#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 5.38 1.40 1.61 0.01 -1.26 -4.90 114.94 117.18 1ngr s ASN 335 Ca 0.00 1.22 -0.22 0.00 -0.71 0.00 0.00 52.86 53.15 1ngr s ASN 335 Cb 0.00 -2.04 0.36 0.00 0.41 0.00 0.00 41.25 39.98 1ngr s ASN 335 CO 0.00 -1.39 0.94 -0.76 -1.51 0.00 0.00 177.10 174.38 1ngr s LEU 336 N -5.42 -0.89 -0.10 0.60 2.01 -1.26 -0.75 118.68 112.86 1ngr s LEU 336 Ca 0.58 0.91 -0.03 0.00 0.01 0.00 0.00 54.13 55.60 1ngr s LEU 336 Cb -0.12 -2.39 -0.01 0.00 0.01 0.00 0.00 46.19 43.68 1ngr s LEU 336 CO 0.53 -5.25 -0.06 0.22 1.01 0.00 0.00 176.35 172.80 1ngr h TYR 337 N -3.34 0.00 0.00 0.29 5.03 -1.42 -3.31 116.97 114.22 1ngr h TYR 337 Ca -0.45 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.86 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 -2.92 0.00 0.00 0.43 -1.32 0.00 0.00 178.16 174.35 1ngr n SER 338 N -4.34 0.00 -0.28 -2.11 7.64 -1.26 -2.39 113.62 110.88 1ngr n SER 338 Ca -0.02 -0.93 0.03 0.00 1.01 0.00 0.00 58.87 58.96 1ngr n SER 338 Cb 0.09 0.00 0.17 0.00 -1.01 0.00 0.00 64.21 63.46 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 0.59 -1.91 6.43 0.87 -1.95 -3.34 113.55 114.25 1ngr h SER 339 Ca 0.00 0.06 -0.53 0.00 -1.23 0.00 0.00 61.79 60.09 1ngr h SER 339 Cb 0.00 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 1ngr h SER 339 CO 0.00 0.32 1.52 -0.22 -0.53 0.00 0.00 176.83 177.92 1ngr s LEU 340 N -10.30 3.42 0.00 2.23 0.20 -1.00 -4.87 118.68 108.35 1ngr s LEU 340 Ca -0.12 1.41 0.27 0.00 0.69 0.00 0.00 54.13 56.38 1ngr s LEU 340 Cb 0.19 -3.05 0.90 0.00 -0.43 0.00 0.00 46.19 43.80 1ngr s LEU 340 CO 0.78 -2.33 1.65 -0.81 -0.29 0.00 0.00 176.35 175.35 1ngr n PRO 341 N 8.86 0.80 -2.50 0.98 -0.04 -1.25 -4.86 135.00 136.98 1ngr n PRO 341 Ca 0.31 -0.42 -0.24 0.00 -0.04 0.00 0.00 63.50 63.12 1ngr n PRO 341 Cb 0.50 -1.49 0.04 0.00 -0.04 0.00 0.00 33.50 32.51 1ngr n PRO 341 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ngr s LEU 342 N -2.49 3.16 0.00 1.53 1.98 -1.26 -4.94 118.68 116.65 1ngr s LEU 342 Ca 0.26 0.27 0.07 0.00 -2.89 0.00 0.00 54.13 51.84 1ngr s LEU 342 Cb 0.19 -3.07 0.43 0.00 0.66 0.00 0.00 46.19 44.41 1ngr s LEU 342 CO 0.51 -1.23 0.87 0.35 -1.89 0.00 0.00 176.35 174.96 1ngr n THR 343 N -2.53 0.00 -0.31 3.68 -2.24 -1.26 -1.43 114.28 110.19 1ngr n THR 343 Ca 0.07 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 62.00 1ngr n THR 343 Cb 0.59 -0.84 0.40 0.00 -2.10 0.00 0.00 70.33 68.38 1ngr n THR 343 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1ngr h LYS 344 N 0.00 0.60 0.00 -0.78 3.64 -1.96 -0.04 116.57 118.04 1ngr h LYS 344 Ca 0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ngr h LYS 344 Cb 0.00 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1ngr h LYS 344 CO 0.00 0.40 -0.01 0.00 -2.27 0.00 0.00 179.45 177.57 1ngr h ARG 345 N 0.62 0.00 -0.33 1.90 2.47 -1.57 0.13 114.38 117.59 1ngr h ARG 345 Ca 0.54 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 59.21 1ngr h ARG 345 Cb 1.03 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.34 1ngr h ARG 345 CO -0.29 0.01 0.02 0.93 0.56 0.00 0.00 179.97 181.19 1ngr h GLU 346 N 0.00 0.57 0.00 0.04 4.39 -1.25 -2.17 114.58 116.17 1ngr h GLU 346 Ca -0.00 -0.17 -0.00 0.00 0.34 0.00 0.00 59.36 59.52 1ngr h GLU 346 Cb 0.05 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.64 1ngr h GLU 346 CO 0.00 0.69 -0.02 1.49 -1.16 0.00 0.00 179.01 180.01 1ngr h GLU 347 N 0.38 0.00 -0.04 2.33 4.81 -0.71 -1.40 114.58 119.95 1ngr h GLU 347 Ca 0.10 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.14 1ngr h GLU 347 Cb 0.42 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1ngr h GLU 347 CO 0.01 0.02 -0.79 0.28 -0.73 0.00 0.00 179.01 177.81 1ngr h VAL 348 N 0.00 1.42 -0.29 0.32 2.07 -0.21 0.14 116.25 119.69 1ngr h VAL 348 Ca -0.00 -2.30 -0.01 0.00 0.82 0.00 0.00 66.70 65.21 1ngr h VAL 348 Cb 0.07 2.24 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1ngr h VAL 348 CO 0.00 0.68 0.12 -0.33 0.02 0.00 0.00 177.57 178.06 1ngr h GLU 349 N 0.21 0.41 -0.41 1.57 5.08 -0.85 0.27 114.58 120.84 1ngr h GLU 349 Ca -0.04 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1ngr h GLU 349 Cb 1.37 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1ngr h GLU 349 CO 0.13 0.34 -0.20 -0.22 -1.00 0.00 0.00 179.01 178.06 1ngr h LYS 350 N 0.41 0.87 0.00 2.33 3.11 -1.14 -3.38 116.57 118.76 1ngr h LYS 350 Ca 0.10 -0.38 0.00 0.00 -2.81 0.00 0.00 60.65 57.56 1ngr h LYS 350 Cb 0.08 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.29 1ngr h LYS 350 CO -0.01 1.02 -0.07 -0.07 -2.81 0.00 0.00 179.45 177.51 1ngr h LEU 351 N 0.68 0.00 -5.57 5.20 3.38 0.04 -3.38 115.31 115.66 1ngr h LEU 351 Ca 0.09 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.61 1ngr h LEU 351 Cb 0.76 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.53 1ngr h LEU 351 CO 0.06 0.48 2.69 0.18 0.09 0.00 0.00 178.44 181.94 1ngr n LEU 352 N -4.45 5.21 -4.38 1.67 4.77 0.88 -4.82 117.00 115.88 1ngr n LEU 352 Ca -0.01 -3.06 -0.31 0.00 -0.03 0.00 0.00 56.01 52.60 1ngr n LEU 352 Cb 0.03 -1.16 0.20 0.00 -2.33 0.00 0.00 43.42 40.17 1ngr n LEU 352 CO 0.01 0.62 -0.06 -0.46 -1.33 0.00 0.00 177.39 176.17 1ngr n ASN 353 N 4.69 -1.99 -3.54 -1.43 6.94 -1.26 -4.30 115.26 114.37 1ngr n ASN 353 Ca 0.48 -0.07 -0.40 0.00 -0.02 0.00 0.00 54.58 54.58 1ngr n ASN 353 Cb 0.19 -1.12 -0.06 0.00 -2.36 0.00 0.00 39.78 36.44 1ngr n ASN 353 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ngr n GLY 354 N 1.53 2.45 0.30 4.83 0.00 -1.26 -2.09 105.19 110.95 1ngr n GLY 354 Ca 0.03 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 7.12 -0.53 -0.25 1.61 2.03 -1.26 -4.98 116.55 120.30 1ngr n ASP 355 Ca 0.48 0.49 -0.07 0.00 0.52 0.00 0.00 54.79 56.21 1ngr n ASP 355 Cb 0.36 0.87 0.05 0.00 -0.72 0.00 0.00 41.12 41.68 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 1.26 -0.25 5.18 2.02 -1.85 -2.30 112.91 116.96 1ngr h THR 356 Ca 0.00 -0.89 0.06 0.00 0.77 0.00 0.00 66.41 66.35 1ngr h THR 356 Cb 0.00 0.51 -0.07 0.00 -1.74 0.00 0.00 68.15 66.85 1ngr h THR 356 CO 0.00 0.35 -0.21 4.11 0.37 0.00 0.00 175.52 180.14 1ngr h TRP 357 N 1.03 -0.54 -0.91 3.16 5.08 -1.61 0.26 115.95 122.42 1ngr h TRP 357 Ca 0.22 0.04 0.20 0.00 1.08 0.00 0.00 58.89 60.43 1ngr h TRP 357 Cb 0.30 0.28 -0.17 0.00 -3.00 0.00 0.00 29.16 26.57 1ngr h TRP 357 CO 0.02 -0.29 -0.16 0.00 -1.28 0.00 0.00 178.44 176.74 1ngr h ARG 358 N -0.20 0.01 0.87 0.12 3.08 -1.67 0.20 114.38 116.78 1ngr h ARG 358 Ca 0.14 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 1ngr h ARG 358 Cb 0.42 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.48 1ngr h ARG 358 CO -0.37 0.01 -0.42 0.45 -1.07 0.00 0.00 179.97 178.57 1ngr h HIS 359 N 0.01 -1.08 -0.99 3.04 3.86 -1.05 -3.32 115.15 115.61 1ngr h HIS 359 Ca 0.46 -0.03 0.18 0.00 -1.16 0.00 0.00 60.37 59.82 1ngr h HIS 359 Cb 0.76 0.36 -0.10 0.00 1.06 0.00 0.00 27.41 29.49 1ngr h HIS 359 CO -0.64 -0.67 0.62 1.25 0.86 0.00 0.00 177.93 179.34 1ngr h LEU 360 N -1.21 0.78 -0.66 2.43 5.85 -0.07 0.19 115.31 122.62 1ngr h LEU 360 Ca -0.12 0.08 0.14 0.00 0.84 0.00 0.00 57.88 58.82 1ngr h LEU 360 Cb 0.89 -0.06 -0.12 0.00 0.37 0.00 0.00 40.66 41.74 1ngr h LEU 360 CO 0.20 0.31 -0.03 0.00 -0.34 0.00 0.00 178.44 178.58 1ngr h ALA 361 N 1.62 0.62 -0.27 1.25 0.00 -0.74 0.20 119.26 121.94 1ngr h ALA 361 Ca 0.55 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.63 1ngr h ALA 361 Cb 0.84 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ngr h ALA 361 CO -0.33 -0.41 -0.02 0.78 0.00 0.00 0.00 179.25 179.27 1ngr h GLY 362 N 0.09 0.53 2.00 0.00 0.00 -0.74 -2.86 103.07 102.09 1ngr h GLY 362 Ca 0.35 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 1ngr h GLY 362 CO -0.59 0.37 -0.01 0.83 0.00 0.00 0.00 176.54 177.14 1ngr h GLU 363 N 0.26 0.00 -0.96 4.80 3.07 -0.89 -1.58 114.58 119.28 1ngr h GLU 363 Ca 0.07 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.68 1ngr h GLU 363 Cb 0.45 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 28.21 1ngr h GLU 363 CO 0.02 0.01 0.33 1.28 -1.40 0.00 0.00 179.01 179.24 1ngr n LEU 364 N -3.30 4.98 -3.95 1.33 4.77 0.62 -4.90 117.00 116.55 1ngr n LEU 364 Ca -0.03 -2.61 -0.30 0.00 -0.03 0.00 0.00 56.01 53.04 1ngr n LEU 364 Cb 0.09 -0.69 0.01 0.00 -2.33 0.00 0.00 43.42 40.51 1ngr n LEU 364 CO 0.23 0.77 0.02 0.61 -1.33 0.00 0.00 177.39 177.69 1ngr n GLY 365 N -0.34 -0.43 3.48 -0.72 0.00 -0.59 -5.00 105.19 101.59 1ngr n GLY 365 Ca 0.32 0.17 -0.34 0.00 0.00 0.00 0.00 46.02 46.17 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 -3.42 3.05 0.89 1.61 2.02 -1.11 -5.05 117.35 115.33 1ngr s TYR 366 Ca 0.52 -0.35 -0.14 0.00 -0.37 0.00 0.00 57.07 56.73 1ngr s TYR 366 Cb -0.27 -2.03 0.01 0.00 -0.40 0.00 0.00 41.96 39.27 1ngr s TYR 366 CO 0.85 -0.12 0.39 1.04 -1.57 0.00 0.00 175.55 176.14 1ngr n GLN 367 N 3.87 -0.10 0.22 -0.62 6.02 -1.26 -4.24 117.38 121.27 1ngr n GLN 367 Ca -0.17 0.01 0.08 0.00 -0.01 0.00 0.00 57.00 56.92 1ngr n GLN 367 Cb 0.52 -1.81 0.51 0.00 1.02 0.00 0.00 30.24 30.48 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 -1.19 0.00 -0.64 -1.09 0.13 -1.98 -0.55 132.00 126.68 1ngr h PRO 368 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 1ngr h PRO 368 Cb 1.30 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.41 1ngr h PRO 368 CO 0.36 0.25 0.16 0.93 -0.23 0.00 0.00 178.00 179.47 1ngr h GLU 369 N 0.00 1.01 -0.38 0.86 3.07 -1.99 -0.60 114.58 116.56 1ngr h GLU 369 Ca -0.00 -0.24 -0.14 0.00 -0.50 0.00 0.00 59.36 58.47 1ngr h GLU 369 Cb 0.61 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1ngr h GLU 369 CO 0.03 0.91 -0.33 0.45 -1.40 0.00 0.00 179.01 178.68 1ngr h HIS 370 N 0.94 1.01 -0.82 4.33 3.86 -1.48 0.45 115.15 123.44 1ngr h HIS 370 Ca 0.20 -0.28 0.03 0.00 -1.16 0.00 0.00 60.37 59.16 1ngr h HIS 370 Cb 0.35 -0.22 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 1ngr h HIS 370 CO 0.03 1.07 0.53 0.82 0.86 0.00 0.00 177.93 181.23 1ngr h ILE 371 N 0.72 1.13 -0.10 2.45 2.04 -1.03 -0.75 117.51 121.97 1ngr h ILE 371 Ca 0.07 -0.35 -0.13 0.00 1.00 0.00 0.00 64.86 65.45 1ngr h ILE 371 Cb 0.89 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1ngr h ILE 371 CO 0.08 0.19 -0.53 -0.78 0.00 0.00 0.00 178.15 177.11 1ngr h ASP 372 N 1.03 0.31 0.56 1.72 3.58 -0.84 -2.56 116.42 120.22 1ngr h ASP 372 Ca 0.33 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1ngr h ASP 372 Cb -0.00 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 40.96 1ngr h ASP 372 CO -0.11 0.78 0.00 -0.24 -2.88 0.00 0.00 179.24 176.79 1ngr n SER 373 N -3.94 0.30 0.01 2.28 2.88 0.12 -2.48 113.62 112.80 1ngr n SER 373 Ca -0.02 0.58 -0.06 0.00 -1.33 0.00 0.00 58.87 58.03 1ngr n SER 373 Cb 0.57 -0.64 -0.12 0.00 -0.75 0.00 0.00 64.21 63.27 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 0.00 -0.00 0.66 0.04 -0.73 0.17 116.94 117.08 1ngr h PHE 374 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ngr h PHE 374 Cb 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1ngr h PHE 374 CO 0.00 0.90 -0.21 -2.37 -0.60 0.00 0.00 178.31 176.03 1ngr n THR 375 N -3.07 0.00 -0.01 -1.55 5.66 -1.03 -2.33 114.28 111.95 1ngr n THR 375 Ca -0.12 -0.01 -0.19 0.00 -3.05 0.00 0.00 64.05 60.68 1ngr n THR 375 Cb 0.98 -0.14 -0.14 0.00 -1.55 0.00 0.00 70.33 69.48 1ngr n THR 375 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1ngr n HIS 376 N -1.41 1.13 -0.49 1.09 8.25 -1.05 -4.81 115.22 117.93 1ngr n HIS 376 Ca 0.08 0.26 -0.29 0.00 -0.26 0.00 0.00 57.72 57.51 1ngr n HIS 376 Cb 0.33 -1.15 0.25 0.00 1.12 0.00 0.00 29.99 30.53 1ngr n HIS 376 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ngr n GLU 377 N -3.40 -2.36 -0.33 -0.41 1.02 0.58 -4.88 120.64 110.86 1ngr n GLU 377 Ca -0.31 -0.66 -0.02 0.00 -0.02 0.00 0.00 57.16 56.15 1ngr n GLU 377 Cb 1.05 -2.15 0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1ngr n GLU 377 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ngr h ALA 378 N -2.63 0.09 -2.53 0.62 0.00 -1.90 -3.38 119.26 109.53 1ngr h ALA 378 Ca -0.61 0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 1ngr h ALA 378 Cb 1.33 0.95 -0.15 0.00 0.00 0.00 0.00 17.79 19.92 1ngr h ALA 378 CO 0.48 -0.64 -0.39 0.00 0.00 0.00 0.00 179.25 178.69 1ngr n PRO 380 N 0.25 0.00 -0.36 0.00 -0.04 -0.98 -1.24 135.00 132.62 1ngr n PRO 380 Ca -0.17 0.04 0.31 0.00 -0.04 0.00 0.00 63.50 63.65 1ngr n PRO 380 Cb 0.61 -0.78 0.58 0.00 -0.04 0.00 0.00 33.50 33.87 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 0.11 0.80 0.52 2.07 -1.90 0.29 116.25 118.14 1ngr h VAL 381 Ca 0.00 -0.04 -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 29.77 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 -1.08 0.00 1.57 2.47 -1.95 -1.54 114.38 113.94 1ngr h ARG 382 Ca 0.82 0.07 0.00 0.00 -1.26 0.00 0.00 59.98 59.61 1ngr h ARG 382 Cb 2.21 0.25 0.00 0.00 -1.65 0.00 0.00 29.97 30.77 1ngr h ARG 382 CO -0.63 -0.72 0.00 0.00 0.56 0.00 0.00 179.97 179.18 1ngr n ALA 383 N -2.61 2.08 -0.01 0.04 0.00 -0.33 -2.29 120.51 117.38 1ngr n ALA 383 Ca -0.14 -0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.10 1ngr n ALA 383 Cb 0.45 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.37 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 0.30 -0.16 0.00 5.85 -0.41 0.02 115.31 120.91 1ngr h LEU 384 Ca 0.00 -0.83 -0.10 0.00 0.84 0.00 0.00 57.88 57.80 1ngr h LEU 384 Cb 0.50 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1ngr h LEU 384 CO 0.00 1.09 -0.46 -0.07 -0.34 0.00 0.00 178.44 178.67 1ngr h LEU 385 N -0.45 0.00 -0.44 2.25 3.38 -1.24 0.27 115.31 119.08 1ngr h LEU 385 Ca -0.05 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1ngr h LEU 385 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 1ngr h LEU 385 CO 0.08 0.46 -0.17 0.00 0.09 0.00 0.00 178.44 178.89 1ngr h ALA 386 N 1.54 0.62 0.00 1.53 0.00 -1.45 -2.95 119.26 118.55 1ngr h ALA 386 Ca -0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1ngr h ALA 386 Cb 1.29 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1ngr h ALA 386 CO 0.06 0.57 -0.96 1.03 0.00 0.00 0.00 179.25 179.94 1ngr h SER 387 N 0.74 0.00 -0.46 0.00 0.87 -0.87 -3.37 113.55 110.45 1ngr h SER 387 Ca 0.10 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 1ngr h SER 387 Cb 0.74 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 1ngr h SER 387 CO 0.06 1.28 0.25 -0.25 -0.53 0.00 0.00 176.83 177.64 1ngr h TRP 388 N -1.00 0.66 0.00 2.24 7.01 -0.63 -1.98 115.95 122.25 1ngr h TRP 388 Ca -0.24 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.75 1ngr h TRP 388 Cb 1.10 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.94 1ngr h TRP 388 CO 0.06 0.47 0.00 0.41 -2.79 0.00 0.00 178.44 176.59 1ngr n GLY 389 N -1.27 -0.56 0.01 2.65 0.00 -1.11 -0.99 105.19 103.91 1ngr n GLY 389 Ca 0.04 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.37 3.83 -1.89 4.61 0.00 -0.74 -4.82 120.51 120.13 1ngr n ALA 390 Ca 0.02 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.73 1ngr n ALA 390 Cb 0.05 -0.97 0.11 0.00 0.00 0.00 0.00 19.45 18.64 1ngr n ALA 390 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ngr s GLN 391 N -3.07 1.68 -0.69 0.00 -1.52 -0.16 -4.89 119.66 111.01 1ngr s GLN 391 Ca 0.08 0.02 -0.30 0.00 -1.95 0.00 0.00 55.36 53.20 1ngr s GLN 391 Cb 0.16 -1.93 -0.15 0.00 -0.22 0.00 0.00 33.01 30.88 1ngr s GLN 391 CO 0.78 -1.78 2.49 -3.47 -0.25 0.00 0.00 175.29 173.07 1ngr n ASP 392 N -3.42 1.35 -3.94 5.90 -0.08 -1.26 -2.63 116.55 112.47 1ngr n ASP 392 Ca 0.09 -0.02 -0.27 0.00 -1.51 0.00 0.00 54.79 53.09 1ngr n ASP 392 Cb 0.61 -1.22 -0.01 0.00 2.34 0.00 0.00 41.12 42.84 1ngr n ASP 392 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ngr n SER 393 N 12.30 -1.41 -3.24 1.67 3.41 -1.26 -4.78 113.62 120.31 1ngr n SER 393 Ca 0.51 -0.94 -0.21 0.00 -0.26 0.00 0.00 58.87 57.97 1ngr n SER 393 Cb 0.25 -3.30 -0.06 0.00 -0.26 0.00 0.00 64.21 60.84 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 -4.41 0.91 -1.24 7.33 0.00 -1.08 -4.81 120.51 117.21 1ngr n ALA 394 Ca -0.21 -1.25 -0.31 0.00 0.00 0.00 0.00 53.44 51.67 1ngr n ALA 394 Cb 0.64 -3.06 0.09 0.00 0.00 0.00 0.00 19.45 17.12 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 5.90 3.21 0.28 0.00 -4.23 -1.26 -1.27 115.64 118.27 1ngr s THR 395 Ca 0.32 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.24 1ngr s THR 395 Cb 0.07 -2.87 0.27 0.00 1.34 0.00 0.00 72.50 71.32 1ngr s THR 395 CO 0.16 -0.50 1.83 0.25 -0.54 0.00 0.00 174.62 175.83 1ngr h LEU 396 N -1.06 0.90 -1.58 4.79 7.12 -1.11 -2.60 115.31 121.77 1ngr h LEU 396 Ca -0.44 0.05 -0.02 0.00 0.13 0.00 0.00 57.88 57.60 1ngr h LEU 396 Cb 1.24 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 41.23 1ngr h LEU 396 CO 0.51 0.48 -0.08 0.44 -0.13 0.00 0.00 178.44 179.66 1ngr h ASP 397 N 0.97 0.00 0.03 1.25 5.19 -1.92 0.98 116.42 122.92 1ngr h ASP 397 Ca 0.48 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.89 1ngr h ASP 397 Cb 0.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 1ngr h ASP 397 CO -0.26 0.08 -0.01 0.00 -3.12 0.00 0.00 179.24 175.92 1ngr h ALA 398 N 1.92 -0.04 -0.75 3.45 0.00 -1.79 -2.29 119.26 119.77 1ngr h ALA 398 Ca -0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1ngr h ALA 398 Cb 0.50 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1ngr h ALA 398 CO 0.01 -0.06 0.37 1.25 0.00 0.00 0.00 179.25 180.82 1ngr h LEU 399 N -0.97 0.96 -0.64 0.00 6.46 -1.17 0.34 115.31 120.30 1ngr h LEU 399 Ca -0.00 -0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 57.65 1ngr h LEU 399 Cb 0.58 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1ngr h LEU 399 CO 0.01 0.80 0.39 0.25 -0.62 0.00 0.00 178.44 179.26 1ngr h LEU 400 N 1.06 0.76 -0.36 2.25 6.46 -0.92 0.62 115.31 125.18 1ngr h LEU 400 Ca 0.26 -0.06 -0.18 0.00 -0.12 0.00 0.00 57.88 57.79 1ngr h LEU 400 Cb 0.09 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 39.82 1ngr h LEU 400 CO -0.04 0.60 -0.50 0.00 -0.62 0.00 0.00 178.44 177.88 1ngr h ALA 401 N 1.20 0.53 0.06 1.25 0.00 -0.70 -0.35 119.26 121.25 1ngr h ALA 401 Ca 0.23 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1ngr h ALA 401 Cb -0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ngr h ALA 401 CO -0.04 0.68 -0.11 0.00 0.00 0.00 0.00 179.25 179.78 1ngr h ALA 402 N 0.76 -0.17 -0.86 0.00 0.00 -0.84 -2.52 119.26 115.62 1ngr h ALA 402 Ca 0.03 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.03 1ngr h ALA 402 Cb 1.10 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1ngr h ALA 402 CO 0.11 -0.62 0.56 -0.07 0.00 0.00 0.00 179.25 179.23 1ngr h LEU 403 N -0.22 0.74 -1.49 0.00 3.38 -0.73 -0.63 115.31 116.37 1ngr h LEU 403 Ca 0.02 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1ngr h LEU 403 Cb 0.23 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ngr h LEU 403 CO -0.07 0.43 -0.26 -0.09 0.09 0.00 0.00 178.44 178.54 1ngr h ARG 404 N 0.81 0.00 -0.76 1.13 9.65 -0.65 -1.12 114.38 123.44 1ngr h ARG 404 Ca 0.40 0.00 0.13 0.00 -1.10 0.00 0.00 59.98 59.42 1ngr h ARG 404 Cb 0.47 0.00 -0.09 0.00 -1.39 0.00 0.00 29.97 28.96 1ngr h ARG 404 CO -0.17 0.26 0.33 0.00 2.80 0.00 0.00 179.97 183.19 1ngr h ARG 405 N 0.00 0.49 -0.27 0.20 2.47 -0.74 -2.68 114.38 113.84 1ngr h ARG 405 Ca -0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1ngr h ARG 405 Cb 0.52 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1ngr h ARG 405 CO 0.03 0.32 0.00 0.44 0.56 0.00 0.00 179.97 181.33 1ngr n ILE 406 N -4.95 0.36 -1.41 2.04 -5.35 -0.44 -4.89 119.36 104.72 1ngr n ILE 406 Ca 0.14 -0.39 -0.11 0.00 -0.27 0.00 0.00 62.75 62.12 1ngr n ILE 406 Cb 0.38 0.22 -0.04 0.00 -1.74 0.00 0.00 39.64 38.46 1ngr n ILE 406 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46 1ngr n GLN 407 N 0.35 -1.33 -2.10 6.28 7.27 -1.01 -4.85 117.38 121.99 1ngr n GLN 407 Ca 0.11 0.65 -0.42 0.00 0.07 0.00 0.00 57.00 57.41 1ngr n GLN 407 Cb 0.27 -4.89 0.00 0.00 2.41 0.00 0.00 30.24 28.03 1ngr n GLN 407 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1ngr n ARG 408 N -1.82 3.57 0.21 3.69 3.00 -1.16 -4.69 116.66 119.46 1ngr n ARG 408 Ca -0.11 -3.24 0.10 0.00 -0.01 0.00 0.00 57.85 54.59 1ngr n ARG 408 Cb 0.38 -2.96 0.24 0.00 0.00 0.00 0.00 32.46 30.12 1ngr n ARG 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ngr h ALA 409 N 5.62 0.92 -0.26 7.54 0.00 -1.88 -3.14 119.26 128.05 1ngr h ALA 409 Ca 0.50 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.32 1ngr h ALA 409 Cb 0.57 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1ngr h ALA 409 CO 1.68 0.20 -0.16 0.38 0.00 0.00 0.00 179.25 181.35 1ngr h ASP 410 N 0.00 -0.52 -0.38 0.00 2.03 -1.99 -0.28 116.42 115.27 1ngr h ASP 410 Ca -0.00 0.11 -0.09 0.00 -0.73 0.00 0.00 57.03 56.33 1ngr h ASP 410 Cb 1.00 0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.76 1ngr h ASP 410 CO 0.02 -0.20 -0.10 0.40 -1.03 0.00 0.00 179.24 178.34 1ngr h ILE 411 N -0.14 1.28 0.53 4.15 2.04 -1.86 -1.82 117.51 121.68 1ngr h ILE 411 Ca 0.14 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 64.80 1ngr h ILE 411 Cb 0.35 1.25 0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1ngr h ILE 411 CO -0.34 0.39 -0.26 0.58 0.00 0.00 0.00 178.15 178.52 1ngr h VAL 412 N 0.55 0.46 -0.85 1.67 2.07 -1.46 0.30 116.25 119.00 1ngr h VAL 412 Ca 0.10 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1ngr h VAL 412 Cb 0.61 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1ngr h VAL 412 CO 0.04 0.02 0.46 -0.33 0.02 0.00 0.00 177.57 177.78 1ngr h GLU 413 N -0.79 1.18 0.00 1.57 3.07 -1.11 -2.37 114.58 116.13 1ngr h GLU 413 Ca -0.07 -0.14 -0.10 0.00 -0.50 0.00 0.00 59.36 58.55 1ngr h GLU 413 Cb 0.58 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 1ngr h GLU 413 CO 0.12 0.87 -0.46 1.03 -1.40 0.00 0.00 179.01 179.17 1ngr h SER 414 N 1.18 0.00 -0.97 1.42 0.87 -1.22 -0.32 113.55 114.51 1ngr h SER 414 Ca 0.30 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.99 1ngr h SER 414 Cb 0.03 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 61.90 1ngr h SER 414 CO -0.05 0.46 0.59 -0.07 -0.53 0.00 0.00 176.83 177.23 1ngr h LEU 415 N 0.00 0.82 0.58 2.23 3.38 0.11 -1.40 115.31 121.02 1ngr h LEU 415 Ca -0.00 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1ngr h LEU 415 Cb 0.89 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.55 1ngr h LEU 415 CO 0.06 0.40 -0.28 0.00 0.09 0.00 0.00 178.44 178.72 1ngr n SER 417 N -4.78 -2.40 0.00 0.00 3.41 -0.23 -5.12 113.62 104.49 1ngr n SER 417 Ca -0.10 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1ngr n SER 417 Cb 0.30 2.42 0.00 0.00 -0.26 0.00 0.00 64.21 66.67 1ngr n SER 417 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09