#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ngr s ASN 335 N 0.00 4.14 1.41 1.61 0.01 -1.26 -4.90 114.94 115.95 1ngr s ASN 335 Ca 0.00 0.82 -0.22 0.00 -0.71 0.00 0.00 52.86 52.75 1ngr s ASN 335 Cb 0.00 -1.32 0.36 0.00 0.41 0.00 0.00 41.25 40.70 1ngr s ASN 335 CO 0.00 -2.14 0.93 -0.76 -1.51 0.00 0.00 177.10 173.62 1ngr s LEU 336 N -5.73 -0.98 -0.14 0.60 1.43 -1.26 -1.63 118.68 110.96 1ngr s LEU 336 Ca 0.63 0.94 -0.19 0.00 -1.03 0.00 0.00 54.13 54.48 1ngr s LEU 336 Cb -0.12 -2.40 -0.16 0.00 0.03 0.00 0.00 46.19 43.54 1ngr s LEU 336 CO 0.50 -5.31 0.39 0.22 0.23 0.00 0.00 176.35 172.39 1ngr h TYR 337 N -3.38 0.00 0.00 0.29 5.03 -1.79 -3.35 116.97 113.77 1ngr h TYR 337 Ca -0.46 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.85 1ngr h TYR 337 Cb 1.34 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.62 1ngr h TYR 337 CO -2.94 0.76 0.00 0.43 -1.32 0.00 0.00 178.16 175.09 1ngr n SER 338 N -4.62 0.00 -0.22 -2.11 7.64 -1.26 -0.86 113.62 112.20 1ngr n SER 338 Ca -0.12 0.07 -0.06 0.00 1.01 0.00 0.00 58.87 59.77 1ngr n SER 338 Cb 0.38 -0.18 0.04 0.00 -1.01 0.00 0.00 64.21 63.44 1ngr n SER 338 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1ngr h SER 339 N 0.00 0.74 -2.38 6.43 0.87 -1.94 -3.41 113.55 113.87 1ngr h SER 339 Ca 0.00 -0.08 -0.54 0.00 -1.23 0.00 0.00 61.79 59.95 1ngr h SER 339 Cb 0.03 -0.19 0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1ngr h SER 339 CO 0.00 0.60 1.24 -0.76 -0.53 0.00 0.00 176.83 177.38 1ngr s LEU 340 N -10.00 4.33 0.00 2.23 1.43 -0.04 -4.94 118.68 111.69 1ngr s LEU 340 Ca -0.13 2.53 0.00 0.00 -1.03 0.00 0.00 54.13 55.50 1ngr s LEU 340 Cb 0.13 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.82 1ngr s LEU 340 CO 0.77 -1.12 0.85 -0.81 0.23 0.00 0.00 176.35 176.28 1ngr n PRO 341 N 7.60 0.00 0.00 1.29 -0.04 -1.26 -4.85 135.00 137.73 1ngr n PRO 341 Ca 0.20 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 64.14 1ngr n PRO 341 Cb 0.42 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1ngr n PRO 341 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1ngr n LEU 342 N -1.92 0.00 -0.11 1.53 7.94 -1.26 -4.91 117.00 118.27 1ngr n LEU 342 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 1ngr n LEU 342 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 1ngr n LEU 342 CO 0.00 0.00 0.73 0.71 -1.11 0.00 0.00 177.39 177.72 1ngr h THR 343 N 0.00 1.27 -0.68 1.96 1.35 -2.00 0.18 112.91 115.00 1ngr h THR 343 Ca 0.00 -1.07 -0.04 0.00 -0.55 0.00 0.00 66.41 64.75 1ngr h THR 343 Cb 0.00 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 67.72 1ngr h THR 343 CO 0.00 0.35 0.25 0.50 -0.25 0.00 0.00 175.52 176.37 1ngr h LYS 344 N 0.37 1.01 -0.54 4.72 3.11 -1.94 -1.41 116.57 121.89 1ngr h LYS 344 Ca 0.08 -0.18 0.05 0.00 -2.81 0.00 0.00 60.65 57.80 1ngr h LYS 344 Cb 0.53 -0.17 -0.05 0.00 -1.00 0.00 0.00 32.23 31.54 1ngr h LYS 344 CO 0.03 0.83 0.26 0.00 -2.81 0.00 0.00 179.45 177.76 1ngr h ARG 345 N 0.98 0.49 -0.45 1.90 3.08 -1.05 -0.42 114.38 118.91 1ngr h ARG 345 Ca 0.23 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.26 1ngr h ARG 345 Cb 0.22 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1ngr h ARG 345 CO -0.02 0.32 0.29 0.93 -1.07 0.00 0.00 179.97 180.43 1ngr h GLU 346 N 0.50 0.58 -0.20 0.04 5.08 -0.79 0.19 114.58 119.98 1ngr h GLU 346 Ca 0.24 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1ngr h GLU 346 Cb 0.18 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1ngr h GLU 346 CO -0.18 0.39 0.11 1.49 -1.00 0.00 0.00 179.01 179.81 1ngr h GLU 347 N 0.60 0.27 0.00 2.33 4.22 -0.83 -1.96 114.58 119.22 1ngr h GLU 347 Ca 0.17 -0.02 -0.19 0.00 0.08 0.00 0.00 59.36 59.40 1ngr h GLU 347 Cb -0.05 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1ngr h GLU 347 CO -0.05 0.20 -0.94 0.28 -2.18 0.00 0.00 179.01 176.33 1ngr h VAL 348 N 0.28 1.36 -0.59 0.32 2.07 -0.17 -3.16 116.25 116.37 1ngr h VAL 348 Ca 0.07 -2.98 0.17 0.00 0.82 0.00 0.00 66.70 64.79 1ngr h VAL 348 Cb 0.01 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 1ngr h VAL 348 CO -0.01 0.78 0.46 -0.33 0.02 0.00 0.00 177.57 178.49 1ngr h GLU 349 N 0.00 0.00 -0.45 1.57 5.08 0.15 0.37 114.58 121.30 1ngr h GLU 349 Ca -0.04 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1ngr h GLU 349 Cb 1.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 1ngr h GLU 349 CO 0.10 0.00 -0.22 -0.22 -1.00 0.00 0.00 179.01 177.68 1ngr h LYS 350 N 0.00 0.94 0.00 2.33 3.64 -1.50 -3.37 116.57 118.61 1ngr h LYS 350 Ca 0.28 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1ngr h LYS 350 Cb 1.20 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1ngr h LYS 350 CO -0.00 1.07 -0.05 -0.07 -2.27 0.00 0.00 179.45 178.13 1ngr h LEU 351 N 0.78 0.00 -5.68 5.20 3.38 -0.52 -3.36 115.31 115.10 1ngr h LEU 351 Ca 0.10 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.71 1ngr h LEU 351 Cb 0.79 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.56 1ngr h LEU 351 CO 0.07 0.52 2.31 0.18 0.09 0.00 0.00 178.44 181.60 1ngr n LEU 352 N -4.73 4.01 -4.52 1.67 4.77 0.69 -4.93 117.00 113.96 1ngr n LEU 352 Ca -0.01 -2.58 -0.28 0.00 -0.03 0.00 0.00 56.01 53.11 1ngr n LEU 352 Cb 0.03 -1.00 0.24 0.00 -2.33 0.00 0.00 43.42 40.36 1ngr n LEU 352 CO 0.01 0.16 0.54 0.54 -1.33 0.00 0.00 177.39 177.31 1ngr s ASN 353 N 3.92 1.18 -0.65 -1.43 4.22 -1.26 -4.38 114.94 116.54 1ngr s ASN 353 Ca 0.36 1.40 -0.21 0.00 -2.14 0.00 0.00 52.86 52.28 1ngr s ASN 353 Cb 0.09 -2.18 -0.17 0.00 1.28 0.00 0.00 41.25 40.27 1ngr s ASN 353 CO -0.00 -4.06 1.87 0.61 -2.04 0.00 0.00 177.10 173.48 1ngr n GLY 354 N 0.41 2.32 0.58 0.45 0.00 -1.26 -2.31 105.19 105.37 1ngr n GLY 354 Ca 0.03 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1ngr n GLY 354 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ngr n ASP 355 N 7.20 -0.48 -0.36 1.61 2.03 -1.26 -4.99 116.55 120.30 1ngr n ASP 355 Ca 0.47 0.24 0.10 0.00 0.52 0.00 0.00 54.79 56.12 1ngr n ASP 355 Cb 0.36 0.67 0.28 0.00 -0.72 0.00 0.00 41.12 41.70 1ngr n ASP 355 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1ngr h THR 356 N 0.00 0.83 -0.47 5.18 2.02 -1.85 -0.05 112.91 118.57 1ngr h THR 356 Ca 0.00 -0.31 0.09 0.00 0.77 0.00 0.00 66.41 66.96 1ngr h THR 356 Cb 0.00 -0.15 -0.08 0.00 -1.74 0.00 0.00 68.15 66.18 1ngr h THR 356 CO 0.00 0.16 -0.04 4.11 0.37 0.00 0.00 175.52 180.12 1ngr h TRP 357 N 0.90 -0.11 -0.81 3.16 5.08 -1.66 -2.01 115.95 120.50 1ngr h TRP 357 Ca 0.53 0.04 0.10 0.00 1.08 0.00 0.00 58.89 60.64 1ngr h TRP 357 Cb 0.67 0.12 -0.12 0.00 -3.00 0.00 0.00 29.16 26.83 1ngr h TRP 357 CO -0.00 -0.14 -0.51 0.00 -1.28 0.00 0.00 178.44 176.50 1ngr h ARG 358 N 0.07 -0.11 -0.23 0.12 3.08 -1.27 0.28 114.38 116.32 1ngr h ARG 358 Ca 0.23 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.35 1ngr h ARG 358 Cb 0.35 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.37 1ngr h ARG 358 CO -0.43 -0.08 -0.14 0.45 -1.07 0.00 0.00 179.97 178.71 1ngr h HIS 359 N -0.12 -0.35 0.23 3.04 3.86 -1.46 -0.91 115.15 119.45 1ngr h HIS 359 Ca 0.19 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.43 1ngr h HIS 359 Cb 0.51 0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 1ngr h HIS 359 CO -0.88 -0.21 -0.20 1.25 0.86 0.00 0.00 177.93 178.75 1ngr h LEU 360 N -0.13 -0.53 -0.49 2.43 5.85 -1.00 -2.38 115.31 119.05 1ngr h LEU 360 Ca 0.13 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.99 1ngr h LEU 360 Cb 0.32 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 1ngr h LEU 360 CO -0.31 -0.31 -0.03 0.00 -0.34 0.00 0.00 178.44 177.46 1ngr h ALA 361 N 0.26 0.43 -0.74 1.25 0.00 0.05 -0.05 119.26 120.46 1ngr h ALA 361 Ca -0.01 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1ngr h ALA 361 Cb 0.41 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1ngr h ALA 361 CO -0.03 -0.40 0.23 0.78 0.00 0.00 0.00 179.25 179.83 1ngr h GLY 362 N 0.08 1.25 2.00 0.00 0.00 -1.17 -2.35 103.07 102.89 1ngr h GLY 362 Ca 0.25 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1ngr h GLY 362 CO -0.44 0.70 0.00 0.83 0.00 0.00 0.00 176.54 177.63 1ngr h GLU 363 N 1.11 0.00 -0.97 4.80 4.39 -0.68 -2.16 114.58 121.07 1ngr h GLU 363 Ca 0.24 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.74 1ngr h GLU 363 Cb 0.32 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.85 1ngr h GLU 363 CO -0.01 0.00 0.26 1.28 -1.16 0.00 0.00 179.01 179.38 1ngr n LEU 364 N -2.71 4.49 -3.03 1.33 4.77 -0.15 -4.93 117.00 116.77 1ngr n LEU 364 Ca 0.00 -2.34 -0.20 0.00 -0.03 0.00 0.00 56.01 53.45 1ngr n LEU 364 Cb 0.21 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1ngr n LEU 364 CO 0.22 0.70 -0.07 0.61 -1.33 0.00 0.00 177.39 177.52 1ngr n GLY 365 N -0.17 -0.50 3.41 -0.72 0.00 -0.81 -4.98 105.19 101.42 1ngr n GLY 365 Ca 0.25 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 1ngr n GLY 365 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ngr s TYR 366 N -2.87 3.04 0.90 1.61 1.51 -1.25 -5.08 117.35 115.19 1ngr s TYR 366 Ca 0.26 -0.58 -0.14 0.00 -1.01 0.00 0.00 57.07 55.60 1ngr s TYR 366 Cb -0.13 -2.15 0.01 0.00 -0.11 0.00 0.00 41.96 39.57 1ngr s TYR 366 CO 0.32 -0.38 0.40 1.04 -1.11 0.00 0.00 175.55 175.82 1ngr n GLN 367 N 4.69 -0.13 0.28 -0.62 6.02 -1.26 -4.55 117.38 121.81 1ngr n GLN 367 Ca -0.17 0.01 0.13 0.00 -0.01 0.00 0.00 57.00 56.95 1ngr n GLN 367 Cb 0.51 -1.83 0.82 0.00 1.02 0.00 0.00 30.24 30.76 1ngr n GLN 367 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1ngr h PRO 368 N -1.25 0.00 -0.81 -1.09 0.13 -1.98 0.80 132.00 127.81 1ngr h PRO 368 Ca -0.44 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1ngr h PRO 368 Cb 1.30 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.38 1ngr h PRO 368 CO 0.36 0.01 0.53 0.93 -0.23 0.00 0.00 178.00 179.60 1ngr h GLU 369 N 0.00 1.03 -0.44 0.86 3.07 -2.00 -1.52 114.58 115.59 1ngr h GLU 369 Ca -0.00 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 58.65 1ngr h GLU 369 Cb 0.02 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 1ngr h GLU 369 CO 0.00 0.68 -0.30 0.45 -1.40 0.00 0.00 179.01 178.45 1ngr h HIS 370 N 1.06 1.14 -0.24 4.33 3.86 -1.15 -0.02 115.15 124.13 1ngr h HIS 370 Ca 0.31 -0.31 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1ngr h HIS 370 Cb -0.07 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.13 1ngr h HIS 370 CO -0.02 1.14 0.14 0.82 0.86 0.00 0.00 177.93 180.87 1ngr h ILE 371 N 0.82 1.02 -0.39 2.45 1.08 -1.14 -0.17 117.51 121.19 1ngr h ILE 371 Ca 0.09 -0.10 -0.15 0.00 -0.39 0.00 0.00 64.86 64.31 1ngr h ILE 371 Cb 0.89 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 1ngr h ILE 371 CO 0.08 0.05 -0.35 -0.78 -0.69 0.00 0.00 178.15 176.46 1ngr h ASP 372 N 0.29 0.98 0.45 1.72 3.58 -1.11 -2.79 116.42 119.54 1ngr h ASP 372 Ca 0.09 -0.46 0.00 0.00 0.42 0.00 0.00 57.03 57.09 1ngr h ASP 372 Cb -0.00 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.77 1ngr h ASP 372 CO -0.05 1.23 0.00 -0.24 -2.88 0.00 0.00 179.24 177.31 1ngr n SER 373 N -4.09 0.04 0.01 2.28 2.88 -0.04 -1.87 113.62 112.83 1ngr n SER 373 Ca -0.02 0.51 -0.12 0.00 -1.33 0.00 0.00 58.87 57.91 1ngr n SER 373 Cb 0.53 -0.52 -0.14 0.00 -0.75 0.00 0.00 64.21 63.33 1ngr n SER 373 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 1ngr h PHE 374 N 0.00 0.18 0.00 0.66 0.04 -0.76 -3.29 116.94 113.76 1ngr h PHE 374 Ca 0.00 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.64 1ngr h PHE 374 Cb 0.23 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.37 1ngr h PHE 374 CO 0.00 1.23 0.00 -2.37 -0.60 0.00 0.00 178.31 176.57 1ngr n THR 375 N -3.23 0.02 0.12 -1.55 5.66 -0.78 -2.89 114.28 111.63 1ngr n THR 375 Ca -0.18 0.01 -0.21 0.00 -3.05 0.00 0.00 64.05 60.61 1ngr n THR 375 Cb 1.04 -0.53 -0.14 0.00 -1.55 0.00 0.00 70.33 69.15 1ngr n THR 375 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 175.07 172.47 1ngr h HIS 376 N 0.00 0.83 -2.50 1.09 3.86 -1.60 -3.45 115.15 113.39 1ngr h HIS 376 Ca 0.00 -0.57 -0.46 0.00 -1.16 0.00 0.00 60.37 58.17 1ngr h HIS 376 Cb 0.12 -0.05 0.23 0.00 1.06 0.00 0.00 27.41 28.78 1ngr h HIS 376 CO 0.00 1.43 -0.95 0.39 0.86 0.00 0.00 177.93 179.66 1ngr n GLU 377 N -3.69 -1.52 -0.33 2.45 -0.58 -1.14 -4.90 120.64 110.94 1ngr n GLU 377 Ca -0.13 -0.42 0.08 0.00 -0.42 0.00 0.00 57.16 56.26 1ngr n GLU 377 Cb 1.03 -1.75 0.18 0.00 -0.57 0.00 0.00 31.44 30.33 1ngr n GLU 377 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ngr h ALA 378 N -2.06 0.79 -2.54 0.62 0.00 -1.91 -3.38 119.26 110.78 1ngr h ALA 378 Ca -0.53 0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1ngr h ALA 378 Cb 1.35 0.64 -0.16 0.00 0.00 0.00 0.00 17.79 19.63 1ngr h ALA 378 CO 0.39 -0.44 -0.38 0.00 0.00 0.00 0.00 179.25 178.81 1ngr n PRO 380 N 0.35 0.00 -0.33 0.00 -0.04 -1.17 -3.24 135.00 130.58 1ngr n PRO 380 Ca -0.17 0.45 0.27 0.00 -0.04 0.00 0.00 63.50 64.01 1ngr n PRO 380 Cb 0.60 -1.30 0.52 0.00 -0.04 0.00 0.00 33.50 33.28 1ngr n PRO 380 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1ngr h VAL 381 N 0.00 0.10 0.78 0.52 2.07 -1.89 0.33 116.25 118.16 1ngr h VAL 381 Ca 0.00 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 1ngr h VAL 381 Cb 0.00 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.76 1ngr h VAL 381 CO 0.00 0.02 -0.42 0.03 0.02 0.00 0.00 177.57 177.22 1ngr h ARG 382 N 0.10 -1.07 0.00 1.57 3.08 -1.93 -1.69 114.38 114.45 1ngr h ARG 382 Ca 0.78 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.90 1ngr h ARG 382 Cb 1.95 0.24 0.00 0.00 0.08 0.00 0.00 29.97 32.24 1ngr h ARG 382 CO -0.73 -0.71 -0.01 0.00 -1.07 0.00 0.00 179.97 177.45 1ngr n ALA 383 N -2.61 2.32 0.01 0.04 0.00 -0.16 -2.31 120.51 117.79 1ngr n ALA 383 Ca -0.14 -0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.11 1ngr n ALA 383 Cb 0.45 -1.47 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 1ngr n ALA 383 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ngr h LEU 384 N 0.00 -0.05 -0.16 0.00 5.85 -0.41 -1.61 115.31 118.92 1ngr h LEU 384 Ca 0.00 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.30 1ngr h LEU 384 Cb 0.60 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1ngr h LEU 384 CO 0.00 0.41 0.00 -0.07 -0.34 0.00 0.00 178.44 178.44 1ngr h LEU 385 N -0.52 0.00 -0.27 2.25 3.38 -1.18 0.29 115.31 119.25 1ngr h LEU 385 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 1ngr h LEU 385 Cb 0.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ngr h LEU 385 CO 0.01 0.00 -0.46 0.00 0.09 0.00 0.00 178.44 178.08 1ngr h ALA 386 N 2.06 0.42 0.00 1.53 0.00 -1.42 -2.78 119.26 119.07 1ngr h ALA 386 Ca 0.00 -0.48 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 1ngr h ALA 386 Cb 0.91 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1ngr h ALA 386 CO 0.00 0.58 -0.89 1.03 0.00 0.00 0.00 179.25 179.96 1ngr h SER 387 N 0.55 0.00 -0.78 0.00 0.87 -1.01 -3.35 113.55 109.83 1ngr h SER 387 Ca 0.02 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 1ngr h SER 387 Cb 1.06 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.99 1ngr h SER 387 CO 0.10 1.18 0.46 -0.25 -0.53 0.00 0.00 176.83 177.79 1ngr h TRP 388 N -1.00 1.05 -0.08 2.24 7.01 -0.65 -3.14 115.95 121.39 1ngr h TRP 388 Ca -0.20 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.75 1ngr h TRP 388 Cb 0.97 -0.34 -0.02 0.00 -2.10 0.00 0.00 29.16 27.67 1ngr h TRP 388 CO -0.00 0.71 0.05 0.41 -2.79 0.00 0.00 178.44 176.82 1ngr n GLY 389 N -1.16 2.18 0.00 2.65 0.00 -1.05 -2.84 105.19 104.97 1ngr n GLY 389 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ngr n GLY 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngr n ALA 390 N 0.36 0.91 -1.77 4.61 0.00 -1.18 -4.47 120.51 118.98 1ngr n ALA 390 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.10 1ngr n ALA 390 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.98 1ngr n ALA 390 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1ngr s GLN 391 N -0.51 4.57 -0.56 0.00 -2.07 -1.13 -4.96 119.66 114.99 1ngr s GLN 391 Ca 0.00 1.53 -0.27 0.00 -1.82 0.00 0.00 55.36 54.80 1ngr s GLN 391 Cb 0.00 -2.95 -0.02 0.00 -1.09 0.00 0.00 33.01 28.94 1ngr s GLN 391 CO 0.00 0.23 1.87 0.34 -1.32 0.00 0.00 175.29 176.41 1ngr s ASP 392 N -1.32 5.33 0.00 12.60 2.15 -1.26 -1.78 116.67 132.39 1ngr s ASP 392 Ca 0.48 0.52 0.00 0.00 0.43 0.00 0.00 52.55 53.98 1ngr s ASP 392 Cb -0.24 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 1ngr s ASP 392 CO 0.31 -2.29 0.00 -1.54 -0.17 0.00 0.00 175.17 171.48 1ngr n SER 393 N 12.50 0.00 -2.22 -0.34 3.41 -1.26 -5.07 113.62 120.64 1ngr n SER 393 Ca 0.22 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 1ngr n SER 393 Cb 0.51 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.35 1ngr n SER 393 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ngr n ALA 394 N 0.00 4.92 -1.03 7.33 0.00 -0.74 -4.70 120.51 126.29 1ngr n ALA 394 Ca 0.00 -1.40 -0.29 0.00 0.00 0.00 0.00 53.44 51.75 1ngr n ALA 394 Cb 0.00 -2.36 0.22 0.00 0.00 0.00 0.00 19.45 17.31 1ngr n ALA 394 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ngr s THR 395 N 1.66 1.76 0.51 0.00 -4.23 -1.26 -4.10 115.64 109.98 1ngr s THR 395 Ca 0.48 0.00 0.18 0.00 -1.18 0.00 0.00 61.69 61.18 1ngr s THR 395 Cb 0.22 -2.44 0.27 0.00 1.34 0.00 0.00 72.50 71.89 1ngr s THR 395 CO -0.00 0.00 2.13 0.25 -0.54 0.00 0.00 174.62 176.46 1ngr h LEU 396 N -2.39 0.00 -1.63 4.79 5.85 -1.47 -2.47 115.31 117.99 1ngr h LEU 396 Ca -0.50 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 1ngr h LEU 396 Cb 1.32 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 1ngr h LEU 396 CO 0.44 0.04 -0.07 0.44 -0.34 0.00 0.00 178.44 178.96 1ngr h ASP 397 N 0.00 0.00 0.02 1.25 5.19 -1.91 0.39 116.42 121.36 1ngr h ASP 397 Ca -0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1ngr h ASP 397 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1ngr h ASP 397 CO 0.01 0.07 -0.01 0.00 -3.12 0.00 0.00 179.24 176.18 1ngr h ALA 398 N 1.93 -0.02 -0.89 3.45 0.00 -1.72 -0.74 119.26 121.27 1ngr h ALA 398 Ca -0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ngr h ALA 398 Cb 0.48 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1ngr h ALA 398 CO 0.01 -0.04 0.55 1.25 0.00 0.00 0.00 179.25 181.01 1ngr h LEU 399 N -0.96 1.05 -0.56 0.00 6.46 -1.48 -1.35 115.31 118.47 1ngr h LEU 399 Ca -0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1ngr h LEU 399 Cb 0.69 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 1ngr h LEU 399 CO 0.00 0.80 0.36 0.25 -0.62 0.00 0.00 178.44 179.23 1ngr h LEU 400 N 1.21 0.66 -0.12 2.25 6.46 -0.98 0.12 115.31 124.92 1ngr h LEU 400 Ca 0.32 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.04 1ngr h LEU 400 Cb -0.07 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 1ngr h LEU 400 CO -0.06 0.50 0.05 0.00 -0.62 0.00 0.00 178.44 178.30 1ngr h ALA 401 N 1.19 0.15 -0.89 1.25 0.00 -0.72 -0.87 119.26 119.38 1ngr h ALA 401 Ca 0.21 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ngr h ALA 401 Cb -0.06 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1ngr h ALA 401 CO -0.04 -0.27 0.59 0.00 0.00 0.00 0.00 179.25 179.53 1ngr h ALA 402 N 0.90 1.39 0.10 0.00 0.00 -0.97 0.66 119.26 121.34 1ngr h ALA 402 Ca 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ngr h ALA 402 Cb 0.15 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ngr h ALA 402 CO -0.00 0.56 -0.05 -0.07 0.00 0.00 0.00 179.25 179.68 1ngr h LEU 403 N 1.18 -0.12 -1.06 0.00 3.38 -0.80 -3.04 115.31 114.85 1ngr h LEU 403 Ca 0.33 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.18 1ngr h LEU 403 Cb -0.10 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1ngr h LEU 403 CO -0.08 -0.05 -0.45 -0.09 0.09 0.00 0.00 178.44 177.86 1ngr h ARG 404 N -0.18 0.00 -0.69 1.13 2.43 -0.45 -0.34 114.38 116.29 1ngr h ARG 404 Ca -0.01 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.30 1ngr h ARG 404 Cb 0.14 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.58 1ngr h ARG 404 CO 0.02 0.45 0.09 -0.09 -1.51 0.00 0.00 179.97 178.93 1ngr h ARG 405 N 0.00 0.18 -0.83 0.20 2.43 -0.94 -1.53 114.38 113.89 1ngr h ARG 405 Ca -0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1ngr h ARG 405 Cb 0.84 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 1ngr h ARG 405 CO 0.06 0.12 0.02 0.44 -1.51 0.00 0.00 179.97 179.10 1ngr n ILE 406 N -5.23 1.25 -1.07 1.20 -5.35 -0.44 -4.89 119.36 104.84 1ngr n ILE 406 Ca 0.12 -0.62 -0.06 0.00 -0.27 0.00 0.00 62.75 61.92 1ngr n ILE 406 Cb 0.42 -0.43 -0.03 0.00 -1.74 0.00 0.00 39.64 37.86 1ngr n ILE 406 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ngr n GLN 407 N 0.23 -1.30 -1.09 6.28 -0.00 -0.58 -4.85 117.38 116.08 1ngr n GLN 407 Ca 0.13 0.39 -0.15 0.00 -0.00 0.00 0.00 57.00 57.37 1ngr n GLN 407 Cb 0.69 -4.37 -0.15 0.00 -0.00 0.00 0.00 30.24 26.40 1ngr n GLN 407 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1ngr n ARG 408 N -1.19 2.08 0.24 2.61 5.12 -0.27 -4.47 116.66 120.79 1ngr n ARG 408 Ca -0.06 -1.24 0.13 0.00 -1.93 0.00 0.00 57.85 54.75 1ngr n ARG 408 Cb 0.23 -2.03 0.45 0.00 -1.16 0.00 0.00 32.46 29.95 1ngr n ARG 408 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ngr h ALA 409 N 3.02 0.98 -0.65 7.54 0.00 -1.87 -2.89 119.26 125.39 1ngr h ALA 409 Ca 0.23 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1ngr h ALA 409 Cb 1.37 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.08 1ngr h ALA 409 CO 0.35 0.11 0.30 0.38 0.00 0.00 0.00 179.25 180.40 1ngr h ASP 410 N 0.00 0.37 -0.36 0.00 3.04 -1.96 -0.48 116.42 117.03 1ngr h ASP 410 Ca -0.00 0.06 -0.10 0.00 -3.24 0.00 0.00 57.03 53.76 1ngr h ASP 410 Cb 0.75 0.01 -0.02 0.00 -1.04 0.00 0.00 39.33 39.03 1ngr h ASP 410 CO 0.01 0.22 -0.12 0.40 -2.04 0.00 0.00 179.24 177.71 1ngr h ILE 411 N 0.52 1.26 0.83 4.15 2.04 -1.87 -2.95 117.51 121.50 1ngr h ILE 411 Ca 0.32 -1.19 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 1ngr h ILE 411 Cb 0.35 1.04 0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1ngr h ILE 411 CO -0.27 0.41 -0.40 0.58 0.00 0.00 0.00 178.15 178.47 1ngr h VAL 412 N 0.73 0.16 0.00 1.67 2.07 -1.13 0.25 116.25 120.00 1ngr h VAL 412 Ca 0.12 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1ngr h VAL 412 Cb 0.61 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1ngr h VAL 412 CO 0.04 0.00 -0.06 1.05 0.02 0.00 0.00 177.57 178.62 1ngr h GLU 413 N -1.15 0.00 -0.08 1.57 4.11 -1.29 0.82 114.58 118.56 1ngr h GLU 413 Ca -0.11 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.12 1ngr h GLU 413 Cb 0.86 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1ngr h GLU 413 CO 0.19 0.06 -0.77 1.03 0.07 0.00 0.00 179.01 179.59 1ngr h SER 414 N 0.00 0.58 -0.19 3.06 0.87 -1.38 -3.32 113.55 113.18 1ngr h SER 414 Ca -0.00 -0.39 0.03 0.00 -1.23 0.00 0.00 61.79 60.19 1ngr h SER 414 Cb 0.12 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.88 1ngr h SER 414 CO 0.01 1.15 0.02 -0.07 -0.53 0.00 0.00 176.83 177.41 1ngr h LEU 415 N 0.33 -0.03 0.76 2.23 3.38 0.87 -3.38 115.31 119.46 1ngr h LEU 415 Ca -0.04 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ngr h LEU 415 Cb 1.36 0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.17 1ngr h LEU 415 CO 0.14 0.01 -0.36 0.00 0.09 0.00 0.00 178.44 178.31 1ngr n SER 417 N -4.90 0.00 -0.41 0.00 3.41 -1.26 -5.10 113.62 105.36 1ngr n SER 417 Ca -0.13 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.63 1ngr n SER 417 Cb 0.40 -0.01 0.59 0.00 -0.26 0.00 0.00 64.21 64.93 1ngr n SER 417 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09