#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ios s VAL 324 N 0.00 4.84 0.05 0.52 1.01 -1.26 -5.00 120.40 120.56 2ios s VAL 324 Ca 0.00 1.26 -0.37 0.00 0.00 0.00 0.00 61.98 62.88 2ios s VAL 324 Cb 0.00 -3.93 -0.16 0.00 0.00 0.00 0.00 36.38 32.28 2ios s VAL 324 CO 0.00 0.46 1.42 -3.20 0.00 0.00 0.00 175.10 173.78 2ios n ASN 325 N 2.41 1.91 0.24 3.32 2.85 -1.26 -4.87 115.26 119.86 2ios n ASN 325 Ca -0.08 1.11 0.12 0.00 -0.11 0.00 0.00 54.58 55.62 2ios n ASN 325 Cb 0.51 -1.21 0.52 0.00 1.24 0.00 0.00 39.78 40.83 2ios n ASN 325 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 2ios h HIS 326 N 5.06 0.00 -0.19 1.20 3.86 -2.00 -2.23 115.15 120.86 2ios h HIS 326 Ca -0.47 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 58.56 2ios h HIS 326 Cb 1.32 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.80 2ios h HIS 326 CO 0.62 0.17 -0.58 -0.07 0.86 0.00 0.00 177.93 178.94 2ios h LEU 327 N 0.00 0.84 -0.55 2.43 3.38 -1.99 -2.14 115.31 117.27 2ios h LEU 327 Ca -0.00 -0.59 0.07 0.00 0.09 0.00 0.00 57.88 57.45 2ios h LEU 327 Cb 0.68 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 2ios h LEU 327 CO 0.02 1.28 0.23 0.58 0.09 0.00 0.00 178.44 180.64 2ios h VAL 328 N 0.44 0.85 -0.42 1.22 2.07 -1.80 0.13 116.25 118.75 2ios h VAL 328 Ca -0.02 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.38 2ios h VAL 328 Cb 1.20 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2ios h VAL 328 CO 0.12 0.08 0.22 0.11 0.02 0.00 0.00 177.57 178.12 2ios h LYS 329 N 0.43 0.43 -0.55 1.57 6.56 -1.41 0.63 116.57 124.24 2ios h LYS 329 Ca 0.26 -0.03 -0.12 0.00 -1.06 0.00 0.00 60.65 59.71 2ios h LYS 329 Cb 0.26 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.81 2ios h LYS 329 CO -0.24 0.28 -0.11 0.93 -2.06 0.00 0.00 179.45 178.25 2ios h GLU 330 N 0.44 1.04 -0.37 3.15 4.39 -0.89 -1.22 114.58 121.12 2ios h GLU 330 Ca 0.18 -0.39 -0.05 0.00 0.34 0.00 0.00 59.36 59.43 2ios h GLU 330 Cb 0.07 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2ios h GLU 330 CO -0.11 1.08 0.03 0.82 -1.16 0.00 0.00 179.01 179.66 2ios h ILE 331 N 0.92 1.25 -0.35 3.13 2.04 -0.55 -0.99 117.51 122.96 2ios h ILE 331 Ca 0.14 -0.94 0.01 0.00 1.00 0.00 0.00 64.86 65.08 2ios h ILE 331 Cb 0.69 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 2ios h ILE 331 CO 0.05 0.31 0.21 -0.78 0.00 0.00 0.00 178.15 177.94 2ios h ASP 332 N 0.47 0.34 -0.49 1.72 3.58 -0.75 -0.40 116.42 120.88 2ios h ASP 332 Ca 0.11 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.62 2ios h ASP 332 Cb 0.42 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 41.35 2ios h ASP 332 CO 0.01 0.24 0.19 0.24 -2.88 0.00 0.00 179.24 177.05 2ios h MET 333 N 0.42 0.36 -0.46 0.28 2.86 -1.10 -0.44 114.93 116.86 2ios h MET 333 Ca 0.14 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.81 2ios h MET 333 Cb 0.00 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 2ios h MET 333 CO -0.06 0.24 0.17 1.25 1.06 0.00 0.00 176.91 179.57 2ios h LEU 334 N 0.37 0.19 -0.26 1.22 6.46 -0.91 0.43 115.31 122.82 2ios h LEU 334 Ca 0.23 0.05 -0.14 0.00 -0.12 0.00 0.00 57.88 57.91 2ios h LEU 334 Cb 0.23 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.19 2ios h LEU 334 CO -0.23 0.14 -0.37 -0.07 -0.62 0.00 0.00 178.44 177.29 2ios h LEU 335 N 0.35 0.77 -0.48 2.25 3.38 -0.80 -0.76 115.31 120.03 2ios h LEU 335 Ca 0.22 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2ios h LEU 335 Cb 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2ios h LEU 335 CO -0.21 1.13 0.26 0.11 0.09 0.00 0.00 178.44 179.82 2ios h LYS 336 N 0.43 0.67 -0.71 1.13 1.57 -0.87 -0.34 116.57 118.45 2ios h LYS 336 Ca 0.03 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2ios h LYS 336 Cb 0.96 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.11 2ios h LYS 336 CO 0.09 0.53 0.44 0.93 -0.57 0.00 0.00 179.45 180.86 2ios h GLU 337 N 0.63 0.95 -0.34 3.15 4.39 -0.82 -0.94 114.58 121.61 2ios h GLU 337 Ca 0.17 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.70 2ios h GLU 337 Cb 0.05 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 2ios h GLU 337 CO -0.03 0.66 -0.15 -0.92 -1.16 0.00 0.00 179.01 177.41 2ios h TYR 338 N 0.97 0.80 -0.52 4.33 3.20 -0.81 -1.71 116.97 123.24 2ios h TYR 338 Ca 0.26 -0.20 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 2ios h TYR 338 Cb -0.06 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.00 2ios h TYR 338 CO 0.00 0.90 0.24 -0.07 -1.64 0.00 0.00 178.16 177.60 2ios h LEU 339 N 0.48 0.65 -0.54 2.82 3.38 -0.73 0.45 115.31 121.82 2ios h LEU 339 Ca 0.08 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 2ios h LEU 339 Cb 0.68 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2ios h LEU 339 CO 0.05 0.56 -0.33 -0.07 0.09 0.00 0.00 178.44 178.74 2ios h LEU 340 N 0.73 0.86 0.00 1.67 3.38 -1.06 -3.36 115.31 117.53 2ios h LEU 340 Ca 0.18 -0.36 -0.36 0.00 0.09 0.00 0.00 57.88 57.42 2ios h LEU 340 Cb 0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.53 2ios h LEU 340 CO -0.02 1.11 -2.37 -1.54 0.09 0.00 0.00 178.44 175.71 2ios n SER 341 N -4.07 0.13 -0.29 -0.43 3.41 -0.65 -4.99 113.62 106.72 2ios n SER 341 Ca -0.01 -0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.56 2ios n SER 341 Cb 0.50 0.96 -0.02 0.00 -0.26 0.00 0.00 64.21 65.39 2ios n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ios n GLY 342 N 1.78 0.62 3.44 5.00 0.00 0.16 -4.98 105.19 111.20 2ios n GLY 342 Ca -0.33 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.00 2ios n GLY 342 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ios s ASP 343 N -2.37 6.42 0.16 1.61 -1.08 -1.26 -4.85 116.67 115.31 2ios s ASP 343 Ca 0.00 -1.64 -0.11 0.00 -0.52 0.00 0.00 52.55 50.28 2ios s ASP 343 Cb 0.00 -2.39 0.04 0.00 -1.46 0.00 0.00 42.92 39.12 2ios s ASP 343 CO 0.00 -1.18 1.63 0.40 0.52 0.00 0.00 175.17 176.55 2ios h ILE 344 N 5.86 1.26 -0.87 4.11 2.04 -1.93 -2.60 117.51 125.38 2ios h ILE 344 Ca -0.05 -1.03 0.04 0.00 1.00 0.00 0.00 64.86 64.81 2ios h ILE 344 Cb 1.05 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 2ios h ILE 344 CO 1.12 0.37 0.56 -1.28 0.00 0.00 0.00 178.15 178.92 2ios h SER 345 N 0.82 0.92 -0.64 1.72 0.87 -2.00 -0.89 113.55 114.35 2ios h SER 345 Ca 0.16 -0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.64 2ios h SER 345 Cb 0.47 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.20 2ios h SER 345 CO 0.02 0.63 0.11 -0.08 -0.53 0.00 0.00 176.83 176.98 2ios h GLU 346 N 1.08 1.07 -0.29 2.24 4.81 -1.96 -0.85 114.58 120.68 2ios h GLU 346 Ca 0.35 -0.27 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2ios h GLU 346 Cb 0.03 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2ios h GLU 346 CO -0.12 0.97 0.12 0.00 -0.73 0.00 0.00 179.01 179.25 2ios h ALA 347 N 1.11 0.38 -0.36 2.92 0.00 -1.01 -2.86 119.26 119.45 2ios h ALA 347 Ca 0.20 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2ios h ALA 347 Cb 0.42 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 2ios h ALA 347 CO 0.01 -0.03 0.03 1.49 0.00 0.00 0.00 179.25 180.76 2ios h GLU 348 N 0.32 0.14 -1.73 0.00 4.81 -0.95 -0.00 114.58 117.17 2ios h GLU 348 Ca 0.10 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2ios h GLU 348 Cb 0.18 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2ios h GLU 348 CO -0.01 0.09 0.00 0.72 -0.73 0.00 0.00 179.01 179.08 2ios n HIS 349 N -5.14 0.00 0.00 0.92 8.25 -0.34 -1.00 115.22 117.90 2ios n HIS 349 Ca 0.02 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.91 2ios n HIS 349 Cb 0.17 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 30.94 2ios n HIS 349 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2ios n LEU 351 N 1.26 0.00 -0.30 2.41 7.94 -0.02 -1.22 117.00 127.07 2ios n LEU 351 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2ios n LEU 351 Cb 0.35 0.00 0.19 0.00 0.53 0.00 0.00 43.42 44.49 2ios n LEU 351 CO 0.00 0.00 1.27 0.11 -1.11 0.00 0.00 177.39 177.66 2ios h LYS 352 N 0.00 1.13 0.00 1.96 1.57 -1.32 -2.25 116.57 117.66 2ios h LYS 352 Ca 0.00 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2ios h LYS 352 Cb 0.00 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.05 2ios h LYS 352 CO 0.00 0.75 -0.05 0.93 -0.57 0.00 0.00 179.45 180.51 2ios h GLU 353 N 1.17 0.00 -0.05 3.15 5.08 -1.43 -0.37 114.58 122.14 2ios h GLU 353 Ca 0.34 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.63 2ios h GLU 353 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2ios h GLU 353 CO -0.09 0.05 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.60 2ios h LEU 354 N 0.00 0.09 -1.55 1.33 3.38 -1.69 -3.47 115.31 113.40 2ios h LEU 354 Ca -0.00 -0.03 -0.45 0.00 0.09 0.00 0.00 57.88 57.50 2ios h LEU 354 Cb 0.09 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.83 2ios h LEU 354 CO 0.01 0.38 -0.82 -0.62 0.09 0.00 0.00 178.44 177.48 2ios n GLU 355 N -4.16 -4.91 -2.85 1.13 1.02 -0.15 -4.95 120.64 105.78 2ios n GLU 355 Ca -0.02 0.59 -0.25 0.00 -0.02 0.00 0.00 57.16 57.46 2ios n GLU 355 Cb 0.36 -5.20 -0.02 0.00 -0.02 0.00 0.00 31.44 26.56 2ios n GLU 355 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2ios n VAL 356 N -4.41 2.32 0.34 2.62 0.24 -1.26 -4.90 118.33 113.28 2ios n VAL 356 Ca -0.20 -5.14 0.20 0.00 -2.04 0.00 0.00 64.34 57.17 2ios n VAL 356 Cb 0.63 -1.08 1.09 0.00 -1.47 0.00 0.00 33.84 33.01 2ios n VAL 356 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2ios h PRO 357 N 2.89 0.00 0.00 7.34 0.13 -1.93 0.44 132.00 140.87 2ios h PRO 357 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2ios h PRO 357 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2ios h PRO 357 CO 0.76 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.25 2ios n HIS 358 N -3.05 0.17 -0.53 1.56 8.25 -1.26 -3.08 115.22 117.28 2ios n HIS 358 Ca -0.03 0.05 0.05 0.00 -0.26 0.00 0.00 57.72 57.54 2ios n HIS 358 Cb 0.17 -0.59 0.08 0.00 1.12 0.00 0.00 29.99 30.77 2ios n HIS 358 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2ios n PHE 359 N -1.64 0.06 0.24 4.41 7.35 0.15 -4.69 117.46 123.34 2ios n PHE 359 Ca 0.05 -0.74 0.10 0.00 -0.76 0.00 0.00 57.45 56.11 2ios n PHE 359 Cb 0.29 -0.11 0.61 0.00 0.35 0.00 0.00 39.48 40.63 2ios n PHE 359 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2ios h HIS 360 N 0.17 0.00 -0.87 -5.13 3.86 -1.47 -1.39 115.15 110.32 2ios h HIS 360 Ca 0.00 0.00 0.22 0.00 -1.16 0.00 0.00 60.37 59.43 2ios h HIS 360 Cb 0.78 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.20 2ios h HIS 360 CO 0.03 0.18 0.60 1.12 0.86 0.00 0.00 177.93 180.72 2ios h HIS 361 N 0.00 0.27 -0.44 2.45 2.07 -1.84 -1.01 115.15 116.64 2ios h HIS 361 Ca -0.00 0.01 -0.07 0.00 -2.85 0.00 0.00 60.37 57.45 2ios h HIS 361 Cb 0.44 -0.08 -0.02 0.00 2.57 0.00 0.00 27.41 30.33 2ios h HIS 361 CO 0.00 0.07 -0.02 1.49 -3.07 0.00 0.00 177.93 176.40 2ios h GLU 362 N 0.20 0.79 -0.07 5.12 4.57 -1.59 -0.31 114.58 123.28 2ios h GLU 362 Ca 0.43 -0.26 0.01 0.00 -1.18 0.00 0.00 59.36 58.37 2ios h GLU 362 Cb 1.39 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.90 2ios h GLU 362 CO -0.09 0.86 -0.01 1.25 -1.18 0.00 0.00 179.01 179.84 2ios h LEU 363 N 0.63 -0.05 -0.49 1.64 6.46 -1.30 0.23 115.31 122.42 2ios h LEU 363 Ca 0.12 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.93 2ios h LEU 363 Cb 0.52 0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.45 2ios h LEU 363 CO 0.03 -0.02 0.27 0.58 -0.62 0.00 0.00 178.44 178.68 2ios h VAL 364 N 0.01 1.02 0.21 1.05 2.07 -1.16 0.92 116.25 120.36 2ios h VAL 364 Ca 0.03 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2ios h VAL 364 Cb 0.04 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2ios h VAL 364 CO -0.06 0.10 -0.10 0.22 0.02 0.00 0.00 177.57 177.75 2ios h TYR 365 N 0.54 -0.26 -0.70 1.57 3.20 -0.96 -1.62 116.97 118.74 2ios h TYR 365 Ca 0.20 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 2ios h TYR 365 Cb 0.06 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.37 2ios h TYR 365 CO -0.08 -0.04 0.45 0.93 -1.64 0.00 0.00 178.16 177.78 2ios h GLU 366 N -0.43 0.88 -0.06 1.82 5.08 -0.75 -0.92 114.58 120.20 2ios h GLU 366 Ca -0.03 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2ios h GLU 366 Cb 0.33 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2ios h GLU 366 CO 0.05 0.58 0.02 0.00 -1.00 0.00 0.00 179.01 178.66 2ios h ALA 367 N 1.28 0.08 -0.60 3.43 0.00 -0.74 -1.23 119.26 121.48 2ios h ALA 367 Ca 0.27 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2ios h ALA 367 Cb -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2ios h ALA 367 CO -0.08 -0.33 0.17 0.82 0.00 0.00 0.00 179.25 179.82 2ios h ILE 368 N -0.07 1.23 -0.79 0.00 2.04 -0.99 -1.69 117.51 117.24 2ios h ILE 368 Ca 0.02 -0.82 0.09 0.00 1.00 0.00 0.00 64.86 65.14 2ios h ILE 368 Cb 0.18 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 36.78 2ios h ILE 368 CO -0.00 0.31 0.45 0.58 0.00 0.00 0.00 178.15 179.49 2ios h VAL 369 N 0.89 0.92 -0.79 1.67 2.07 -1.02 -1.47 116.25 118.50 2ios h VAL 369 Ca 0.20 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.49 2ios h VAL 369 Cb 0.28 0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 2ios h VAL 369 CO -0.01 0.14 0.50 0.24 0.02 0.00 0.00 177.57 178.47 2ios h MET 370 N 0.77 0.95 -0.02 1.57 2.86 -0.38 -1.36 114.93 119.32 2ios h MET 370 Ca 0.38 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.99 2ios h MET 370 Cb 0.33 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.74 2ios h MET 370 CO -0.24 0.63 -0.19 0.28 1.06 0.00 0.00 176.91 178.45 2ios h VAL 371 N 0.98 0.54 -0.58 -2.22 2.07 -0.64 -2.00 116.25 114.40 2ios h VAL 371 Ca 0.32 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.86 2ios h VAL 371 Cb 0.02 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2ios h VAL 371 CO -0.12 0.00 0.38 -0.07 0.02 0.00 0.00 177.57 177.79 2ios h LEU 372 N -0.30 0.61 -0.14 2.57 3.38 -0.66 -2.33 115.31 118.43 2ios h LEU 372 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2ios h LEU 372 Cb 0.38 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2ios h LEU 372 CO -0.19 0.43 -0.16 -0.62 0.09 0.00 0.00 178.44 177.99 2ios n GLU 373 N -4.46 0.41 -2.16 1.13 1.02 -0.57 -4.93 120.64 111.08 2ios n GLU 373 Ca 0.06 -0.14 -0.27 0.00 -0.02 0.00 0.00 57.16 56.80 2ios n GLU 373 Cb 0.11 -1.50 0.10 0.00 -0.02 0.00 0.00 31.44 30.13 2ios n GLU 373 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2ios s SER 374 N -2.69 4.42 0.01 1.62 1.04 -0.77 -5.08 113.70 112.25 2ios s SER 374 Ca 0.22 0.37 0.07 0.00 0.48 0.00 0.00 55.95 57.09 2ios s SER 374 Cb 0.19 -0.86 -0.03 0.00 0.10 0.00 0.00 66.02 65.42 2ios s SER 374 CO 0.53 -1.87 -0.19 -0.89 0.98 0.00 0.00 173.24 171.80 2ios s THR 375 N -3.39 2.69 0.00 2.02 2.01 -1.26 -5.04 115.64 112.67 2ios s THR 375 Ca 0.64 -1.07 0.00 0.00 0.31 0.00 0.00 61.69 61.56 2ios s THR 375 Cb -0.09 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.34 2ios s THR 375 CO 0.47 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 175.45 2ios n GLY 376 N 1.90 -1.38 0.43 4.40 0.00 -1.26 -4.42 105.19 104.85 2ios n GLY 376 Ca -0.16 -1.26 0.09 0.00 0.00 0.00 0.00 46.02 44.69 2ios n GLY 376 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ios n GLU 377 N -0.23 1.44 -0.02 1.61 1.02 -1.26 -4.72 120.64 118.49 2ios n GLU 377 Ca 0.00 -0.89 -0.13 0.00 -0.02 0.00 0.00 57.16 56.12 2ios n GLU 377 Cb 0.00 -1.38 -0.09 0.00 -0.02 0.00 0.00 31.44 29.96 2ios n GLU 377 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2ios h SER 378 N 2.09 0.08 -0.38 1.62 0.87 -2.01 -2.52 113.55 113.31 2ios h SER 378 Ca 0.00 -0.40 -0.03 0.00 -1.23 0.00 0.00 61.79 60.13 2ios h SER 378 Cb 0.65 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 2ios h SER 378 CO 0.00 0.47 0.13 0.00 -0.53 0.00 0.00 176.83 176.89 2ios h ALA 379 N 0.62 0.49 -0.58 6.23 0.00 -1.85 0.11 119.26 124.29 2ios h ALA 379 Ca 0.01 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.86 2ios h ALA 379 Cb 0.43 -0.15 -0.11 0.00 0.00 0.00 0.00 17.79 17.97 2ios h ALA 379 CO 0.01 0.12 -0.37 0.35 0.00 0.00 0.00 179.25 179.36 2ios h PHE 380 N 0.46 -1.04 -0.28 0.00 3.04 -1.84 0.22 116.94 117.51 2ios h PHE 380 Ca 0.12 0.07 -0.02 0.00 3.98 0.00 0.00 57.97 62.12 2ios h PHE 380 Cb 0.23 0.54 -0.01 0.00 2.56 0.00 0.00 35.95 39.27 2ios h PHE 380 CO 0.01 -0.40 0.08 -0.22 -2.02 0.00 0.00 178.31 175.76 2ios h LYS 381 N -0.19 0.43 -0.93 1.11 1.63 -1.19 -0.28 116.57 117.15 2ios h LYS 381 Ca 0.21 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 2ios h LYS 381 Cb 0.56 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 2ios h LYS 381 CO -0.68 0.50 0.56 0.52 -3.45 0.00 0.00 179.45 176.90 2ios h MET 382 N 0.28 1.27 -0.05 1.90 2.86 -0.23 -0.90 114.93 120.06 2ios h MET 382 Ca 0.09 -0.12 -0.21 0.00 -2.06 0.00 0.00 59.70 57.40 2ios h MET 382 Cb 0.25 -0.26 0.01 0.00 0.06 0.00 0.00 31.60 31.66 2ios h MET 382 CO -0.00 0.89 -0.80 0.82 1.06 0.00 0.00 176.91 178.88 2ios h ILE 383 N 1.29 1.32 -0.50 -1.22 1.08 -0.51 -0.73 117.51 118.23 2ios h ILE 383 Ca 0.33 -2.08 0.08 0.00 -0.39 0.00 0.00 64.86 62.81 2ios h ILE 383 Cb -0.05 2.30 -0.07 0.00 -3.07 0.00 0.00 36.82 35.94 2ios h ILE 383 CO -0.06 0.64 0.10 0.25 -0.69 0.00 0.00 178.15 178.39 2ios h LEU 384 N 0.28 0.01 -0.64 1.44 5.85 -0.96 0.83 115.31 122.12 2ios h LEU 384 Ca -0.09 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 2ios h LEU 384 Cb 1.46 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.58 2ios h LEU 384 CO 0.16 0.03 0.16 0.44 -0.34 0.00 0.00 178.44 178.89 2ios h ASP 385 N 0.24 0.96 0.03 1.25 3.32 -1.00 -0.43 116.42 120.79 2ios h ASP 385 Ca 0.25 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2ios h ASP 385 Cb 0.33 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2ios h ASP 385 CO -0.32 0.95 -0.02 0.25 -1.72 0.00 0.00 179.24 178.37 2ios h LEU 386 N 0.94 -0.06 -0.77 1.55 5.85 -0.76 -1.39 115.31 120.67 2ios h LEU 386 Ca 0.20 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.80 2ios h LEU 386 Cb 0.36 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2ios h LEU 386 CO 0.00 -0.04 -0.42 -0.07 -0.34 0.00 0.00 178.44 177.57 2ios h LEU 387 N -0.05 0.44 -0.74 2.25 3.38 -0.57 0.55 115.31 120.57 2ios h LEU 387 Ca 0.00 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2ios h LEU 387 Cb 0.05 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2ios h LEU 387 CO -0.00 0.81 0.49 0.11 0.09 0.00 0.00 178.44 179.94 2ios h LYS 388 N 0.34 0.98 -0.12 1.13 1.57 -1.03 0.61 116.57 120.05 2ios h LYS 388 Ca 0.03 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2ios h LYS 388 Cb 0.89 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2ios h LYS 388 CO 0.07 0.65 -0.22 1.03 -0.57 0.00 0.00 179.45 180.41 2ios h SER 389 N 1.01 0.40 0.44 0.86 0.87 -0.65 -1.54 113.55 114.94 2ios h SER 389 Ca 0.27 -0.55 -0.07 0.00 -1.23 0.00 0.00 61.79 60.21 2ios h SER 389 Cb -0.11 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 2ios h SER 389 CO -0.06 0.88 -0.34 -0.07 -0.53 0.00 0.00 176.83 176.71 2ios h LEU 390 N -0.06 0.00 -0.22 2.23 3.38 -0.81 -1.14 115.31 118.69 2ios h LEU 390 Ca 0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2ios h LEU 390 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2ios h LEU 390 CO 0.05 0.34 -0.50 -0.25 0.09 0.00 0.00 178.44 178.17 2ios h TRP 391 N 0.00 0.93 0.00 1.13 7.01 -0.64 -0.26 115.95 124.12 2ios h TRP 391 Ca -0.00 -0.35 -0.11 0.00 2.11 0.00 0.00 58.89 60.54 2ios h TRP 391 Cb 0.65 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.53 2ios h TRP 391 CO 0.00 1.14 -0.51 0.87 -2.79 0.00 0.00 178.44 177.15 2ios h LYS 392 N 0.45 0.00 -0.04 2.65 1.57 -0.94 -2.79 116.57 117.47 2ios h LYS 392 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ios h LYS 392 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2ios h LYS 392 CO 0.11 0.51 0.00 -1.13 -0.57 0.00 0.00 179.45 178.37 2ios n SER 393 N -3.62 0.82 -1.24 0.86 3.41 -0.46 -4.89 113.62 108.49 2ios n SER 393 Ca -0.00 -1.39 -0.14 0.00 -0.26 0.00 0.00 58.87 57.07 2ios n SER 393 Cb 0.58 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 2ios n SER 393 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2ios n SER 394 N -0.31 -4.58 0.06 4.04 7.64 -1.05 -4.91 113.62 114.51 2ios n SER 394 Ca 0.19 0.24 -0.12 0.00 1.01 0.00 0.00 58.87 60.18 2ios n SER 394 Cb 0.22 -3.45 -0.13 0.00 -1.01 0.00 0.00 64.21 59.84 2ios n SER 394 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2ios h THR 395 N 0.00 1.41 -3.31 0.44 2.02 -1.32 -3.40 112.91 108.75 2ios h THR 395 Ca -0.30 -3.08 -0.66 0.00 0.77 0.00 0.00 66.41 63.14 2ios h THR 395 Cb 1.02 2.81 -0.29 0.00 -1.74 0.00 0.00 68.15 69.95 2ios h THR 395 CO 0.41 0.86 -0.76 -0.63 0.37 0.00 0.00 175.52 175.77 2ios s ILE 396 N -2.66 3.01 0.60 3.11 1.01 -0.60 -5.01 121.20 120.67 2ios s ILE 396 Ca -0.04 -0.63 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 2ios s ILE 396 Cb 0.08 -2.32 0.02 0.00 0.01 0.00 0.00 42.46 40.25 2ios s ILE 396 CO 0.85 0.48 0.90 0.42 0.00 0.00 0.00 174.94 177.58 2ios s THR 397 N 1.10 3.25 0.24 2.92 -4.23 -1.26 -4.44 115.64 113.22 2ios s THR 397 Ca 0.01 -0.16 -0.10 0.00 -1.18 0.00 0.00 61.69 60.26 2ios s THR 397 Cb -0.14 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.68 2ios s THR 397 CO -0.02 -0.30 1.62 -0.29 -0.54 0.00 0.00 174.62 175.09 2ios h ILE 398 N -0.22 0.29 -0.46 2.99 6.09 -1.97 -1.12 117.51 123.12 2ios h ILE 398 Ca -0.45 -0.01 -0.08 0.00 -1.37 0.00 0.00 64.86 62.95 2ios h ILE 398 Cb 1.27 0.25 -0.02 0.00 0.47 0.00 0.00 36.82 38.79 2ios h ILE 398 CO 0.60 0.01 -0.02 0.44 -3.07 0.00 0.00 178.15 176.10 2ios h ASP 399 N 0.04 0.75 -0.22 2.19 5.19 -1.99 0.17 116.42 122.55 2ios h ASP 399 Ca 0.38 -0.19 -0.19 0.00 -0.62 0.00 0.00 57.03 56.41 2ios h ASP 399 Cb 0.63 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.95 2ios h ASP 399 CO -0.72 0.83 -0.61 1.56 -3.12 0.00 0.00 179.24 177.19 2ios h GLN 400 N 0.72 0.81 -0.55 3.56 1.08 -1.78 -1.15 115.11 117.79 2ios h GLN 400 Ca 0.14 -0.57 -0.02 0.00 -1.45 0.00 0.00 58.65 56.75 2ios h GLN 400 Cb 0.47 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.97 2ios h GLN 400 CO 0.02 1.19 0.29 1.98 -0.95 0.00 0.00 178.83 181.36 2ios h MET 401 N 0.56 0.78 -0.19 1.46 4.05 -1.05 -1.87 114.93 118.68 2ios h MET 401 Ca -0.01 -0.10 -0.00 0.00 -0.28 0.00 0.00 59.70 59.30 2ios h MET 401 Cb 1.23 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.87 2ios h MET 401 CO 0.13 0.62 0.11 0.87 0.23 0.00 0.00 176.91 178.87 2ios h LYS 402 N 0.74 0.26 -0.72 0.39 6.56 -0.47 -1.72 116.57 121.62 2ios h LYS 402 Ca 0.19 -0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.71 2ios h LYS 402 Cb 0.08 -0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 31.66 2ios h LYS 402 CO -0.03 0.24 0.28 -0.09 -2.06 0.00 0.00 179.45 177.79 2ios h ARG 403 N 0.21 1.07 -0.34 3.15 2.43 -1.16 -0.04 114.38 119.71 2ios h ARG 403 Ca 0.07 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 2ios h ARG 403 Cb 0.05 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2ios h ARG 403 CO -0.01 0.89 0.12 0.78 -1.51 0.00 0.00 179.97 180.23 2ios h GLY 404 N 1.03 0.55 1.05 2.80 0.00 -1.15 -1.14 103.07 106.21 2ios h GLY 404 Ca 0.24 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 2ios h GLY 404 CO -0.02 0.29 0.06 -0.97 0.00 0.00 0.00 176.54 175.90 2ios h TYR 405 N 0.39 1.08 -1.00 5.60 -1.99 -1.16 -2.56 116.97 117.33 2ios h TYR 405 Ca 0.11 -0.17 0.05 0.00 2.00 0.00 0.00 58.73 60.73 2ios h TYR 405 Cb 0.22 -0.29 -0.06 0.00 2.00 0.00 0.00 36.73 38.60 2ios h TYR 405 CO 0.00 0.95 0.65 0.93 -0.00 0.00 0.00 178.16 180.69 2ios h GLU 406 N 0.91 1.17 -0.50 4.88 5.08 -0.74 -0.14 114.58 125.24 2ios h GLU 406 Ca 0.18 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2ios h GLU 406 Cb 0.48 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2ios h GLU 406 CO 0.02 0.77 0.30 0.00 -1.00 0.00 0.00 179.01 179.10 2ios h ARG 407 N 1.20 0.67 -0.37 2.33 3.08 -0.88 -0.29 114.38 120.13 2ios h ARG 407 Ca 0.42 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.41 2ios h ARG 407 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2ios h ARG 407 CO -0.16 0.50 0.24 0.82 -1.07 0.00 0.00 179.97 180.30 2ios h ILE 408 N 0.66 1.11 -0.52 2.04 1.08 -1.05 -1.94 117.51 118.89 2ios h ILE 408 Ca 0.18 -0.22 0.04 0.00 -0.39 0.00 0.00 64.86 64.46 2ios h ILE 408 Cb -0.00 0.59 -0.04 0.00 -3.07 0.00 0.00 36.82 34.29 2ios h ILE 408 CO -0.03 0.11 0.29 1.88 -0.69 0.00 0.00 178.15 179.70 2ios h TYR 409 N 0.50 0.53 -0.94 1.37 0.99 -0.58 0.17 116.97 119.01 2ios h TYR 409 Ca 0.14 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.93 2ios h TYR 409 Cb -0.03 -0.16 -0.06 0.00 1.00 0.00 0.00 36.73 37.48 2ios h TYR 409 CO -0.04 0.28 0.61 -0.91 -0.00 0.00 0.00 178.16 178.10 2ios h ASN 410 N 0.56 1.00 0.26 3.88 2.35 -0.82 -3.23 115.58 119.58 2ios h ASN 410 Ca 0.22 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2ios h ASN 410 Cb 0.09 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.24 2ios h ASN 410 CO -0.13 0.68 -0.83 -0.62 -1.65 0.00 0.00 177.43 174.88 2ios n GLU 411 N -4.45 0.06 -0.35 0.81 1.02 -0.66 -4.45 120.64 112.60 2ios n GLU 411 Ca 0.13 -0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.39 2ios n GLU 411 Cb 0.12 -1.51 0.32 0.00 -0.02 0.00 0.00 31.44 30.34 2ios n GLU 411 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 2ios h ILE 412 N 0.00 0.71 -0.59 -3.67 6.09 -0.72 0.11 117.51 119.44 2ios h ILE 412 Ca 0.00 -0.26 0.07 0.00 -1.37 0.00 0.00 64.86 63.30 2ios h ILE 412 Cb 0.54 -0.13 -0.06 0.00 0.47 0.00 0.00 36.82 37.65 2ios h ILE 412 CO 0.00 0.14 0.27 -0.65 -3.07 0.00 0.00 178.15 174.84 2ios h PRO 413 N 0.77 0.48 -0.10 2.19 0.11 -1.81 0.75 132.00 134.39 2ios h PRO 413 Ca 0.58 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.64 2ios h PRO 413 Cb 0.89 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 2ios h PRO 413 CO -0.38 0.32 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.28 2ios h ASP 414 N 0.50 0.18 -0.81 -2.05 5.19 -1.39 -2.94 116.42 115.10 2ios h ASP 414 Ca 0.28 -0.35 0.12 0.00 -0.62 0.00 0.00 57.03 56.47 2ios h ASP 414 Cb 0.26 -0.05 -0.08 0.00 0.18 0.00 0.00 39.33 39.64 2ios h ASP 414 CO -0.23 0.48 0.42 0.40 -3.12 0.00 0.00 179.24 177.19 2ios h ILE 415 N -0.13 0.79 0.00 0.35 2.04 -0.70 -2.36 117.51 117.50 2ios h ILE 415 Ca 0.03 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 2ios h ILE 415 Cb 0.40 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2ios h ILE 415 CO 0.01 0.12 -0.32 -1.13 0.00 0.00 0.00 178.15 176.83 2ios h ASN 416 N 0.65 0.00 -0.68 1.72 -1.24 -0.81 -0.26 115.58 114.95 2ios h ASN 416 Ca 0.42 0.00 0.10 0.00 0.71 0.00 0.00 56.30 57.53 2ios h ASN 416 Cb 0.52 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.53 2ios h ASN 416 CO -0.32 0.32 0.45 -0.07 -1.29 0.00 0.00 177.43 176.52 2ios h LEU 417 N 0.00 0.47 0.00 0.34 3.38 -1.24 -3.19 115.31 115.07 2ios h LEU 417 Ca -0.00 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 2ios h LEU 417 Cb 0.81 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2ios h LEU 417 CO 0.04 0.28 -2.12 0.47 0.09 0.00 0.00 178.44 177.20 2ios n ASP 418 N -4.48 0.34 -3.78 -0.43 8.00 -0.66 -4.79 116.55 110.74 2ios n ASP 418 Ca 0.11 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.32 2ios n ASP 418 Cb 0.37 1.43 -0.14 0.00 -0.02 0.00 0.00 41.12 42.76 2ios n ASP 418 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ios s VAL 419 N -2.92 1.41 0.54 2.53 1.01 -0.20 -5.11 120.40 117.66 2ios s VAL 419 Ca -0.08 -2.17 -0.22 0.00 0.00 0.00 0.00 61.98 59.51 2ios s VAL 419 Cb 0.09 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 2ios s VAL 419 CO 0.81 -0.77 1.35 -2.84 0.00 0.00 0.00 175.10 173.65 2ios s PRO 420 N 0.83 3.19 -0.21 2.72 0.02 -1.25 -2.49 135.00 137.82 2ios s PRO 420 Ca 0.14 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.39 2ios s PRO 420 Cb -0.21 -2.28 0.00 0.00 0.02 0.00 0.00 34.50 32.02 2ios s PRO 420 CO -0.10 -1.14 0.00 0.72 -0.33 0.00 0.00 177.00 176.15 2ios n HIS 421 N -0.96 0.00 0.06 6.54 8.25 -1.26 -4.93 115.22 122.92 2ios n HIS 421 Ca 0.10 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.52 2ios n HIS 421 Cb 0.45 -0.71 0.19 0.00 1.12 0.00 0.00 29.99 31.04 2ios n HIS 421 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2ios h SER 422 N 0.00 0.36 -0.67 0.41 0.02 -1.80 -2.05 113.55 109.83 2ios h SER 422 Ca -0.04 -0.15 0.03 0.00 -0.84 0.00 0.00 61.79 60.79 2ios h SER 422 Cb 0.18 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 2ios h SER 422 CO 0.06 0.73 0.41 1.88 -1.14 0.00 0.00 176.83 178.77 2ios h TYR 423 N 0.29 0.77 -0.59 3.45 -1.99 -1.90 0.22 116.97 117.22 2ios h TYR 423 Ca 0.03 0.02 -0.07 0.00 2.00 0.00 0.00 58.73 60.71 2ios h TYR 423 Cb 0.84 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 39.30 2ios h TYR 423 CO 0.02 0.43 0.08 1.03 -0.00 0.00 0.00 178.16 179.73 2ios h SER 424 N 0.80 0.95 -0.33 3.88 0.87 -1.91 -0.46 113.55 117.35 2ios h SER 424 Ca 0.27 -0.27 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 2ios h SER 424 Cb 0.04 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 2ios h SER 424 CO -0.11 0.98 -0.12 0.58 -0.53 0.00 0.00 176.83 177.62 2ios h VAL 425 N 0.88 1.29 -0.75 2.23 2.07 -1.09 -2.55 116.25 118.33 2ios h VAL 425 Ca 0.18 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2ios h VAL 425 Cb 0.44 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 2ios h VAL 425 CO 0.01 0.39 0.47 0.25 0.02 0.00 0.00 177.57 178.72 2ios h LEU 426 N 0.44 0.88 -0.72 2.57 5.85 -0.39 -0.20 115.31 123.73 2ios h LEU 426 Ca 0.08 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 2ios h LEU 426 Cb 0.64 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2ios h LEU 426 CO 0.04 0.65 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.62 2ios h GLU 427 N 1.02 0.88 -0.18 1.25 4.81 -1.00 0.18 114.58 121.54 2ios h GLU 427 Ca 0.27 -0.30 -0.16 0.00 -0.13 0.00 0.00 59.36 59.04 2ios h GLU 427 Cb -0.08 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 2ios h GLU 427 CO -0.05 0.94 -0.56 0.00 -0.73 0.00 0.00 179.01 178.60 2ios h ARG 428 N 0.79 0.55 0.16 1.92 3.08 -0.99 -1.54 114.38 118.35 2ios h ARG 428 Ca 0.13 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.82 2ios h ARG 428 Cb 0.61 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2ios h ARG 428 CO 0.04 0.96 -0.07 0.35 -1.07 0.00 0.00 179.97 180.18 2ios h PHE 429 N 0.42 -0.19 -0.65 3.04 3.57 -0.66 -1.48 116.94 120.99 2ios h PHE 429 Ca 0.01 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.62 2ios h PHE 429 Cb 1.11 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 39.82 2ios h PHE 429 CO 0.05 0.16 0.17 0.28 -2.23 0.00 0.00 178.31 176.74 2ios h VAL 430 N -0.57 0.63 -0.70 1.41 2.07 -1.00 -0.40 116.25 117.70 2ios h VAL 430 Ca -0.02 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 2ios h VAL 430 Cb 0.44 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2ios h VAL 430 CO 0.04 0.06 0.32 -0.08 0.02 0.00 0.00 177.57 177.92 2ios h GLU 431 N 0.31 1.02 -0.27 1.57 4.57 -1.20 -0.07 114.58 120.51 2ios h GLU 431 Ca 0.35 -0.16 -0.10 0.00 -1.18 0.00 0.00 59.36 58.27 2ios h GLU 431 Cb 0.52 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2ios h GLU 431 CO -0.41 0.82 -0.25 0.93 -1.18 0.00 0.00 179.01 178.91 2ios h GLU 432 N 0.98 0.53 -0.25 1.92 4.39 -0.73 0.10 114.58 121.52 2ios h GLU 432 Ca 0.24 -0.20 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 2ios h GLU 432 Cb 0.15 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2ios h GLU 432 CO -0.03 0.74 -0.05 0.00 -1.16 0.00 0.00 179.01 178.51 2ios h PHE 434 N 0.23 0.03 0.00 0.00 3.57 -0.74 -2.33 116.94 117.69 2ios h PHE 434 Ca 0.07 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2ios h PHE 434 Cb 0.51 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 2ios h PHE 434 CO 0.05 -0.01 -0.04 1.96 -2.23 0.00 0.00 178.31 178.04 2ios h GLN 435 N 0.09 0.00 -0.00 1.11 1.08 -0.72 -0.82 115.11 115.85 2ios h GLN 435 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2ios h GLN 435 Cb 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2ios h GLN 435 CO -0.16 0.04 -0.13 0.00 -0.95 0.00 0.00 178.83 177.63 2ios n ALA 436 N -2.38 2.68 -0.84 3.87 0.00 -0.68 -4.94 120.51 118.21 2ios n ALA 436 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2ios n ALA 436 Cb 0.12 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.20 2ios n ALA 436 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ios n GLY 437 N 1.45 0.50 0.45 0.00 0.00 -0.32 -4.95 105.19 102.32 2ios n GLY 437 Ca 0.08 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.45 2ios n GLY 437 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ios n ILE 438 N -2.84 0.00 -4.22 -0.61 -5.35 -0.93 -4.89 119.36 100.51 2ios n ILE 438 Ca 0.00 -0.35 -0.18 0.00 -0.27 0.00 0.00 62.75 61.96 2ios n ILE 438 Cb 0.00 1.24 -0.11 0.00 -1.74 0.00 0.00 39.64 39.02 2ios n ILE 438 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 2ios s ILE 439 N -1.96 1.24 0.71 7.28 -4.36 -1.25 -5.01 121.20 117.85 2ios s ILE 439 Ca 0.16 -1.58 -0.13 0.00 -0.26 0.00 0.00 60.65 58.84 2ios s ILE 439 Cb 0.14 -1.38 0.02 0.00 1.25 0.00 0.00 42.46 42.50 2ios s ILE 439 CO 0.41 -0.36 1.10 -0.94 0.24 0.00 0.00 174.94 175.39 2ios s SER 440 N -2.22 4.86 0.38 4.36 1.04 -1.26 -4.71 113.70 116.14 2ios s SER 440 Ca 0.05 1.91 0.12 0.00 0.48 0.00 0.00 55.95 58.51 2ios s SER 440 Cb -0.06 -2.54 0.91 0.00 0.10 0.00 0.00 66.02 64.43 2ios s SER 440 CO 0.03 -1.80 1.87 0.50 0.98 0.00 0.00 173.24 174.81 2ios h LYS 441 N -0.49 0.57 0.23 4.02 3.64 -1.98 -1.04 116.57 121.51 2ios h LYS 441 Ca -0.45 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 2ios h LYS 441 Cb 1.24 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2ios h LYS 441 CO 0.53 0.38 -0.11 0.37 -2.27 0.00 0.00 179.45 178.35 2ios h GLN 442 N 0.59 -0.29 -0.81 1.90 5.75 -1.99 0.60 115.11 120.86 2ios h GLN 442 Ca 0.45 0.02 0.06 0.00 -0.15 0.00 0.00 58.65 59.03 2ios h GLN 442 Cb 0.86 0.07 -0.06 0.00 1.07 0.00 0.00 27.48 29.42 2ios h GLN 442 CO -0.20 -0.08 0.50 1.25 -2.65 0.00 0.00 178.83 177.65 2ios h LEU 443 N -0.46 0.79 -0.22 -2.39 5.85 -1.88 -0.66 115.31 116.35 2ios h LEU 443 Ca -0.03 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.76 2ios h LEU 443 Cb 0.35 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 2ios h LEU 443 CO 0.05 0.51 -0.39 -0.09 -0.34 0.00 0.00 178.44 178.19 2ios h ARG 444 N 0.92 -0.39 0.00 1.25 1.12 -0.96 -2.63 114.38 113.69 2ios h ARG 444 Ca 0.35 0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 59.21 2ios h ARG 444 Cb 0.15 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 30.19 2ios h ARG 444 CO -0.16 -0.26 -0.20 -0.44 -3.11 0.00 0.00 179.97 175.79 2ios h ASP 445 N -0.41 0.00 -1.09 -3.80 3.32 -0.52 -3.47 116.42 110.44 2ios h ASP 445 Ca 0.10 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.82 2ios h ASP 445 Cb 0.59 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.10 2ios h ASP 445 CO -0.44 0.20 0.89 -0.76 -1.72 0.00 0.00 179.24 177.41 2ios s LEU 446 N -7.23 3.18 0.00 1.55 1.43 -0.28 -5.09 118.68 112.23 2ios s LEU 446 Ca -0.02 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2ios s LEU 446 Cb 0.12 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.80 2ios s LEU 446 CO 0.62 -2.77 0.28 -0.81 0.23 0.00 0.00 176.35 173.90