ca 0.35 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.20 2ggf h LYS 388 Cb 0.54 0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.94 2ggf h LYS 388 CO -0.72 -0.43 -0.43 0.77 -0.57 0.00 0.00 179.45 178.07 2ggf h SER 389 N -0.67 -1.36 -0.95 0.86 0.02 -0.03 0.90 113.55 112.31 2ggf h SER 389 Ca -0.02 0.16 0.30 0.00 -0.84 0.00 0.00 61.79 61.39 2ggf h SER 389 Cb 0.63 0.54 -0.16 0.00 0.14 0.00 0.00 62.40 63.55 2ggf h SER 389 CO -0.16 -0.37 0.29 -0.07 -1.14 0.00 0.00 176.83 175.39 2ggf h LEU 390 N -0.43 0.01 0.50 5.07 -0.00 -1.06 0.91 115.31 120.30 2ggf h LEU 390 Ca 0.03 0.23 -0.02 0.00 -0.00 0.00 0.00 57.88 58.12 2ggf h LEU 390 Cb 0.52 0.31 0.00 0.00 -0.00 0.00 0.00 40.66 41.49 2ggf h LEU 390 CO -0.36 -0.27 -0.24 -0.25 -0.00 0.00 0.00 178.44 177.32 2ggf h TRP 391 N 0.12 -0.62 0.00 1.13 7.01 0.20 -1.57 115.95 122.23 2ggf h TRP 391 Ca 0.66 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.64 2ggf h TRP 391 Cb 1.47 0.21 0.00 0.00 -2.10 0.00 0.00 29.16 28.74 2ggf h TRP 391 CO -0.24 -0.30 0.00 0.87 -2.79 0.00 0.00 178.44 175.98 2ggf h LYS 392 N -0.95 0.00 -0.99 2.65 6.56 0.11 -2.06 116.57 121.88 2ggf h LYS 392 Ca -0.07 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 59.30 2ggf h LYS 392 Cb 0.60 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 32.13 2ggf h LYS 392 CO 0.11 0.00 0.28 0.43 -2.06 0.00 0.00 179.45 178.21 2ggf n SER 393 N -2.61 3.33 -3.65 0.86 7.64 0.30 -4.84 113.62 114.65 2ggf n SER 393 Ca -0.01 -2.71 -0.26 0.00 1.01 0.00 0.00 58.87 56.90 2ggf n SER 393 Cb 0.11 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.64 2ggf n SER 393 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ggf n SER 394 N -0.21 -2.63 -0.00 6.43 2.88 -0.77 -4.77 113.62 114.54 2ggf n SER 394 Ca 0.26 -0.55 0.05 0.00 -1.33 0.00 0.00 58.87 57.31 2ggf n SER 394 Cb 1.01 -2.23 -0.08 0.00 -0.75 0.00 0.00 64.21 62.16 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 -3.76 0.00 -3.81 2.46 -1.04 -0.61 -4.98 114.28 102.54 2ggf n THR 395 Ca 0.04 -0.25 -0.16 0.00 -2.04 0.00 0.00 64.05 61.64 2ggf n THR 395 Cb 0.50 0.38 -0.16 0.00 -1.82 0.00 0.00 70.33 69.23 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 -2.61 -0.00 0.09 12.58 1.01 -1.15 -4.92 121.20 126.20 2ggf s ILE 396 Ca -0.03 0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.85 2ggf s ILE 396 Cb 0.07 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.37 2ggf s ILE 396 CO 0.44 0.11 0.10 0.28 0.00 0.00 0.00 174.94 175.87 2ggf s THR 397 N 1.12 4.61 0.07 2.92 -1.32 -1.26 -4.62 115.64 117.15 2ggf s THR 397 Ca -0.08 -0.77 -0.14 0.00 -1.21 0.00 0.00 61.69 59.48 2ggf s THR 397 Cb -0.13 -3.24 -0.03 0.00 -1.51 0.00 0.00 72.50 67.59 2ggf s THR 397 CO -0.03 0.09 0.91 0.52 -2.21 0.00 0.00 174.62 173.91 2ggf n VAL 398 N 0.33 -0.31 -0.22 5.08 0.31 -1.26 -0.49 118.33 121.76 2ggf n VAL 398 Ca -0.08 1.41 -0.07 0.00 -0.01 0.00 0.00 64.34 65.59 2ggf n VAL 398 Cb 0.52 -1.78 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 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 -1.32 -0.01 4.52 5.19 -1.96 0.42 116.42 123.27 2ggf h ASP 399 Ca 0.07 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 2ggf h ASP 399 Cb 0.19 0.57 -0.01 0.00 0.18 0.00 0.00 39.33 40.26 2ggf h ASP 399 CO -0.43 -0.17 -0.05 -0.61 -3.12 0.00 0.00 179.24 174.86 2ggf h GLN 400 N -0.06 -0.06 -1.36 3.56 5.75 -1.19 -0.59 115.11 121.17 2ggf h GLN 400 Ca 0.09 0.00 0.43 0.00 -0.15 0.00 0.00 58.65 59.02 2ggf h GLN 400 Cb 0.29 0.01 -0.11 0.00 1.07 0.00 0.00 27.48 28.74 2ggf h GLN 400 CO -0.54 -0.04 0.90 1.98 -2.65 0.00 0.00 178.83 178.48 2ggf h MET 401 N -0.06 0.10 0.21 1.69 4.05 -0.78 0.15 114.93 120.29 2ggf h MET 401 Ca 0.00 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 2ggf h MET 401 Cb 0.07 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 2ggf h MET 401 CO -0.04 0.06 -0.34 -0.22 0.23 0.00 0.00 176.91 176.60 2ggf h LYS 402 N 0.10 -0.60 -0.21 0.39 3.64 0.15 -2.94 116.57 117.09 2ggf h LYS 402 Ca 0.79 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 60.26 2ggf h LYS 402 Cb 2.58 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 34.47 2ggf h LYS 402 CO -0.33 -0.40 -0.50 -0.09 -2.27 0.00 0.00 179.45 175.86 2ggf h ARG 403 N -0.63 -0.48 -0.32 1.90 9.65 -0.38 -2.09 114.38 122.03 2ggf h ARG 403 Ca 0.01 0.03 0.03 0.00 -1.10 0.00 0.00 59.98 58.95 2ggf h ARG 403 Cb 0.62 0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 29.27 2ggf h ARG 403 CO -0.14 -0.32 -0.19 0.41 2.80 0.00 0.00 179.97 182.52 2ggf n GLY 404 N -1.43 -2.18 0.44 2.80 0.00 -1.12 -1.14 105.19 102.56 2ggf n GLY 404 Ca -0.04 0.64 -0.15 0.00 0.00 0.00 0.00 46.02 46.46 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 -1.33 -0.80 1.61 0.05 -1.41 -2.78 116.97 112.30 2ggf h TYR 405 Ca 0.05 0.03 0.08 0.00 0.05 0.00 0.00 58.73 58.94 2ggf h TYR 405 Cb 0.13 0.55 -0.10 0.00 1.01 0.00 0.00 36.73 38.33 2ggf h TYR 405 CO -0.73 -0.56 -0.46 0.39 -1.05 0.00 0.00 178.16 175.75 2ggf n GLU 406 N -5.15 -0.34 -0.32 4.88 -0.58 -0.41 0.15 120.64 118.87 2ggf n GLU 406 Ca -0.09 1.22 0.20 0.00 -0.42 0.00 0.00 57.16 58.07 2ggf n GLU 406 Cb 0.38 -1.79 0.40 0.00 -0.57 0.00 0.00 31.44 29.86 2ggf n GLU 406 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2ggf h ARG 407 N 0.00 0.12 -0.71 3.49 9.65 -0.85 0.87 114.38 126.94 2ggf h ARG 407 Ca 0.14 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.95 2ggf h ARG 407 Cb 0.35 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.87 2ggf h ARG 407 CO -0.76 0.08 0.17 0.82 2.80 0.00 0.00 179.97 183.08 2ggf h ILE 408 N 0.12 1.26 0.00 1.20 1.08 0.14 0.82 117.51 122.14 2ggf h ILE 408 Ca 0.67 -0.98 -0.00 0.00 -0.39 0.00 0.00 64.86 64.16 2ggf h ILE 408 Cb 1.54 0.53 -0.00 0.00 -3.07 0.00 0.00 36.82 35.82 2ggf h ILE 408 CO -0.75 0.38 -0.02 1.88 -0.69 0.00 0.00 178.15 178.94 2ggf h TYR 409 N 1.08 0.00 0.00 1.37 0.05 0.14 0.14 116.97 119.74 2ggf h TYR 409 Ca 0.22 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.78 2ggf h TYR 409 Cb 0.37 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.07 2ggf h TYR 409 CO 0.03 0.02 -2.18 0.09 -1.05 0.00 0.00 178.16 175.07 2ggf n ASN 410 N -3.14 0.25 -1.62 3.88 3.02 -0.37 -4.29 115.26 112.99 2ggf n ASN 410 Ca -0.00 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.64 2ggf n ASN 410 Cb 0.26 1.34 0.37 0.00 -0.61 0.00 0.00 39.78 41.13 2ggf n ASN 410 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2ggf n GLU 411 N -2.53 3.74 0.13 3.52 1.02 0.28 -4.29 120.64 122.50 2ggf n GLU 411 Ca -0.21 -2.91 -0.01 0.00 -0.02 0.00 0.00 57.16 54.01 2ggf n GLU 411 Cb 0.91 -1.90 0.11 0.00 -0.02 0.00 0.00 31.44 30.54 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 4.21 1.30 -0.10 -3.67 6.09 -1.16 -3.18 117.51 121.01 2ggf h ILE 412 Ca 0.00 -2.36 0.04 0.00 -1.37 0.00 0.00 64.86 61.18 2ggf h ILE 412 Cb 1.45 2.33 -0.05 0.00 0.47 0.00 0.00 36.82 41.02 2ggf h ILE 412 CO 0.23 0.64 -0.25 -0.65 -3.07 0.00 0.00 178.15 175.05 2ggf h PRO 413 N 0.00 -0.31 -0.13 2.19 0.11 -1.86 0.18 132.00 132.18 2ggf h PRO 413 Ca -0.01 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 2ggf h PRO 413 Cb 1.28 0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.46 2ggf h PRO 413 CO 0.08 -0.21 -0.05 -0.44 -0.21 0.00 0.00 178.00 177.18 2ggf h ASP 414 N -0.32 0.26 -0.88 -2.05 3.32 -1.89 -3.13 116.42 111.73 2ggf h ASP 414 Ca 0.09 -0.39 0.12 0.00 0.02 0.00 0.00 57.03 56.87 2ggf h ASP 414 Cb 0.46 -0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.85 2ggf h ASP 414 CO -0.29 0.60 0.49 0.40 -1.72 0.00 0.00 179.24 178.72 2ggf h ILE 415 N -0.07 0.83 -1.14 0.35 2.04 -1.48 -0.36 117.51 117.68 2ggf h ILE 415 Ca 0.03 -0.26 0.32 0.00 1.00 0.00 0.00 64.86 65.95 2ggf h ILE 415 Cb 0.49 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.48 2ggf h ILE 415 CO 0.02 0.14 0.75 -1.13 0.00 0.00 0.00 178.15 177.93 2ggf h ASN 416 N 0.76 0.31 0.23 1.72 -1.24 -0.59 0.45 115.58 117.22 2ggf h ASN 416 Ca 0.45 0.07 0.01 0.00 0.71 0.00 0.00 56.30 57.54 2ggf h ASN 416 Cb 0.53 0.03 -0.04 0.00 0.73 0.00 0.00 38.32 39.57 2ggf h ASN 416 CO -0.30 0.02 -0.51 -0.07 -1.29 0.00 0.00 177.43 175.27 2ggf h LEU 417 N 0.25 -1.50 0.01 0.34 3.38 -1.15 -2.92 115.31 113.71 2ggf h LEU 417 Ca 0.64 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.75 2ggf h LEU 417 Cb 1.90 0.54 0.00 0.00 0.09 0.00 0.00 40.66 43.19 2ggf h LEU 417 CO -0.25 -0.59 -0.00 -2.24 0.09 0.00 0.00 178.44 175.45 2ggf h ASP 418 N -0.82 -0.01 -3.59 -0.43 2.03 -1.34 -3.41 116.42 108.84 2ggf h ASP 418 Ca -0.02 -0.81 -0.75 0.00 -0.73 0.00 0.00 57.03 54.72 2ggf h ASP 418 Cb 0.79 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 39.01 2ggf h ASP 418 CO -0.22 0.88 -0.16 -0.69 -1.03 0.00 0.00 179.24 178.02 2ggf s VAL 419 N -2.32 4.89 -0.02 4.15 1.01 0.15 -4.93 120.40 123.32 2ggf s VAL 419 Ca -0.16 -2.19 -0.25 0.00 0.00 0.00 0.00 61.98 59.39 2ggf s VAL 419 Cb -0.02 -4.11 -0.19 0.00 0.00 0.00 0.00 36.38 32.07 2ggf s VAL 419 CO 0.59 -0.91 1.18 1.55 0.00 0.00 0.00 175.10 177.51 2ggf h PRO 420 N 8.05 -0.13 0.00 2.72 0.13 -1.73 -3.00 132.00 138.04 2ggf h PRO 420 Ca -0.08 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2ggf h PRO 420 Cb 1.05 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2ggf h PRO 420 CO 0.83 0.31 0.00 -2.39 -0.23 0.00 0.00 178.00 176.52 2ggf n HIS 421 N -4.93 0.43 -0.26 1.56 1.44 -1.26 -3.24 115.22 108.97 2ggf n HIS 421 Ca -0.09 0.22 0.15 0.00 -2.01 0.00 0.00 57.72 55.99 2ggf n HIS 421 Cb 0.25 -0.85 0.29 0.00 0.12 0.00 0.00 29.99 29.80 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 -1.94 0.01 0.00 4.39 3.41 -1.13 0.98 113.62 119.35 2ggf n SER 422 Ca -0.01 1.28 -0.10 0.00 -0.26 0.00 0.00 58.87 59.78 2ggf n SER 422 Cb 0.04 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.44 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 -0.83 0.48 7.33 -1.99 -1.81 0.33 116.97 120.48 2ggf h TYR 423 Ca 0.51 0.04 -0.02 0.00 2.00 0.00 0.00 58.73 61.26 2ggf h TYR 423 Cb 1.17 0.39 0.00 0.00 2.00 0.00 0.00 36.73 40.29 2ggf h TYR 423 CO -0.28 -0.38 -0.23 0.77 -0.00 0.00 0.00 178.16 178.04 2ggf h SER 424 N -0.38 -0.55 -0.92 3.88 0.02 0.34 -1.81 113.55 114.12 2ggf h SER 424 Ca 0.10 -0.08 0.23 0.00 -0.84 0.00 0.00 61.79 61.20 2ggf h SER 424 Cb 0.53 0.14 -0.13 0.00 0.14 0.00 0.00 62.40 63.08 2ggf h SER 424 CO -0.34 -0.21 0.42 0.58 -1.14 0.00 0.00 176.83 176.14 2ggf h VAL 425 N -0.92 0.45 0.13 2.27 2.07 -1.03 -0.52 116.25 118.69 2ggf h VAL 425 Ca -0.07 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2ggf h VAL 425 Cb 0.59 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2ggf h VAL 425 CO 0.11 0.07 -0.06 0.25 0.02 0.00 0.00 177.57 177.96 2ggf h LEU 426 N 0.40 -0.14 -0.94 2.57 5.85 -0.27 -1.97 115.31 120.80 2ggf h LEU 426 Ca 0.59 -0.21 0.19 0.00 0.84 0.00 0.00 57.88 59.28 2ggf h LEU 426 Cb 1.15 0.04 -0.11 0.00 0.37 0.00 0.00 40.66 42.10 2ggf h LEU 426 CO -0.54 0.14 0.53 -0.08 -0.34 0.00 0.00 178.44 178.14 2ggf h GLU 427 N -0.43 0.63 0.11 1.25 4.22 -0.25 0.24 114.58 120.35 2ggf h GLU 427 Ca -0.02 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 59.38 2ggf h GLU 427 Cb 0.35 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2ggf h GLU 427 CO 0.03 0.42 -0.05 -0.09 -2.18 0.00 0.00 179.01 177.13 2ggf h ARG 428 N 0.65 -0.14 -0.94 1.92 2.43 -1.11 -1.46 114.38 115.73 2ggf h ARG 428 Ca 0.55 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.77 2ggf h ARG 428 Cb 0.89 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.42 2ggf h ARG 428 CO -0.41 0.16 0.61 0.35 -1.51 0.00 0.00 179.97 179.17 2ggf h PHE 429 N -0.45 1.14 -0.39 2.20 3.04 -0.51 -2.45 116.94 119.52 2ggf h PHE 429 Ca -0.02 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.94 2ggf h PHE 429 Cb 0.37 -0.38 -0.02 0.00 2.56 0.00 0.00 35.95 38.48 2ggf h PHE 429 CO 0.02 0.66 0.14 0.28 -2.02 0.00 0.00 178.31 177.39 2ggf h VAL 430 N 1.18 1.20 -0.05 1.41 2.07 -0.51 -2.75 116.25 118.80 2ggf h VAL 430 Ca 0.37 -0.64 0.02 0.00 0.82 0.00 0.00 66.70 67.27 2ggf h VAL 430 Cb 0.00 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 2ggf h VAL 430 CO -0.12 0.23 -0.43 -0.08 0.02 0.00 0.00 177.57 177.18 2ggf h GLU 431 N 0.48 -0.49 -0.69 1.57 4.81 -0.78 0.38 114.58 119.86 2ggf h GLU 431 Ca 0.13 0.03 0.15 0.00 -0.13 0.00 0.00 59.36 59.54 2ggf h GLU 431 Cb 0.22 0.11 -0.10 0.00 0.63 0.00 0.00 28.75 29.60 2ggf h GLU 431 CO -0.01 -0.33 0.14 0.93 -0.73 0.00 0.00 179.01 179.02 2ggf h GLU 432 N -0.51 0.24 0.07 1.92 4.39 -1.52 -1.46 114.58 117.71 2ggf h GLU 432 Ca 0.02 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2ggf h GLU 432 Cb 0.57 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 2ggf h GLU 432 CO -0.32 0.16 -0.24 0.00 -1.16 0.00 0.00 179.01 177.45 2ggf h PHE 434 N -0.42 0.60 -0.55 0.00 3.57 0.05 0.68 116.94 120.88 2ggf h PHE 434 Ca 0.04 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.52 2ggf h PHE 434 Cb 0.46 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2ggf h PHE 434 CO -0.24 0.08 0.12 1.96 -2.23 0.00 0.00 178.31 178.00 2ggf h GLN 435 N 0.49 0.85 0.00 1.11 1.08 -0.72 -2.13 115.11 115.79 2ggf h GLN 435 Ca 0.45 -0.18 -0.01 0.00 -1.45 0.00 0.00 58.65 57.45 2ggf h GLN 435 Cb 0.69 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.00 2ggf h GLN 435 CO -0.41 0.78 -0.06 0.00 -0.95 0.00 0.00 178.83 178.19 2ggf h ALA 436 N 1.31 1.57 -0.83 3.87 0.00 0.52 -3.46 119.26 122.24 2ggf h ALA 436 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2ggf h ALA 436 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ggf h ALA 436 CO 0.00 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2ggf n GLY 437 N -1.15 0.81 0.01 0.00 0.00 -0.80 -5.00 105.19 99.05 2ggf n GLY 437 Ca -0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.28 0.14 -4.34 -0.61 -5.35 -1.24 -5.05 119.36 101.64 2ggf n ILE 438 Ca 0.00 -0.10 -0.26 0.00 -0.27 0.00 0.00 62.75 62.11 2ggf n ILE 438 Cb 0.32 -0.55 -0.10 0.00 -1.74 0.00 0.00 39.64 37.56 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 -2.10 2.91 0.42 7.28 -4.36 -1.26 -4.77 121.20 119.31 2ggf s ILE 439 Ca -0.01 -1.83 -0.01 0.00 -0.26 0.00 0.00 60.65 58.54 2ggf s ILE 439 Cb 0.01 -2.44 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 2ggf s ILE 439 CO 0.12 -0.14 0.65 -0.44 0.24 0.00 0.00 174.94 175.36 2ggf s SER 440 N -2.87 6.12 0.26 4.36 0.01 -1.26 -4.77 113.70 115.56 2ggf s SER 440 Ca 0.24 0.50 -0.03 0.00 1.31 0.00 0.00 55.95 57.98 2ggf s SER 440 Cb -0.08 -1.91 0.56 0.00 0.21 0.00 0.00 66.02 64.80 2ggf s SER 440 CO 0.14 -0.51 1.65 0.11 0.41 0.00 0.00 173.24 175.04 2ggf h LYS 441 N 0.50 0.19 -0.98 12.44 1.79 -1.99 0.26 116.57 128.78 2ggf h LYS 441 Ca -0.48 -0.01 0.27 0.00 -2.18 0.00 0.00 60.65 58.25 2ggf h LYS 441 Cb 1.23 -0.04 -0.18 0.00 -1.58 0.00 0.00 32.23 31.65 2ggf h LYS 441 CO 0.60 0.13 0.02 1.04 -1.08 0.00 0.00 179.45 180.16 2ggf n GLN 442 N -5.24 -0.08 0.13 3.15 6.02 -1.26 -0.59 117.38 119.51 2ggf n GLN 442 Ca 0.17 1.47 -0.10 0.00 -0.01 0.00 0.00 57.00 58.53 2ggf n GLN 442 Cb 0.56 -2.33 -0.06 0.00 1.02 0.00 0.00 30.24 29.43 2ggf n GLN 442 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2ggf h LEU 443 N 0.00 -0.34 -0.99 1.08 3.38 -1.33 0.44 115.31 117.55 2ggf h LEU 443 Ca 0.60 -0.15 0.36 0.00 0.09 0.00 0.00 57.88 58.77 2ggf h LEU 443 Cb 1.23 0.09 -0.17 0.00 0.09 0.00 0.00 40.66 41.90 2ggf h LEU 443 CO -0.92 0.14 0.43 -0.09 0.09 0.00 0.00 178.44 178.09 2ggf h ARG 444 N -1.00 0.09 0.00 1.13 9.65 -0.80 -0.82 114.38 122.63 2ggf h ARG 444 Ca -0.04 -0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 58.73 2ggf h ARG 444 Cb 0.46 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.01 2ggf h ARG 444 CO 0.07 0.06 -0.61 0.22 2.80 0.00 0.00 179.97 182.50 2ggf h ASP 445 N 0.09 0.00 -0.86 -3.80 1.82 -0.88 -3.35 116.42 109.44 2ggf h ASP 445 Ca 0.76 -0.64 0.36 0.00 -0.39 0.00 0.00 57.03 57.12 2ggf h ASP 445 Cb 1.85 0.00 -0.15 0.00 0.68 0.00 0.00 39.33 41.70 2ggf h ASP 445 CO -0.75 1.17 0.46 0.18 -1.61 0.00 0.00 179.24 178.70 2ggf n LEU 446 N -4.54 0.30 -4.43 2.28 4.77 0.15 -4.53 117.00 111.00 2ggf n LEU 446 Ca -0.19 1.42 -0.48 0.00 -0.03 0.00 0.00 56.01 56.73 2ggf n LEU 446 Cb 0.52 -0.69 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 2ggf n LEU 446 CO 0.23 -1.59 0.08 0.00 -1.33 0.00 0.00 177.39 174.78 2ggf s PRO 448 N -1.05 4.37 -0.16 0.00 0.04 -1.26 -5.03 135.00 131.91 2ggf s PRO 448 Ca 0.64 2.04 -0.21 0.00 0.04 0.00 0.00 61.00 63.52 2ggf s PRO 448 Cb -0.91 -3.22 0.05 0.00 0.04 0.00 0.00 34.50 30.47 2ggf s PRO 448 CO 0.56 -0.31 0.55 -1.54 0.04 0.00 0.00 177.00 176.30 2ggf s SER 449 N 0.62 -0.55 0.38 6.66 1.04 -1.26 -4.81 113.70 115.78 2ggf s SER 449 Ca 0.59 0.95 0.08 0.00 0.48 0.00 0.00 55.95 58.05 2ggf s SER 449 Cb -0.36 0.96 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 2ggf s SER 449 CO 0.35 -0.29 0.19 -0.13 0.98 0.00 0.00 173.24 174.35 2ggf s ARG 450 N -0.11 2.33 -0.22 4.02 0.52 -1.26 -5.08 118.95 119.15 2ggf s ARG 450 Ca -0.03 -1.67 -0.14 0.00 -0.52 0.00 0.00 55.73 53.37 2ggf s ARG 450 Cb -0.03 -2.12 -0.09 0.00 0.52 0.00 0.00 34.95 33.22 2ggf s ARG 450 CO 0.03 -0.02 -0.32 0.45 0.02 0.00 0.00 175.30 175.45 2ggf n SER 451 N -1.24 1.79 0.00 0.23 2.88 -1.26 -5.13 113.62 110.88 2ggf n SER 451 Ca -0.01 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2ggf n SER 451 Cb 0.63 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 2ggf n SER 451 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ggf n GLY 452 N 1.50 4.63 0.17 0.46 0.00 -1.24 -4.88 105.19 105.84 2ggf n GLY 452 Ca -0.38 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2ggf n GLY 452 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ggf h PRO 453 N 0.00 0.03 -0.02 1.61 0.13 -2.03 -3.21 132.00 128.51 2ggf h PRO 453 Ca 0.00 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2ggf h PRO 453 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2ggf h PRO 453 CO 0.00 0.51 -0.00 0.66 -0.23 0.00 0.00 178.00 178.94 2ggf h SER 454 N 0.03 0.04 -3.59 1.44 4.64 -2.07 -3.44 113.55 110.60 2ggf h SER 454 Ca -0.00 -0.33 -0.23 0.00 -0.47 0.00 0.00 61.79 60.76 2ggf h SER 454 Cb 0.87 -0.01 -0.30 0.00 -0.31 0.00 0.00 62.40 62.65 2ggf h SER 454 CO 0.06 0.36 -0.61 -0.94 -0.87 0.00 0.00 176.83 174.84 2ggf s SER 455 N -5.57 -0.10 0.00 4.97 1.04 -1.21 -5.27 113.70 107.56 2ggf s SER 455 Ca -0.15 0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.52 2ggf s SER 455 Cb 0.03 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2ggf s SER 455 CO 0.68 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.41