#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 -5.12 0.14 1.61 7.64 -1.26 -4.92 113.62 111.71 2ggf n SER 321 Ca 0.00 -0.70 -0.06 0.00 1.01 0.00 0.00 58.87 59.12 2ggf n SER 321 Cb 0.00 -4.31 -0.03 0.00 -1.01 0.00 0.00 64.21 58.86 2ggf n SER 321 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2ggf h SER 322 N -2.29 -0.35 0.00 6.43 0.87 -2.13 -3.48 113.55 112.60 2ggf h SER 322 Ca -0.58 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2ggf h SER 322 Cb 1.37 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.42 2ggf h SER 322 CO 0.63 0.03 0.00 0.61 -0.53 0.00 0.00 176.83 177.57 2ggf n GLY 323 N 0.62 5.07 4.01 5.77 0.00 -1.26 -5.16 105.19 114.23 2ggf n GLY 323 Ca -0.05 -1.77 -0.22 0.00 0.00 0.00 0.00 46.02 43.98 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 1.00 4.64 -0.30 1.61 0.01 -1.26 -5.04 113.70 114.36 2ggf s SER 324 Ca 0.00 -0.58 0.08 0.00 1.31 0.00 0.00 55.95 56.76 2ggf s SER 324 Cb 0.00 0.13 0.46 0.00 0.21 0.00 0.00 66.02 66.82 2ggf s SER 324 CO 0.00 -1.66 1.34 -1.20 0.41 0.00 0.00 173.24 172.13 2ggf n SER 325 N -2.59 3.73 -1.58 2.44 7.64 -1.26 -5.02 113.62 116.98 2ggf n SER 325 Ca 0.15 -3.81 -0.01 0.00 1.01 0.00 0.00 58.87 56.22 2ggf n SER 325 Cb 0.61 -0.52 -0.01 0.00 -1.01 0.00 0.00 64.21 63.29 2ggf n SER 325 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ggf n GLY 326 N -0.94 -3.65 0.10 0.23 0.00 -1.26 -5.06 105.19 94.62 2ggf n GLY 326 Ca 0.37 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2ggf n GLY 326 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2ggf n LEU 327 N 0.51 1.76 0.03 0.99 -0.00 -1.26 -4.83 117.00 114.19 2ggf n LEU 327 Ca -0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.73 2ggf n LEU 327 Cb 0.09 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.37 2ggf n LEU 327 CO 0.05 0.28 -0.57 -0.37 -0.00 0.00 0.00 177.39 176.78 2ggf h VAL 328 N 0.00 0.89 -0.93 1.47 -1.51 -2.01 -3.37 116.25 110.78 2ggf h VAL 328 Ca 0.00 -2.42 0.25 0.00 -1.23 0.00 0.00 66.70 63.29 2ggf h VAL 328 Cb 0.63 2.67 -0.17 0.00 -2.13 0.00 0.00 31.29 32.29 2ggf h VAL 328 CO 0.00 0.80 0.04 0.11 -1.23 0.00 0.00 177.57 177.29 2ggf h LYS 329 N -0.07 0.05 0.14 5.19 1.57 -2.00 0.73 116.57 122.18 2ggf h LYS 329 Ca -0.35 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2ggf h LYS 329 Cb 1.95 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 34.20 2ggf h LYS 329 CO 0.10 0.03 -0.41 0.93 -0.57 0.00 0.00 179.45 179.53 2ggf h GLU 330 N 0.05 -0.64 -0.03 3.15 4.39 -1.89 -0.49 114.58 119.13 2ggf h GLU 330 Ca 0.55 0.04 0.03 0.00 0.34 0.00 0.00 59.36 60.33 2ggf h GLU 330 Cb 1.11 0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.84 2ggf h GLU 330 CO -0.85 -0.42 -0.47 0.82 -1.16 0.00 0.00 179.01 176.93 2ggf h ILE 331 N -0.66 0.08 0.00 3.13 2.04 -1.06 0.77 117.51 121.81 2ggf h ILE 331 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2ggf h ILE 331 Cb 0.68 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2ggf h ILE 331 CO -0.23 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.25 2ggf n ASP 332 N -5.45 0.00 -0.34 1.72 2.03 -0.76 -2.48 116.55 111.26 2ggf n ASP 332 Ca -0.06 0.98 -0.09 0.00 0.52 0.00 0.00 54.79 56.13 2ggf n ASP 332 Cb 0.38 -0.48 -0.06 0.00 -0.72 0.00 0.00 41.12 40.24 2ggf n ASP 332 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2ggf h MET 333 N 0.00 -0.09 -0.73 -0.67 2.86 -1.02 0.41 114.93 115.70 2ggf h MET 333 Ca 0.00 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.76 2ggf h MET 333 Cb 0.00 0.02 -0.12 0.00 0.06 0.00 0.00 31.60 31.56 2ggf h MET 333 CO 0.00 -0.06 -0.28 -0.11 1.06 0.00 0.00 176.91 177.52 2ggf n LEU 334 N -5.34 -0.46 -0.28 1.22 7.94 0.26 0.23 117.00 120.58 2ggf n LEU 334 Ca 0.03 1.26 -0.05 0.00 -1.11 0.00 0.00 56.01 56.14 2ggf n LEU 334 Cb 0.31 -0.30 0.09 0.00 0.53 0.00 0.00 43.42 44.05 2ggf n LEU 334 CO -0.11 -1.14 1.06 -0.07 -1.11 0.00 0.00 177.39 176.02 2ggf h LEU 335 N 0.00 1.07 0.34 -1.96 3.38 -0.62 -1.88 115.31 115.64 2ggf h LEU 335 Ca 0.26 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2ggf h LEU 335 Cb 0.44 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2ggf h LEU 335 CO -0.72 0.94 -0.32 0.11 0.09 0.00 0.00 178.44 178.53 2ggf h LYS 336 N 1.14 -0.66 -0.79 1.13 1.79 0.36 -1.45 116.57 118.09 2ggf h LYS 336 Ca 0.26 0.05 0.03 0.00 -2.18 0.00 0.00 60.65 58.81 2ggf h LYS 336 Cb 0.20 0.15 -0.04 0.00 -1.58 0.00 0.00 32.23 30.95 2ggf h LYS 336 CO -0.02 -0.44 0.52 0.93 -1.08 0.00 0.00 179.45 179.35 2ggf h GLU 337 N -0.69 0.95 -0.45 3.15 5.08 -0.97 -0.70 114.58 120.96 2ggf h GLU 337 Ca -0.02 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2ggf h GLU 337 Cb 0.62 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2ggf h GLU 337 CO -0.05 0.63 0.26 -0.92 -1.00 0.00 0.00 179.01 177.92 2ggf h TYR 338 N 0.98 0.59 0.07 4.33 3.20 -0.82 0.19 116.97 125.51 2ggf h TYR 338 Ca 0.31 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.93 2ggf h TYR 338 Cb 0.02 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2ggf h TYR 338 CO -0.00 0.41 -1.18 -0.07 -1.64 0.00 0.00 178.16 175.67 2ggf h LEU 339 N 0.62 0.24 -0.56 2.82 3.38 -0.21 0.84 115.31 122.45 2ggf h LEU 339 Ca 0.16 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2ggf h LEU 339 Cb -0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2ggf h LEU 339 CO -0.03 1.21 -0.55 -0.07 0.09 0.00 0.00 178.44 179.09 2ggf h LEU 340 N 0.04 0.00 0.00 1.67 3.38 -0.55 -3.35 115.31 116.50 2ggf h LEU 340 Ca -0.10 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.49 2ggf h LEU 340 Cb 1.90 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.59 2ggf h LEU 340 CO 0.17 0.55 -2.33 -0.24 0.09 0.00 0.00 178.44 176.67 2ggf n SER 341 N -3.49 1.89 -1.09 -0.43 2.88 0.62 -5.06 113.62 108.93 2ggf n SER 341 Ca 0.00 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 2ggf n SER 341 Cb 0.65 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 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 1.80 0.67 2.72 0.46 0.00 0.29 -5.07 105.19 106.06 2ggf n GLY 342 Ca -0.45 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.82 1.73 0.20 1.61 -1.08 -1.23 -5.02 116.67 110.06 2ggf s ASP 343 Ca 0.00 -0.45 -0.10 0.00 -0.52 0.00 0.00 52.55 51.48 2ggf s ASP 343 Cb 0.00 0.27 0.13 0.00 -1.46 0.00 0.00 42.92 41.85 2ggf s ASP 343 CO 0.00 -0.35 1.80 0.40 0.52 0.00 0.00 175.17 177.54 2ggf h ILE 344 N 6.33 1.23 -0.62 4.11 2.04 -1.98 -2.75 117.51 125.87 2ggf h ILE 344 Ca -0.17 -0.60 0.11 0.00 1.00 0.00 0.00 64.86 65.21 2ggf h ILE 344 Cb 1.13 0.32 -0.08 0.00 -0.74 0.00 0.00 36.82 37.44 2ggf h ILE 344 CO 0.31 0.26 0.16 -1.28 0.00 0.00 0.00 178.15 177.59 2ggf h SER 345 N 0.98 0.06 0.90 1.72 0.87 -2.00 0.28 113.55 116.37 2ggf h SER 345 Ca 0.25 0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.87 2ggf h SER 345 Cb 0.08 0.13 0.01 0.00 -0.44 0.00 0.00 62.40 62.18 2ggf h SER 345 CO -0.04 0.04 -0.43 -0.08 -0.53 0.00 0.00 176.83 175.79 2ggf h GLU 346 N 0.30 -1.17 -0.64 2.24 4.57 -1.93 -2.89 114.58 115.06 2ggf h GLU 346 Ca 0.32 0.08 0.13 0.00 -1.18 0.00 0.00 59.36 58.72 2ggf h GLU 346 Cb 0.47 0.27 -0.10 0.00 -0.16 0.00 0.00 28.75 29.22 2ggf h GLU 346 CO -0.39 -0.78 0.06 0.00 -1.18 0.00 0.00 179.01 176.72 2ggf h ALA 347 N -1.11 0.70 -0.46 2.92 0.00 -1.23 -1.82 119.26 118.26 2ggf h ALA 347 Ca -0.12 0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2ggf h ALA 347 Cb 0.93 0.29 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 2ggf h ALA 347 CO 0.20 -0.37 -0.44 1.49 0.00 0.00 0.00 179.25 180.14 2ggf h GLU 348 N 0.17 -0.29 -0.03 0.00 4.81 -0.83 0.33 114.58 118.75 2ggf h GLU 348 Ca 0.34 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.63 2ggf h GLU 348 Cb 0.56 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 2ggf h GLU 348 CO -0.51 -0.19 -0.26 1.25 -0.73 0.00 0.00 179.01 178.57 2ggf h HIS 349 N -0.30 -0.69 -0.93 0.92 2.76 -1.14 0.29 115.15 116.07 2ggf h HIS 349 Ca 0.15 0.03 0.20 0.00 -2.20 0.00 0.00 60.37 58.54 2ggf h HIS 349 Cb 0.58 0.31 -0.11 0.00 1.55 0.00 0.00 27.41 29.73 2ggf h HIS 349 CO -0.66 -0.35 0.49 0.00 -1.30 0.00 0.00 177.93 176.12 2ggf h LEU 351 N 0.57 -0.66 -1.23 0.00 5.85 0.02 -3.16 115.31 116.70 2ggf h LEU 351 Ca 0.56 0.02 0.25 0.00 0.84 0.00 0.00 57.88 59.55 2ggf h LEU 351 Cb 0.96 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 42.06 2ggf h LEU 351 CO -0.45 -0.30 0.64 0.11 -0.34 0.00 0.00 178.44 178.11 2ggf h LYS 352 N -1.14 0.48 -0.89 1.25 1.57 -0.51 0.16 116.57 117.48 2ggf h LYS 352 Ca -0.08 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.79 2ggf h LYS 352 Cb 0.60 -0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.72 2ggf h LYS 352 CO 0.13 0.32 0.52 0.93 -0.57 0.00 0.00 179.45 180.78 2ggf h GLU 353 N 0.50 0.78 -0.09 3.15 4.39 -0.63 0.16 114.58 122.84 2ggf h GLU 353 Ca 0.60 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 60.27 2ggf h GLU 353 Cb 1.32 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2ggf h GLU 353 CO -0.35 0.52 0.09 -0.07 -1.16 0.00 0.00 179.01 178.04 2ggf h LEU 354 N 0.81 0.00 -1.45 1.33 3.38 -0.64 -3.46 115.31 115.28 2ggf h LEU 354 Ca 0.45 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.98 2ggf h LEU 354 Cb 0.50 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.27 2ggf h LEU 354 CO -0.29 0.00 -0.80 -0.62 0.09 0.00 0.00 178.44 176.82 2ggf n GLU 355 N -3.97 -5.26 -3.63 1.13 1.02 0.54 -4.96 120.64 105.52 2ggf n GLU 355 Ca -0.01 0.62 -0.29 0.00 -0.02 0.00 0.00 57.16 57.46 2ggf n GLU 355 Cb 0.19 -5.32 -0.12 0.00 -0.02 0.00 0.00 31.44 26.17 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 -3.52 1.11 -0.29 2.62 -7.23 -1.26 -4.95 120.40 106.88 2ggf s VAL 356 Ca 0.27 -2.54 0.27 0.00 -1.81 0.00 0.00 61.98 58.17 2ggf s VAL 356 Cb -0.14 -1.77 0.29 0.00 0.56 0.00 0.00 36.38 35.33 2ggf s VAL 356 CO 0.82 -0.98 1.80 1.55 -0.31 0.00 0.00 175.10 177.98 2ggf h PRO 357 N 6.51 0.00 0.00 4.82 0.13 -1.94 -3.24 132.00 138.27 2ggf h PRO 357 Ca 0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 2ggf h PRO 357 Cb 0.92 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 2ggf h PRO 357 CO 0.44 0.00 -0.13 1.12 -0.23 0.00 0.00 178.00 179.20 2ggf h HIS 358 N 0.00 0.00 -1.51 1.56 2.07 -1.99 -3.33 115.15 111.95 2ggf h HIS 358 Ca 0.00 0.00 0.44 0.00 -2.85 0.00 0.00 60.37 57.96 2ggf h HIS 358 Cb 0.40 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 30.31 2ggf h HIS 358 CO 0.00 0.13 1.07 0.74 -3.07 0.00 0.00 177.93 176.80 2ggf h PHE 359 N -1.00 0.11 -0.87 6.12 0.04 -1.99 -0.59 116.94 118.76 2ggf h PHE 359 Ca -0.01 0.00 0.26 0.00 2.80 0.00 0.00 57.97 61.02 2ggf h PHE 359 Cb 0.23 -0.03 -0.16 0.00 2.20 0.00 0.00 35.95 38.19 2ggf h PHE 359 CO -0.01 -0.03 0.09 0.72 -0.60 0.00 0.00 178.31 178.48 2ggf n HIS 360 N -4.18 0.63 -0.28 -0.55 8.25 -1.22 0.34 115.22 118.21 2ggf n HIS 360 Ca 0.35 1.04 0.12 0.00 -0.26 0.00 0.00 57.72 58.96 2ggf n HIS 360 Cb 1.55 -1.20 0.23 0.00 1.12 0.00 0.00 29.99 31.70 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 -5.21 0.50 0.12 4.41 1.44 -0.23 0.19 115.22 116.45 2ggf n HIS 361 Ca 0.22 0.96 -0.12 0.00 -2.01 0.00 0.00 57.72 56.77 2ggf n HIS 361 Cb 0.74 -1.10 -0.08 0.00 0.12 0.00 0.00 29.99 29.68 2ggf n HIS 361 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 2ggf h GLU 362 N 0.00 -0.33 0.00 -1.40 4.57 -0.35 -3.13 114.58 113.94 2ggf h GLU 362 Ca 0.48 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.68 2ggf h GLU 362 Cb 0.99 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 2ggf h GLU 362 CO -0.75 0.02 0.00 -0.11 -1.18 0.00 0.00 179.01 176.99 2ggf n LEU 363 N -5.06 0.00 -0.32 1.64 7.94 0.13 -0.01 117.00 121.33 2ggf n LEU 363 Ca -0.09 0.78 0.03 0.00 -1.11 0.00 0.00 56.01 55.63 2ggf n LEU 363 Cb 0.26 -0.38 0.11 0.00 0.53 0.00 0.00 43.42 43.94 2ggf n LEU 363 CO 0.29 -0.38 0.68 0.58 -1.11 0.00 0.00 177.39 177.44 2ggf h VAL 364 N 0.00 0.10 -0.44 1.96 2.07 -1.58 0.38 116.25 118.74 2ggf h VAL 364 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2ggf h VAL 364 Cb 0.00 0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 29.82 2ggf h VAL 364 CO 0.00 0.00 0.14 0.22 0.02 0.00 0.00 177.57 177.95 2ggf h TYR 365 N -0.01 0.25 -0.15 1.57 5.03 -0.41 -2.40 116.97 120.86 2ggf h TYR 365 Ca 0.42 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.75 2ggf h TYR 365 Cb 0.65 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.87 2ggf h TYR 365 CO -0.70 0.08 0.09 0.93 -1.32 0.00 0.00 178.16 177.24 2ggf h GLU 366 N 0.31 0.20 -0.56 1.82 5.08 0.29 -2.54 114.58 119.18 2ggf h GLU 366 Ca 0.21 -0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.66 2ggf h GLU 366 Cb 0.21 -0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.31 2ggf h GLU 366 CO -0.22 0.17 -0.22 0.00 -1.00 0.00 0.00 179.01 177.73 2ggf h ALA 367 N 1.02 0.22 -0.56 3.43 0.00 -0.44 0.22 119.26 123.15 2ggf h ALA 367 Ca 0.05 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2ggf h ALA 367 Cb 0.01 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2ggf h ALA 367 CO -0.01 -0.53 0.37 0.82 0.00 0.00 0.00 179.25 179.91 2ggf h ILE 368 N -0.08 1.13 -0.52 0.00 2.04 -1.27 -1.79 117.51 117.02 2ggf h ILE 368 Ca 0.26 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 2ggf h ILE 368 Cb 0.49 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2ggf h ILE 368 CO -0.62 0.13 0.12 0.40 0.00 0.00 0.00 178.15 178.18 2ggf h ILE 369 N 0.74 1.22 -0.69 -0.67 1.08 -0.18 -2.24 117.51 116.77 2ggf h ILE 369 Ca 0.21 -0.80 -0.02 0.00 -0.39 0.00 0.00 64.86 63.86 2ggf h ILE 369 Cb -0.05 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.37 2ggf h ILE 369 CO -0.05 0.30 0.34 0.24 -0.69 0.00 0.00 178.15 178.29 2ggf h MET 370 N 0.77 0.98 -0.16 2.37 2.86 -0.35 0.21 114.93 121.61 2ggf h MET 370 Ca 0.17 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.61 2ggf h MET 370 Cb 0.29 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 2ggf h MET 370 CO -0.00 0.75 -0.17 0.28 1.06 0.00 0.00 176.91 178.83 2ggf h VAL 371 N 0.98 1.34 -0.22 -2.22 2.07 -1.34 0.36 116.25 117.22 2ggf h VAL 371 Ca 0.24 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 66.39 2ggf h VAL 371 Cb 0.09 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2ggf h VAL 371 CO -0.03 0.40 -0.00 -0.07 0.02 0.00 0.00 177.57 177.88 2ggf h LEU 372 N 0.02 0.39 -0.15 2.57 3.38 -1.20 -3.23 115.31 117.10 2ggf h LEU 372 Ca 0.02 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 2ggf h LEU 372 Cb 0.71 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2ggf h LEU 372 CO 0.04 0.61 -0.16 -0.33 0.09 0.00 0.00 178.44 178.69 2ggf h GLU 373 N 0.16 0.38 -6.30 1.13 5.08 -0.64 -3.43 114.58 110.96 2ggf h GLU 373 Ca 0.06 -0.20 -0.55 0.00 -1.00 0.00 0.00 59.36 57.67 2ggf h GLU 373 Cb 0.41 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2ggf h GLU 373 CO 0.01 0.76 0.63 0.45 -1.00 0.00 0.00 179.01 179.86 2ggf s SER 374 N -6.16 7.14 0.06 1.42 0.15 0.13 -4.94 113.70 111.51 2ggf s SER 374 Ca -0.14 1.70 -0.15 0.00 0.70 0.00 0.00 55.95 58.07 2ggf s SER 374 Cb 0.05 -2.56 -0.25 0.00 -1.71 0.00 0.00 66.02 61.55 2ggf s SER 374 CO 0.76 -0.51 1.16 0.71 1.20 0.00 0.00 173.24 176.55 2ggf h THR 375 N 5.02 1.29 -1.80 6.45 1.35 -1.83 -3.43 112.91 119.95 2ggf h THR 375 Ca -0.33 -2.31 -0.65 0.00 -0.55 0.00 0.00 66.41 62.57 2ggf h THR 375 Cb 1.16 2.50 0.01 0.00 -1.73 0.00 0.00 68.15 70.09 2ggf h THR 375 CO 0.86 0.71 1.10 0.61 -0.25 0.00 0.00 175.52 178.56 2ggf n GLY 376 N 1.18 1.19 0.35 5.82 0.00 -1.26 -4.83 105.19 107.65 2ggf n GLY 376 Ca -0.12 0.89 0.14 0.00 0.00 0.00 0.00 46.02 46.93 2ggf n GLY 376 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ggf h GLU 377 N 9.29 0.71 -0.71 1.61 5.08 -1.96 -2.08 114.58 126.51 2ggf h GLU 377 Ca -0.45 -0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.00 2ggf h GLU 377 Cb 1.29 -0.16 -0.13 0.00 0.50 0.00 0.00 28.75 30.25 2ggf h GLU 377 CO 0.96 0.47 -0.21 0.45 -1.00 0.00 0.00 179.01 179.68 2ggf n SER 378 N -4.79 -0.33 -0.24 1.42 2.88 -1.26 0.22 113.62 111.53 2ggf n SER 378 Ca 0.24 1.23 0.01 0.00 -1.33 0.00 0.00 58.87 59.03 2ggf n SER 378 Cb 0.60 -0.34 0.13 0.00 -0.75 0.00 0.00 64.21 63.85 2ggf n SER 378 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2ggf h THR 379 N 0.00 0.82 0.19 2.46 2.02 -1.74 0.41 112.91 117.07 2ggf h THR 379 Ca 0.31 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.31 2ggf h THR 379 Cb 0.49 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 2ggf h THR 379 CO -0.73 0.10 -0.47 0.15 0.37 0.00 0.00 175.52 174.94 2ggf h PHE 380 N 0.55 -1.34 0.88 3.16 3.04 0.26 0.20 116.94 123.69 2ggf h PHE 380 Ca 0.34 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.28 2ggf h PHE 380 Cb 0.38 0.56 0.01 0.00 2.56 0.00 0.00 35.95 39.46 2ggf h PHE 380 CO -0.12 -0.58 -0.42 -0.22 -2.02 0.00 0.00 178.31 174.95 2ggf h LYS 381 N -0.76 -1.14 -0.39 1.11 1.63 -1.14 -0.10 116.57 115.78 2ggf h LYS 381 Ca -0.00 0.08 0.04 0.00 -0.85 0.00 0.00 60.65 59.91 2ggf h LYS 381 Cb 0.75 0.26 -0.06 0.00 -0.60 0.00 0.00 32.23 32.57 2ggf h LYS 381 CO -0.23 -0.76 -0.36 0.52 -3.45 0.00 0.00 179.45 175.17 2ggf h MET 382 N -1.20 -0.16 -0.48 1.90 2.86 -0.88 0.54 114.93 117.50 2ggf h MET 382 Ca -0.12 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.63 2ggf h MET 382 Cb 0.90 0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.52 2ggf h MET 382 CO 0.20 -0.11 -0.07 0.82 1.06 0.00 0.00 176.91 178.81 2ggf h ILE 383 N -0.17 0.56 -0.16 -1.22 1.08 -0.63 0.13 117.51 117.10 2ggf h ILE 383 Ca 0.07 -0.02 0.04 0.00 -0.39 0.00 0.00 64.86 64.56 2ggf h ILE 383 Cb 0.34 0.51 -0.07 0.00 -3.07 0.00 0.00 36.82 34.53 2ggf h ILE 383 CO -0.46 0.01 -0.43 0.25 -0.69 0.00 0.00 178.15 176.83 2ggf h LEU 384 N 0.05 -1.37 -0.44 1.44 5.85 0.41 -1.75 115.31 119.51 2ggf h LEU 384 Ca 0.24 0.18 0.04 0.00 0.84 0.00 0.00 57.88 59.18 2ggf h LEU 384 Cb 0.37 0.56 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 2ggf h LEU 384 CO -0.46 -0.43 0.20 -0.78 -0.34 0.00 0.00 178.44 176.64 2ggf h ASP 385 N -0.48 0.28 -0.66 1.25 3.58 -0.37 -2.34 116.42 117.68 2ggf h ASP 385 Ca 0.08 0.03 0.08 0.00 0.42 0.00 0.00 57.03 57.64 2ggf h ASP 385 Cb 0.63 -0.02 -0.10 0.00 1.72 0.00 0.00 39.33 41.55 2ggf h ASP 385 CO -0.42 0.20 -0.52 0.25 -2.88 0.00 0.00 179.24 175.87 2ggf h LEU 386 N 0.41 -1.83 0.36 2.28 5.85 -0.13 0.13 115.31 122.38 2ggf h LEU 386 Ca 0.19 0.27 -0.01 0.00 0.84 0.00 0.00 57.88 59.18 2ggf h LEU 386 Cb 0.12 0.80 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2ggf h LEU 386 CO -0.15 -0.33 -0.28 -0.07 -0.34 0.00 0.00 178.44 177.27 2ggf h LEU 387 N -0.21 -0.74 -0.31 2.25 3.38 -1.20 -1.76 115.31 116.71 2ggf h LEU 387 Ca 0.14 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.21 2ggf h LEU 387 Cb 0.53 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 2ggf h LEU 387 CO -0.75 -0.43 -0.35 0.11 0.09 0.00 0.00 178.44 177.12 2ggf h LYS 388 N -0.65 -0.20 -0.03 1.13 1.57 -0.76 0.21 116.57 117.85 2ggf h LYS 388 Ca -0.03 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2ggf h LYS 388 Cb 0.56 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 2ggf h LYS 388 CO -0.01 -0.14 -0.13 0.77 -0.57 0.00 0.00 179.45 179.37 2ggf h SER 389 N -0.21 -0.41 -0.95 0.86 0.02 -0.74 0.04 113.55 112.17 2ggf h SER 389 Ca 0.05 0.05 0.11 0.00 -0.84 0.00 0.00 61.79 61.16 2ggf h SER 389 Cb 0.35 0.16 -0.13 0.00 0.14 0.00 0.00 62.40 62.92 2ggf h SER 389 CO -0.40 -0.12 -0.51 -0.07 -1.14 0.00 0.00 176.83 174.60 2ggf h LEU 390 N -0.14 -1.85 -0.04 5.07 3.38 -1.08 0.21 115.31 120.86 2ggf h LEU 390 Ca 0.01 0.31 0.02 0.00 0.09 0.00 0.00 57.88 58.31 2ggf h LEU 390 Cb 0.16 0.86 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 2ggf h LEU 390 CO -0.10 -0.26 -0.36 -0.25 0.09 0.00 0.00 178.44 177.56 2ggf h TRP 391 N -0.03 -1.06 0.00 1.13 7.01 -0.20 0.33 115.95 123.12 2ggf h TRP 391 Ca 0.22 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.26 2ggf h TRP 391 Cb 0.49 0.47 0.00 0.00 -2.10 0.00 0.00 29.16 28.02 2ggf h TRP 391 CO -0.94 -0.37 0.18 1.63 -2.79 0.00 0.00 178.44 176.14 2ggf n LYS 392 N -4.46 0.11 -1.11 2.65 4.01 -0.03 -1.54 118.16 117.79 2ggf n LYS 392 Ca -0.04 0.60 -0.25 0.00 -0.51 0.00 0.00 58.31 58.11 2ggf n LYS 392 Cb 0.26 -2.05 0.05 0.00 -0.51 0.00 0.00 35.03 32.78 2ggf n LYS 392 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2ggf n SER 393 N -2.16 6.98 -4.01 4.39 7.64 0.11 -4.85 113.62 121.73 2ggf n SER 393 Ca -0.01 -3.37 -0.33 0.00 1.01 0.00 0.00 58.87 56.17 2ggf n SER 393 Cb 0.20 -1.04 -0.07 0.00 -1.01 0.00 0.00 64.21 62.30 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 -0.14 -1.01 -0.04 6.43 7.64 -0.59 -4.73 113.62 121.19 2ggf n SER 394 Ca 0.44 -1.03 -0.04 0.00 1.01 0.00 0.00 58.87 59.25 2ggf n SER 394 Cb 0.60 -1.32 -0.06 0.00 -1.01 0.00 0.00 64.21 62.42 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 -3.55 0.54 -4.67 0.44 -1.04 -1.10 -5.00 114.28 99.90 2ggf n THR 395 Ca 0.02 -0.32 -0.25 0.00 -2.04 0.00 0.00 64.05 61.46 2ggf n THR 395 Cb 0.42 -0.80 -0.16 0.00 -1.82 0.00 0.00 70.33 67.97 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 -2.19 1.22 -0.00 12.58 1.01 -1.26 -4.94 121.20 127.63 2ggf s ILE 396 Ca -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.04 2ggf s ILE 396 Cb 0.02 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 2ggf s ILE 396 CO 0.31 0.37 0.05 0.28 0.00 0.00 0.00 174.94 175.95 2ggf s THR 397 N 0.35 4.52 0.06 2.92 -1.32 -1.26 -4.71 115.64 116.19 2ggf s THR 397 Ca -0.09 -0.48 -0.11 0.00 -1.21 0.00 0.00 61.69 59.80 2ggf s THR 397 Cb -0.13 -3.05 -0.03 0.00 -1.51 0.00 0.00 72.50 67.78 2ggf s THR 397 CO 0.03 0.36 0.89 0.52 -2.21 0.00 0.00 174.62 174.21 2ggf n VAL 398 N 1.26 -0.24 -0.12 5.08 0.31 -1.26 -0.92 118.33 122.43 2ggf n VAL 398 Ca -0.14 1.38 -0.03 0.00 -0.01 0.00 0.00 64.34 65.54 2ggf n VAL 398 Cb 0.53 -1.75 -0.03 0.00 -0.91 0.00 0.00 33.84 31.68 2ggf n VAL 398 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2ggf n ASP 399 N -3.82 -0.30 -0.00 4.52 2.03 -1.26 0.32 116.55 118.04 2ggf n ASP 399 Ca 0.01 1.05 -0.14 0.00 0.52 0.00 0.00 54.79 56.23 2ggf n ASP 399 Cb 0.09 -0.34 -0.09 0.00 -0.72 0.00 0.00 41.12 40.06 2ggf n ASP 399 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2ggf h GLN 400 N 0.00 -0.52 -1.17 -0.67 5.75 -1.41 0.12 115.11 117.21 2ggf h GLN 400 Ca 0.04 0.04 0.33 0.00 -0.15 0.00 0.00 58.65 58.91 2ggf h GLN 400 Cb 0.11 0.12 -0.07 0.00 1.07 0.00 0.00 27.48 28.71 2ggf h GLN 400 CO -0.26 -0.35 0.81 1.98 -2.65 0.00 0.00 178.83 178.36 2ggf h MET 401 N -0.54 0.13 0.22 1.69 4.05 0.26 -1.80 114.93 118.94 2ggf h MET 401 Ca 0.03 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.44 2ggf h MET 401 Cb 0.62 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.38 2ggf h MET 401 CO -0.39 0.08 -0.28 -0.22 0.23 0.00 0.00 176.91 176.33 2ggf h LYS 402 N 0.13 -0.50 -0.71 0.39 3.64 0.26 -2.66 116.57 117.13 2ggf h LYS 402 Ca 0.60 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 60.10 2ggf h LYS 402 Cb 2.09 0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 33.91 2ggf h LYS 402 CO -0.13 -0.33 -0.51 -0.09 -2.27 0.00 0.00 179.45 176.12 2ggf h ARG 403 N -0.52 -0.17 -0.70 1.90 2.43 -1.22 0.51 114.38 116.61 2ggf h ARG 403 Ca -0.03 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 2ggf h ARG 403 Cb 0.46 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.97 2ggf h ARG 403 CO -0.07 -0.11 -0.41 0.78 -1.51 0.00 0.00 179.97 178.64 2ggf h GLY 404 N -0.18 -1.41 0.69 2.80 0.00 -1.47 0.24 103.07 103.74 2ggf h GLY 404 Ca 0.16 0.91 0.03 0.00 0.00 0.00 0.00 47.33 48.44 2ggf h GLY 404 CO -0.77 -0.28 -0.01 -0.97 0.00 0.00 0.00 176.54 174.51 2ggf h TYR 405 N -0.00 -0.03 -0.05 5.60 -1.99 -1.00 -3.07 116.97 116.43 2ggf h TYR 405 Ca 0.11 0.01 0.02 0.00 2.00 0.00 0.00 58.73 60.87 2ggf h TYR 405 Cb 0.29 0.04 -0.04 0.00 2.00 0.00 0.00 36.73 39.02 2ggf h TYR 405 CO -1.00 -0.04 -0.34 0.93 -0.00 0.00 0.00 178.16 177.71 2ggf h GLU 406 N 0.05 -0.38 -0.78 4.88 5.08 0.74 -0.64 114.58 123.54 2ggf h GLU 406 Ca 0.09 0.03 0.31 0.00 -1.00 0.00 0.00 59.36 58.79 2ggf h GLU 406 Cb 0.12 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.31 2ggf h GLU 406 CO -0.16 -0.25 0.38 -2.13 -1.00 0.00 0.00 179.01 175.85 2ggf n ARG 407 N -4.36 -0.05 0.01 2.33 3.00 0.68 0.15 116.66 118.42 2ggf n ARG 407 Ca -0.04 1.08 -0.13 0.00 -0.00 0.00 0.00 57.85 58.76 2ggf n ARG 407 Cb 0.24 -1.92 -0.09 0.00 0.00 0.00 0.00 32.46 30.70 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 1.25 -0.45 5.15 1.08 -1.09 0.84 117.51 124.29 2ggf h ILE 408 Ca 0.64 -0.80 0.13 0.00 -0.39 0.00 0.00 64.86 64.44 2ggf h ILE 408 Cb 1.67 1.80 -0.02 0.00 -3.07 0.00 0.00 36.82 37.19 2ggf h ILE 408 CO -0.61 0.21 0.44 1.88 -0.69 0.00 0.00 178.15 179.37 2ggf h TYR 409 N -0.36 0.00 0.00 1.37 0.05 0.20 0.78 116.97 119.01 2ggf h TYR 409 Ca -0.00 0.00 -0.36 0.00 0.05 0.00 0.00 58.73 58.42 2ggf h TYR 409 Cb 0.35 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.02 2ggf h TYR 409 CO 0.04 0.00 -2.30 0.09 -1.05 0.00 0.00 178.16 174.94 2ggf n ASN 410 N -3.85 0.12 -1.18 3.88 3.02 -0.73 -4.22 115.26 112.29 2ggf n ASN 410 Ca 0.08 0.06 0.07 0.00 -0.03 0.00 0.00 54.58 54.76 2ggf n ASN 410 Cb 0.63 0.86 0.26 0.00 -0.61 0.00 0.00 39.78 40.92 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 -2.79 2.81 0.13 3.52 1.02 0.29 -4.12 120.64 121.50 2ggf n GLU 411 Ca -0.31 -2.05 -0.01 0.00 -0.02 0.00 0.00 57.16 54.77 2ggf n GLU 411 Cb 1.14 -1.65 0.12 0.00 -0.02 0.00 0.00 31.44 31.04 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 3.05 1.31 -0.57 -3.67 6.09 0.32 -3.23 117.51 120.81 2ggf h ILE 412 Ca 0.00 -2.33 0.09 0.00 -1.37 0.00 0.00 64.86 61.25 2ggf h ILE 412 Cb 1.02 2.31 -0.07 0.00 0.47 0.00 0.00 36.82 40.55 2ggf h ILE 412 CO 0.13 0.63 0.20 -0.65 -3.07 0.00 0.00 178.15 175.39 2ggf h PRO 413 N 0.00 0.36 -0.15 2.19 0.11 -1.84 -1.26 132.00 131.42 2ggf h PRO 413 Ca -0.01 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 2ggf h PRO 413 Cb 1.26 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ggf h PRO 413 CO 0.08 0.24 -0.23 -0.44 -0.21 0.00 0.00 178.00 177.45 2ggf h ASP 414 N 0.37 0.46 -0.19 -2.05 3.32 -1.88 -3.01 116.42 113.44 2ggf h ASP 414 Ca 0.28 -0.53 0.06 0.00 0.02 0.00 0.00 57.03 56.86 2ggf h ASP 414 Cb 0.34 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 2ggf h ASP 414 CO -0.30 0.89 0.23 0.40 -1.72 0.00 0.00 179.24 178.74 2ggf h ILE 415 N 0.03 0.42 -0.41 0.35 2.04 -1.48 -0.06 117.51 118.41 2ggf h ILE 415 Ca 0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 2ggf h ILE 415 Cb 0.80 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2ggf h ILE 415 CO 0.05 0.00 0.03 -1.13 0.00 0.00 0.00 178.15 177.11 2ggf h ASN 416 N 0.00 0.60 0.31 1.72 -1.24 -1.10 0.97 115.58 116.84 2ggf h ASN 416 Ca 0.09 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.99 2ggf h ASN 416 Cb 0.54 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.40 2ggf h ASN 416 CO -0.00 0.65 -0.49 -0.07 -1.29 0.00 0.00 177.43 176.23 2ggf h LEU 417 N 0.61 -1.41 0.01 0.34 -0.00 -1.10 -3.02 115.31 110.74 2ggf h LEU 417 Ca 0.13 0.13 -0.08 0.00 -0.00 0.00 0.00 57.88 58.06 2ggf h LEU 417 Cb 0.34 0.50 -0.01 0.00 -0.00 0.00 0.00 40.66 41.48 2ggf h LEU 417 CO 0.01 -0.60 -0.44 0.44 -0.00 0.00 0.00 178.44 177.85 2ggf h ASP 418 N -0.86 0.03 -3.66 -0.43 3.32 -1.66 -3.42 116.42 109.75 2ggf h ASP 418 Ca -0.03 -0.85 -0.74 0.00 0.02 0.00 0.00 57.03 55.43 2ggf h ASP 418 Cb 0.80 -0.01 -0.29 0.00 0.22 0.00 0.00 39.33 40.05 2ggf h ASP 418 CO -0.17 1.18 -0.21 -0.69 -1.72 0.00 0.00 179.24 177.63 2ggf s VAL 419 N -2.28 4.62 -0.02 -1.35 1.01 0.33 -4.93 120.40 117.79 2ggf s VAL 419 Ca -0.22 -2.27 -0.24 0.00 0.00 0.00 0.00 61.98 59.25 2ggf s VAL 419 Cb -0.00 -3.96 -0.18 0.00 0.00 0.00 0.00 36.38 32.24 2ggf s VAL 419 CO 0.67 -0.89 1.16 1.55 0.00 0.00 0.00 175.10 177.58 2ggf h PRO 420 N 7.92 -0.17 0.00 2.72 0.13 -1.68 -3.00 132.00 137.92 2ggf h PRO 420 Ca -0.07 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2ggf h PRO 420 Cb 1.03 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2ggf h PRO 420 CO 0.81 0.25 0.00 -2.39 -0.23 0.00 0.00 178.00 176.44 2ggf n HIS 421 N -4.95 0.43 -0.25 1.56 1.44 -1.26 -3.20 115.22 108.98 2ggf n HIS 421 Ca -0.09 0.22 0.24 0.00 -2.01 0.00 0.00 57.72 56.09 2ggf n HIS 421 Cb 0.26 -0.86 0.44 0.00 0.12 0.00 0.00 29.99 29.95 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 0.23 0.40 4.39 3.41 -1.14 0.10 113.62 119.07 2ggf n SER 422 Ca -0.01 1.16 -0.18 0.00 -0.26 0.00 0.00 58.87 59.58 2ggf n SER 422 Cb 0.02 -0.57 -0.09 0.00 -0.26 0.00 0.00 64.21 63.32 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 -0.91 0.77 7.33 -1.99 -1.81 0.07 116.97 120.44 2ggf h TYR 423 Ca 0.62 -0.02 -0.03 0.00 2.00 0.00 0.00 58.73 61.29 2ggf h TYR 423 Cb 1.70 0.30 -0.00 0.00 2.00 0.00 0.00 36.73 40.73 2ggf h TYR 423 CO -0.01 -0.56 -0.47 0.77 -0.00 0.00 0.00 178.16 177.89 2ggf h SER 424 N -0.98 -1.18 -1.01 3.88 0.02 0.40 -1.55 113.55 113.14 2ggf h SER 424 Ca -0.10 0.06 0.25 0.00 -0.84 0.00 0.00 61.79 61.16 2ggf h SER 424 Cb 0.75 0.34 -0.12 0.00 0.14 0.00 0.00 62.40 63.51 2ggf h SER 424 CO 0.16 -0.73 0.60 0.58 -1.14 0.00 0.00 176.83 176.31 2ggf h VAL 425 N -1.16 0.53 0.66 2.27 2.07 -1.35 -1.46 116.25 117.82 2ggf h VAL 425 Ca -0.10 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 2ggf h VAL 425 Cb 0.93 -0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.63 2ggf h VAL 425 CO 0.11 0.10 -0.32 0.25 0.02 0.00 0.00 177.57 177.73 2ggf h LEU 426 N 0.56 -0.75 -0.92 2.57 5.85 -0.57 -1.94 115.31 120.11 2ggf h LEU 426 Ca 0.64 -0.00 0.26 0.00 0.84 0.00 0.00 57.88 59.61 2ggf h LEU 426 Cb 1.26 0.19 -0.14 0.00 0.37 0.00 0.00 40.66 42.34 2ggf h LEU 426 CO -0.46 -0.47 0.36 -0.08 -0.34 0.00 0.00 178.44 177.46 2ggf h GLU 427 N -1.00 0.27 0.57 1.25 4.57 -0.27 0.15 114.58 120.12 2ggf h GLU 427 Ca -0.09 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.04 2ggf h GLU 427 Cb 0.71 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 29.25 2ggf h GLU 427 CO 0.15 0.18 -0.28 -0.09 -1.18 0.00 0.00 179.01 177.79 2ggf h ARG 428 N 0.28 -0.74 -0.86 1.92 2.43 -1.25 -1.08 114.38 115.09 2ggf h ARG 428 Ca 0.60 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.95 2ggf h ARG 428 Cb 1.26 0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 30.89 2ggf h ARG 428 CO -0.62 -0.44 0.47 0.35 -1.51 0.00 0.00 179.97 178.22 2ggf h PHE 429 N -0.92 0.84 0.69 2.20 3.04 -0.37 -2.69 116.94 119.73 2ggf h PHE 429 Ca -0.08 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.87 2ggf h PHE 429 Cb 0.64 -0.24 0.01 0.00 2.56 0.00 0.00 35.95 38.91 2ggf h PHE 429 CO -0.01 0.26 -0.33 0.28 -2.02 0.00 0.00 178.31 176.49 2ggf h VAL 430 N 0.71 0.00 -0.75 1.41 2.07 -0.66 -2.45 116.25 116.58 2ggf h VAL 430 Ca 0.45 -0.06 0.07 0.00 0.82 0.00 0.00 66.70 67.98 2ggf h VAL 430 Cb 0.54 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.22 2ggf h VAL 430 CO -0.31 0.00 -0.44 1.21 0.02 0.00 0.00 177.57 178.04 2ggf n GLU 431 N -4.65 -0.33 -0.13 1.57 2.13 -0.42 -0.02 120.64 118.79 2ggf n GLU 431 Ca -0.12 1.24 -0.06 0.00 0.66 0.00 0.00 57.16 58.89 2ggf n GLU 431 Cb 0.37 -1.83 0.01 0.00 0.27 0.00 0.00 31.44 30.25 2ggf n GLU 431 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2ggf h GLU 432 N 0.00 -0.16 -0.40 5.31 4.39 -1.51 -0.69 114.58 121.51 2ggf h GLU 432 Ca 0.12 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.88 2ggf h GLU 432 Cb 0.31 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 28.91 2ggf h GLU 432 CO -0.71 -0.11 -0.54 0.00 -1.16 0.00 0.00 179.01 176.50 2ggf h PHE 434 N -0.39 0.18 -0.52 0.00 3.57 -0.67 0.33 116.94 119.45 2ggf h PHE 434 Ca 0.08 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.75 2ggf h PHE 434 Cb 0.60 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 2ggf h PHE 434 CO -0.71 0.02 0.37 1.96 -2.23 0.00 0.00 178.31 177.72 2ggf h GLN 435 N 0.25 0.06 0.00 1.11 1.08 0.24 0.30 115.11 118.15 2ggf h GLN 435 Ca 0.24 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.40 2ggf h GLN 435 Cb 0.31 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.72 2ggf h GLN 435 CO -0.30 0.04 -0.17 0.00 -0.95 0.00 0.00 178.83 177.45 2ggf h ALA 436 N 1.74 0.90 -1.34 3.87 0.00 0.92 -3.48 119.26 121.86 2ggf h ALA 436 Ca 0.25 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2ggf h ALA 436 Cb 0.90 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2ggf h ALA 436 CO -0.02 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2ggf n GLY 437 N 1.02 0.56 0.02 0.00 0.00 0.10 -5.01 105.19 101.89 2ggf n GLY 437 Ca 0.03 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.99 0.26 -4.12 -0.61 -5.35 -1.20 -5.01 119.36 102.34 2ggf n ILE 438 Ca 0.00 -0.15 -0.27 0.00 -0.27 0.00 0.00 62.75 62.06 2ggf n ILE 438 Cb 0.37 -0.87 -0.04 0.00 -1.74 0.00 0.00 39.64 37.36 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 -2.09 1.84 0.19 7.28 -4.36 -1.26 -4.80 121.20 118.00 2ggf s ILE 439 Ca -0.02 -1.65 0.05 0.00 -0.26 0.00 0.00 60.65 58.76 2ggf s ILE 439 Cb 0.01 -2.50 -0.04 0.00 1.25 0.00 0.00 42.46 41.19 2ggf s ILE 439 CO 0.15 0.00 0.17 -0.44 0.24 0.00 0.00 174.94 175.06 2ggf s SER 440 N -4.06 5.60 0.22 4.36 0.01 -1.26 -4.82 113.70 113.74 2ggf s SER 440 Ca 0.32 -0.13 -0.09 0.00 1.31 0.00 0.00 55.95 57.35 2ggf s SER 440 Cb 0.01 -1.47 0.32 0.00 0.21 0.00 0.00 66.02 65.08 2ggf s SER 440 CO 0.18 0.04 1.69 0.11 0.41 0.00 0.00 173.24 175.68 2ggf h LYS 441 N 2.13 0.22 -0.98 12.44 1.57 -1.99 -0.48 116.57 129.48 2ggf h LYS 441 Ca -0.48 -0.01 0.34 0.00 -1.87 0.00 0.00 60.65 58.63 2ggf h LYS 441 Cb 1.21 -0.05 -0.17 0.00 0.08 0.00 0.00 32.23 33.30 2ggf h LYS 441 CO 0.63 0.15 0.40 0.37 -0.57 0.00 0.00 179.45 180.42 2ggf h GLN 442 N 0.23 0.10 0.29 3.15 4.15 -1.99 -0.46 115.11 120.57 2ggf h GLN 442 Ca 0.33 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.73 2ggf h GLN 442 Cb 0.52 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.19 2ggf h GLN 442 CO -0.45 0.06 -0.14 -0.07 -1.93 0.00 0.00 178.83 176.31 2ggf h LEU 443 N 0.10 -0.33 -1.63 -2.39 3.38 -1.50 -1.09 115.31 111.86 2ggf h LEU 443 Ca 0.73 -0.04 0.41 0.00 0.09 0.00 0.00 57.88 59.08 2ggf h LEU 443 Cb 1.77 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 42.54 2ggf h LEU 443 CO -0.75 0.14 1.23 -0.09 0.09 0.00 0.00 178.44 179.05 2ggf h ARG 444 N -1.08 0.00 0.01 1.13 2.43 -0.81 0.31 114.38 116.36 2ggf h ARG 444 Ca -0.04 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.90 2ggf h ARG 444 Cb 0.34 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 2ggf h ARG 444 CO 0.07 0.00 -1.25 0.22 -1.51 0.00 0.00 179.97 177.49 2ggf h ASP 445 N 0.00 0.03 -1.45 -3.80 1.82 -1.15 -3.36 116.42 108.51 2ggf h ASP 445 Ca 0.68 -0.55 0.44 0.00 -0.39 0.00 0.00 57.03 57.21 2ggf h ASP 445 Cb 3.13 -0.01 -0.10 0.00 0.68 0.00 0.00 39.33 43.03 2ggf h ASP 445 CO -0.01 1.49 0.98 -0.07 -1.61 0.00 0.00 179.24 180.03 2ggf h LEU 446 N -0.94 0.16 -9.27 2.28 3.38 0.96 -3.40 115.31 108.47 2ggf h LEU 446 Ca -0.34 0.08 -0.67 0.00 0.09 0.00 0.00 57.88 57.04 2ggf h LEU 446 Cb 1.34 0.06 0.04 0.00 0.09 0.00 0.00 40.66 42.19 2ggf h LEU 446 CO -0.19 -0.08 0.76 0.00 0.09 0.00 0.00 178.44 179.02 2ggf s PRO 448 N 2.09 0.66 -0.30 0.00 0.04 -1.26 -5.07 135.00 131.15 2ggf s PRO 448 Ca 0.89 0.61 -0.09 0.00 0.04 0.00 0.00 61.00 62.45 2ggf s PRO 448 Cb -0.90 -1.76 0.18 0.00 0.04 0.00 0.00 34.50 32.06 2ggf s PRO 448 CO 0.52 -2.60 0.88 0.45 0.04 0.00 0.00 177.00 176.29 2ggf s SER 449 N -3.44 -0.80 0.23 6.66 0.15 -1.26 -4.82 113.70 110.42 2ggf s SER 449 Ca 0.65 0.60 -0.13 0.00 0.70 0.00 0.00 55.95 57.77 2ggf s SER 449 Cb -0.18 1.71 0.29 0.00 -1.71 0.00 0.00 66.02 66.13 2ggf s SER 449 CO 0.57 -0.15 1.59 0.03 1.20 0.00 0.00 173.24 176.48 2ggf h ARG 450 N 7.92 -0.03 -7.14 5.44 3.08 -1.98 -3.41 114.38 118.27 2ggf h ARG 450 Ca -0.17 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.34 2ggf h ARG 450 Cb 1.16 0.01 0.18 0.00 0.08 0.00 0.00 29.97 31.39 2ggf h ARG 450 CO 0.05 -0.02 0.31 0.43 -1.07 0.00 0.00 179.97 179.67 2ggf n SER 451 N -5.50 1.03 0.00 7.04 7.64 -1.26 -4.56 113.62 118.01 2ggf n SER 451 Ca 0.10 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.60 2ggf n SER 451 Cb 0.39 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 2ggf n SER 451 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ggf n GLY 452 N 0.70 1.44 0.00 0.23 0.00 -1.26 -4.92 105.19 101.37 2ggf n GLY 452 Ca 0.14 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.07 2ggf n GLY 452 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ggf n PRO 453 N 0.00 0.49 0.00 1.61 -0.04 -1.26 -2.25 135.00 133.55 2ggf n PRO 453 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2ggf n PRO 453 Cb 0.00 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 2ggf n PRO 453 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ggf n SER 454 N -0.91 0.57 -0.02 3.54 3.41 -1.26 -4.86 113.62 114.09 2ggf n SER 454 Ca 0.10 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.59 2ggf n SER 454 Cb 0.04 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 2ggf n SER 454 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2ggf h SER 455 N 0.00 0.15 0.00 4.04 4.64 -1.93 -3.54 113.55 116.92 2ggf h SER 455 Ca 0.00 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2ggf h SER 455 Cb 0.44 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2ggf h SER 455 CO 0.00 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.80