#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 4.18 1.41 1.61 -0.87 -1.26 -4.86 114.94 115.15 1ngr s ASN 335 Ca 0.00 0.78 -0.22 0.00 -1.57 0.00 0.00 52.86 51.85 1ngr s ASN 335 Cb 0.00 -1.25 0.36 0.00 -0.02 0.00 0.00 41.25 40.34 1ngr s ASN 335 CO 0.00 -2.11 0.93 -0.76 -2.57 0.00 0.00 177.10 172.58 1ngr s LEU 336 N -5.70 -1.03 -0.22 0.60 1.43 -1.26 -1.72 118.68 110.78 1ngr s LEU 336 Ca 0.63 0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 54.61 1ngr s LEU 336 Cb -0.11 -2.40 -0.19 0.00 0.03 0.00 0.00 46.19 43.52 1ngr s LEU 336 CO 0.50 -5.34 -0.05 0.00 0.23 0.00 0.00 176.35 171.69 1ngr n TYR 337 N -5.63 0.44 0.06 0.29 4.19 -1.26 -3.54 117.16 111.71 1ngr n TYR 337 Ca 0.11 0.12 0.04 0.00 3.31 0.00 0.00 57.90 61.48 1ngr n TYR 337 Cb 0.59 -1.05 0.21 0.00 0.49 0.00 0.00 39.34 39.58 1ngr n TYR 337 CO 0.00 0.00 0.00 -1.13 0.91 0.00 0.00 176.86 176.64 1ngr n SER 338 N -3.67 0.20 -0.30 2.98 3.41 -1.24 -1.34 113.62 113.66 1ngr n SER 338 Ca -0.43 0.57 -0.02 0.00 -0.26 0.00 0.00 58.87 58.73 1ngr n SER 338 Cb 0.95 -0.59 0.15 0.00 -0.26 0.00 0.00 64.21 64.46 1ngr n SER 338 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1ngr h SER 339 N 0.00 1.04 -2.17 4.04 0.87 -1.91 -3.36 113.55 112.06 1ngr h SER 339 Ca 0.00 -0.05 -0.58 0.00 -1.23 0.00 0.00 61.79 59.93 1ngr h SER 339 Cb 0.08 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.77 1ngr h SER 339 CO 0.00 0.79 1.42 -0.76 -0.53 0.00 0.00 176.83 177.74 1ngr s LEU 340 N -9.94 3.58 0.07 2.23 1.43 -0.45 -4.92 118.68 110.69 1ngr s LEU 340 Ca -0.12 1.88 -0.24 0.00 -1.03 0.00 0.00 54.13 54.61 1ngr s LEU 340 Cb 0.17 -3.52 -0.16 0.00 0.03 0.00 0.00 46.19 42.72 1ngr s LEU 340 CO 0.81 -1.79 1.67 1.55 0.23 0.00 0.00 176.35 178.82 1ngr h PRO 341 N 14.05 -0.10 0.00 1.29 0.13 -1.86 -3.47 132.00 142.04 1ngr h PRO 341 Ca -0.41 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1ngr h PRO 341 Cb 1.22 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1ngr h PRO 341 CO 0.97 -0.01 0.00 -0.11 -0.23 0.00 0.00 178.00 178.62 1ngr n LEU 342 N -5.11 0.00 -0.17 1.56 7.94 -1.26 -5.02 117.00 114.94 1ngr n LEU 342 Ca -0.08 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 54.83 1ngr n LEU 342 Cb 0.09 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.08 1ngr n LEU 342 CO 0.33 0.00 0.29 1.07 -1.11 0.00 0.00 177.39 177.97 1ngr n THR 343 N -0.33 -0.22 -0.24 1.96 5.66 -1.26 0.07 114.28 119.92 1ngr n THR 343 Ca 0.00 1.06 -0.03 0.00 -3.05 0.00 0.00 64.05 62.03 1ngr n THR 343 Cb 0.00 -1.43 0.16 0.00 -1.55 0.00 0.00 70.33 67.50 1ngr n THR 343 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 1ngr h LYS 344 N 0.00 1.05 -0.05 1.09 3.64 -1.98 -1.16 116.57 119.17 1ngr h LYS 344 Ca 0.19 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1ngr h LYS 344 Cb 0.31 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1ngr h LYS 344 CO -0.46 0.81 0.05 0.00 -2.27 0.00 0.00 179.45 177.57 1ngr h ARG 345 N 1.05 0.00 -0.06 1.90 3.08 -0.71 0.39 114.38 120.02 1ngr h ARG 345 Ca 0.26 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.26 1ngr h ARG 345 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1ngr h ARG 345 CO -0.03 0.00 -0.14 0.93 -1.07 0.00 0.00 179.97 179.66 1ngr h GLU 346 N 0.00 0.20 0.00 0.04 5.08 -1.32 -2.00 114.58 116.59 1ngr h GLU 346 Ca 0.02 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1ngr h GLU 346 Cb 0.12 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1ngr h GLU 346 CO -0.00 0.73 0.00 1.49 -1.00 0.00 0.00 179.01 180.23 1ngr h GLU 347 N -0.29 0.00 0.00 2.33 4.22 -0.76 -0.33 114.58 119.75 1ngr h GLU 347 Ca 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.26 1ngr h GLU 347 Cb 0.73 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1ngr h GLU 347 CO 0.03 0.00 -0.91 0.28 -2.18 0.00 0.00 179.01 176.23 1ngr h VAL 348 N 0.00 1.37 -0.78 0.32 2.07 -0.09 -0.58 116.25 118.56 1ngr h VAL 348 Ca 0.00 -2.98 0.14 0.00 0.82 0.00 0.00 66.70 64.68 1ngr h VAL 348 Cb 0.04 2.67 -0.05 0.00 -1.52 0.00 0.00 31.29 32.43 1ngr h VAL 348 CO 0.00 0.78 0.52 -0.33 0.02 0.00 0.00 177.57 178.56 1ngr h GLU 349 N 0.00 0.50 -0.41 1.57 5.08 -0.28 0.44 114.58 121.48 1ngr h GLU 349 Ca -0.03 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 1ngr h GLU 349 Cb 1.66 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.79 1ngr h GLU 349 CO 0.11 0.33 -0.22 -0.22 -1.00 0.00 0.00 179.01 178.00 1ngr h LYS 350 N 0.51 0.87 0.00 2.33 3.11 -1.38 -3.32 116.57 118.69 1ngr h LYS 350 Ca 0.38 -0.39 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1ngr h LYS 350 Cb 0.76 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 1ngr h LYS 350 CO -0.14 1.03 -0.02 -0.07 -2.81 0.00 0.00 179.45 177.44 1ngr h LEU 351 N 0.68 0.00 -5.49 5.20 3.38 0.55 -3.33 115.31 116.30 1ngr h LEU 351 Ca 0.09 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.58 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 0.06 0.45 2.84 0.18 0.09 0.00 0.00 178.44 182.06 1ngr n LEU 352 N -4.44 5.65 -3.85 1.67 4.77 0.14 -4.90 117.00 116.04 1ngr n LEU 352 Ca -0.00 -3.22 -0.39 0.00 -0.03 0.00 0.00 56.01 52.37 1ngr n LEU 352 Cb 0.01 -1.21 -0.01 0.00 -2.33 0.00 0.00 43.42 39.88 1ngr n LEU 352 CO 0.00 0.81 -0.27 -3.20 -1.33 0.00 0.00 177.39 173.41 1ngr n ASN 353 N 4.50 -2.11 -3.53 -1.43 5.15 -1.25 -4.17 115.26 112.43 1ngr n ASN 353 Ca 0.52 0.81 -0.39 0.00 -0.60 0.00 0.00 54.58 54.92 1ngr n ASN 353 Cb 0.19 -0.80 -0.05 0.00 -0.53 0.00 0.00 39.78 38.59 1ngr n ASN 353 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ngr n GLY 354 N 1.98 2.74 0.00 8.20 0.00 -1.26 -1.54 105.19 115.32 1ngr n GLY 354 Ca 0.12 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 6.75 0.00 0.12 1.61 2.03 -1.26 -4.95 116.55 120.85 1ngr n ASP 355 Ca 0.48 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.84 1ngr n ASP 355 Cb 0.35 0.00 0.46 0.00 -0.72 0.00 0.00 41.12 41.21 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 1.11 -0.50 5.18 2.02 -1.60 0.99 112.91 120.11 1ngr h THR 356 Ca 0.00 -0.43 0.10 0.00 0.77 0.00 0.00 66.41 66.85 1ngr h THR 356 Cb 0.00 0.98 -0.09 0.00 -1.74 0.00 0.00 68.15 67.30 1ngr h THR 356 CO 0.00 0.15 -0.03 4.11 0.37 0.00 0.00 175.52 180.12 1ngr h TRP 357 N 0.25 -0.09 -0.92 3.16 5.08 -1.49 -2.09 115.95 119.86 1ngr h TRP 357 Ca 0.06 0.04 0.20 0.00 1.08 0.00 0.00 58.89 60.27 1ngr h TRP 357 Cb 0.17 0.12 -0.17 0.00 -3.00 0.00 0.00 29.16 26.27 1ngr h TRP 357 CO 0.00 -0.14 -0.14 0.00 -1.28 0.00 0.00 178.44 176.88 1ngr h ARG 358 N 0.09 0.01 -0.05 0.12 3.08 -1.08 0.32 114.38 116.87 1ngr h ARG 358 Ca 0.25 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.34 1ngr h ARG 358 Cb 0.39 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1ngr h ARG 358 CO -0.45 0.01 -0.20 0.45 -1.07 0.00 0.00 179.97 178.72 1ngr h HIS 359 N 0.01 -0.52 -0.65 3.04 3.86 -1.35 -2.66 115.15 116.89 1ngr h HIS 359 Ca 0.48 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.67 1ngr h HIS 359 Cb 0.81 0.24 -0.03 0.00 1.06 0.00 0.00 27.41 29.49 1ngr h HIS 359 CO -0.63 -0.28 0.27 1.25 0.86 0.00 0.00 177.93 179.41 1ngr h LEU 360 N -0.29 0.88 -0.48 2.43 5.85 -1.10 -3.29 115.31 119.31 1ngr h LEU 360 Ca 0.07 -0.16 0.10 0.00 0.84 0.00 0.00 57.88 58.73 1ngr h LEU 360 Cb 0.39 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.11 1ngr h LEU 360 CO -0.22 0.80 -0.04 0.00 -0.34 0.00 0.00 178.44 178.64 1ngr h ALA 361 N 1.12 0.41 -0.77 1.25 0.00 -0.04 0.21 119.26 121.44 1ngr h ALA 361 Ca 0.22 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 1ngr h ALA 361 Cb 0.18 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1ngr h ALA 361 CO -0.02 -0.41 0.29 0.78 0.00 0.00 0.00 179.25 179.89 1ngr h GLY 362 N 0.07 1.24 2.00 0.00 0.00 -1.61 -2.63 103.07 102.14 1ngr h GLY 362 Ca 0.24 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1ngr h GLY 362 CO -0.44 0.65 0.00 0.83 0.00 0.00 0.00 176.54 177.58 1ngr h GLU 363 N 1.12 0.00 -1.00 4.80 4.39 -1.10 -2.71 114.58 120.08 1ngr h GLU 363 Ca 0.25 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 1ngr h GLU 363 Cb 0.24 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1ngr h GLU 363 CO -0.02 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.12 1ngr n LEU 364 N -2.67 2.68 -3.90 1.33 4.77 -0.21 -4.86 117.00 114.14 1ngr n LEU 364 Ca 0.01 -1.34 -0.27 0.00 -0.03 0.00 0.00 56.01 54.38 1ngr n LEU 364 Cb 0.28 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.88 1ngr n LEU 364 CO 0.24 0.46 -0.04 0.61 -1.33 0.00 0.00 177.39 177.33 1ngr n GLY 365 N 0.40 -0.37 3.15 -0.72 0.00 -1.02 -5.02 105.19 101.62 1ngr n GLY 365 Ca 0.00 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.56 2.13 0.89 1.61 2.02 -1.24 -5.11 117.35 114.10 1ngr s TYR 366 Ca 0.33 -0.84 -0.14 0.00 -0.37 0.00 0.00 57.07 56.05 1ngr s TYR 366 Cb -0.17 -1.46 0.01 0.00 -0.40 0.00 0.00 41.96 39.94 1ngr s TYR 366 CO 0.85 -0.36 0.39 1.04 -1.57 0.00 0.00 175.55 175.90 1ngr n GLN 367 N 3.60 -0.12 0.04 -0.62 6.02 -1.26 -4.45 117.38 120.59 1ngr n GLN 367 Ca -0.20 0.01 0.13 0.00 -0.01 0.00 0.00 57.00 56.92 1ngr n GLN 367 Cb 0.52 -1.82 0.59 0.00 1.02 0.00 0.00 30.24 30.56 1ngr n GLN 367 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1ngr h PRO 368 N -1.23 0.17 -0.02 -1.09 0.11 -1.98 -1.06 132.00 126.91 1ngr h PRO 368 Ca -0.44 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1ngr h PRO 368 Cb 1.30 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1ngr h PRO 368 CO 0.36 0.12 -0.52 0.93 -0.21 0.00 0.00 178.00 178.68 1ngr h GLU 369 N 0.18 0.05 -0.36 1.05 3.07 -2.00 -1.56 114.58 115.02 1ngr h GLU 369 Ca 0.19 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.87 1ngr h GLU 369 Cb 0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 1ngr h GLU 369 CO -0.03 0.56 -0.37 0.45 -1.40 0.00 0.00 179.01 178.22 1ngr h HIS 370 N 0.04 1.00 -0.60 4.33 3.86 -1.54 -2.10 115.15 120.15 1ngr h HIS 370 Ca -0.00 -0.29 -0.01 0.00 -1.16 0.00 0.00 60.37 58.91 1ngr h HIS 370 Cb 0.93 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.16 1ngr h HIS 370 CO 0.00 1.08 0.35 0.82 0.86 0.00 0.00 177.93 181.04 1ngr h ILE 371 N 0.69 1.18 0.01 2.45 1.08 -1.00 -0.96 117.51 120.97 1ngr h ILE 371 Ca 0.06 -0.42 0.01 0.00 -0.39 0.00 0.00 64.86 64.12 1ngr h ILE 371 Cb 0.93 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 1ngr h ILE 371 CO 0.09 0.19 -0.05 -0.78 -0.69 0.00 0.00 178.15 176.91 1ngr h ASP 372 N 0.81 -0.13 0.49 1.72 1.82 -1.37 -2.46 116.42 117.31 1ngr h ASP 372 Ca 0.21 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.87 1ngr h ASP 372 Cb -0.00 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.06 1ngr h ASP 372 CO -0.04 -0.07 0.00 -0.24 -1.61 0.00 0.00 179.24 177.28 1ngr n SER 373 N -5.16 0.19 -0.01 2.28 2.88 -0.79 -1.13 113.62 111.90 1ngr n SER 373 Ca -0.07 0.55 -0.11 0.00 -1.33 0.00 0.00 58.87 57.92 1ngr n SER 373 Cb 0.09 -0.59 -0.14 0.00 -0.75 0.00 0.00 64.21 62.82 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 0.11 0.00 0.66 0.04 -0.91 -3.09 116.94 113.75 1ngr h PHE 374 Ca 0.00 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1ngr h PHE 374 Cb 0.25 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 1ngr h PHE 374 CO 0.00 1.16 0.00 -2.37 -0.60 0.00 0.00 178.31 176.50 1ngr n THR 375 N -3.17 0.05 0.13 -1.55 5.66 -0.28 -3.12 114.28 111.99 1ngr n THR 375 Ca -0.18 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.61 1ngr n THR 375 Cb 1.04 -0.52 -0.15 0.00 -1.55 0.00 0.00 70.33 69.16 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 0.81 -2.36 1.09 3.86 -1.36 -3.47 115.15 113.72 1ngr h HIS 376 Ca 0.00 -0.58 -0.47 0.00 -1.16 0.00 0.00 60.37 58.16 1ngr h HIS 376 Cb 0.49 -0.04 0.23 0.00 1.06 0.00 0.00 27.41 29.16 1ngr h HIS 376 CO 0.00 1.44 -1.17 0.39 0.86 0.00 0.00 177.93 179.45 1ngr n GLU 377 N -3.66 -1.21 -0.15 2.45 -0.58 -1.17 -4.91 120.64 111.41 1ngr n GLU 377 Ca -0.13 -0.34 -0.03 0.00 -0.42 0.00 0.00 57.16 56.24 1ngr n GLU 377 Cb 1.06 -1.64 0.04 0.00 -0.57 0.00 0.00 31.44 30.32 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 -1.87 0.35 -3.39 0.62 0.00 -1.92 -3.38 119.26 109.67 1ngr h ALA 378 Ca -0.51 0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.37 1ngr h ALA 378 Cb 1.35 0.31 -0.26 0.00 0.00 0.00 0.00 17.79 19.20 1ngr h ALA 378 CO 0.36 -0.43 -0.63 0.00 0.00 0.00 0.00 179.25 178.55 1ngr n PRO 380 N 2.66 0.00 -0.46 0.00 -0.04 -1.19 -2.93 135.00 133.04 1ngr n PRO 380 Ca -0.15 0.42 0.38 0.00 -0.04 0.00 0.00 63.50 64.12 1ngr n PRO 380 Cb 0.58 -1.27 0.66 0.00 -0.04 0.00 0.00 33.50 33.44 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 0.09 0.70 0.52 2.07 -1.91 0.34 116.25 118.05 1ngr h VAL 381 Ca 0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1ngr h VAL 381 Cb 0.00 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1ngr h VAL 381 CO 0.00 0.01 -0.34 0.03 0.02 0.00 0.00 177.57 177.29 1ngr h ARG 382 N 0.06 -0.91 0.00 1.57 3.08 -1.84 -2.43 114.38 113.91 1ngr h ARG 382 Ca 0.84 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.95 1ngr h ARG 382 Cb 2.69 0.21 0.00 0.00 0.08 0.00 0.00 29.97 32.94 1ngr h ARG 382 CO -0.42 -0.59 -0.01 0.00 -1.07 0.00 0.00 179.97 177.88 1ngr n ALA 383 N -2.68 2.33 -0.01 0.04 0.00 -0.49 -3.08 120.51 116.61 1ngr n ALA 383 Ca -0.12 -0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.12 1ngr n ALA 383 Cb 0.38 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 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 -0.14 0.00 5.85 -0.40 -0.52 115.31 120.05 1ngr h LEU 384 Ca 0.00 -0.58 -0.03 0.00 0.84 0.00 0.00 57.88 58.11 1ngr h LEU 384 Cb 0.61 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 1ngr h LEU 384 CO 0.00 0.59 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.50 1ngr h LEU 385 N -0.73 0.00 -0.20 2.25 3.38 -1.52 0.17 115.31 118.66 1ngr h LEU 385 Ca -0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1ngr h LEU 385 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1ngr h LEU 385 CO 0.01 0.12 -0.56 0.00 0.09 0.00 0.00 178.44 178.11 1ngr h ALA 386 N 1.88 0.34 0.02 1.53 0.00 -1.53 -2.86 119.26 118.64 1ngr h ALA 386 Ca -0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 54.91 54.16 1ngr h ALA 386 Cb 1.05 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1ngr h ALA 386 CO 0.02 0.56 -1.26 1.03 0.00 0.00 0.00 179.25 179.60 1ngr h SER 387 N 0.45 0.08 -0.92 0.00 0.87 -0.83 -3.29 113.55 109.91 1ngr h SER 387 Ca -0.01 -0.63 0.06 0.00 -1.23 0.00 0.00 61.79 59.98 1ngr h SER 387 Cb 1.18 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 63.05 1ngr h SER 387 CO 0.12 1.51 0.59 -0.25 -0.53 0.00 0.00 176.83 178.26 1ngr h TRP 388 N -0.82 1.09 0.00 2.24 7.01 -0.88 -3.11 115.95 121.49 1ngr h TRP 388 Ca -0.33 0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.70 1ngr h TRP 388 Cb 1.40 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 28.11 1ngr h TRP 388 CO 0.11 0.57 0.00 0.41 -2.79 0.00 0.00 178.44 176.74 1ngr n GLY 389 N -1.34 1.72 0.00 2.65 0.00 -1.08 -1.80 105.19 105.33 1ngr n GLY 389 Ca 0.13 0.00 0.00 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 1.26 0.97 -1.74 4.61 0.00 -1.17 -4.45 120.51 119.98 1ngr n ALA 390 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 53.44 53.06 1ngr n ALA 390 Cb 0.35 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.84 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 -0.29 3.12 -0.52 0.00 -0.21 -0.75 -4.94 119.66 116.07 1ngr s GLN 391 Ca 0.00 0.77 -0.28 0.00 0.02 0.00 0.00 55.36 55.87 1ngr s GLN 391 Cb 0.00 -2.03 -0.10 0.00 1.00 0.00 0.00 33.01 31.89 1ngr s GLN 391 CO 0.00 -0.92 2.42 -3.47 -2.12 0.00 0.00 175.29 171.20 1ngr n ASP 392 N -2.98 2.10 -0.01 5.90 2.03 -1.26 -1.91 116.55 120.41 1ngr n ASP 392 Ca 0.07 -0.24 -0.00 0.00 0.52 0.00 0.00 54.79 55.14 1ngr n ASP 392 Cb 0.55 -1.45 -0.00 0.00 -0.72 0.00 0.00 41.12 39.49 1ngr n ASP 392 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1ngr n SER 393 N 14.06 -3.06 -2.20 1.67 3.41 -1.26 -4.95 113.62 121.30 1ngr n SER 393 Ca 0.41 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.98 1ngr n SER 393 Cb 0.43 -0.57 -0.07 0.00 -0.26 0.00 0.00 64.21 63.74 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 1.00 3.41 -1.14 7.33 0.00 -0.80 -4.59 120.51 125.73 1ngr n ALA 394 Ca -0.00 -0.74 -0.29 0.00 0.00 0.00 0.00 53.44 52.40 1ngr n ALA 394 Cb 0.01 -2.18 0.21 0.00 0.00 0.00 0.00 19.45 17.49 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 1.92 1.78 0.57 0.00 -4.23 -1.26 -4.40 115.64 110.02 1ngr s THR 395 Ca 0.27 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 61.03 1ngr s THR 395 Cb 0.13 -2.50 0.33 0.00 1.34 0.00 0.00 72.50 71.79 1ngr s THR 395 CO 0.00 0.00 2.22 0.25 -0.54 0.00 0.00 174.62 176.55 1ngr h LEU 396 N -2.28 0.00 -1.51 4.79 6.46 -1.55 -1.40 115.31 119.83 1ngr h LEU 396 Ca -0.49 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.25 1ngr h LEU 396 Cb 1.31 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.24 1ngr h LEU 396 CO 0.45 0.00 -0.08 0.44 -0.62 0.00 0.00 178.44 178.63 1ngr h ASP 397 N 0.00 0.00 0.03 1.25 5.19 -1.91 0.55 116.42 121.54 1ngr h ASP 397 Ca 0.00 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1ngr h ASP 397 Cb 0.02 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.53 1ngr h ASP 397 CO -0.00 0.08 -0.25 0.00 -3.12 0.00 0.00 179.24 175.95 1ngr h ALA 398 N 1.92 -0.01 -0.61 3.45 0.00 -1.51 -2.49 119.26 120.01 1ngr h ALA 398 Ca -0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 1ngr h ALA 398 Cb 0.53 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1ngr h ALA 398 CO 0.01 0.10 0.13 1.25 0.00 0.00 0.00 179.25 180.74 1ngr h LEU 399 N -0.72 0.91 -1.12 0.00 6.46 -1.29 0.12 115.31 119.67 1ngr h LEU 399 Ca -0.04 -0.19 0.03 0.00 -0.12 0.00 0.00 57.88 57.56 1ngr h LEU 399 Cb 1.14 -0.24 -0.05 0.00 -0.73 0.00 0.00 40.66 40.78 1ngr h LEU 399 CO 0.05 0.90 0.60 0.25 -0.62 0.00 0.00 178.44 179.61 1ngr h LEU 400 N 0.92 0.99 -0.27 2.25 6.46 -0.97 0.12 115.31 124.81 1ngr h LEU 400 Ca 0.19 -0.01 -0.14 0.00 -0.12 0.00 0.00 57.88 57.80 1ngr h LEU 400 Cb 0.36 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.05 1ngr h LEU 400 CO 0.00 0.68 -0.38 0.00 -0.62 0.00 0.00 178.44 178.13 1ngr h ALA 401 N 1.46 0.41 -0.86 1.25 0.00 -0.91 -2.86 119.26 117.75 1ngr h ALA 401 Ca 0.36 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ngr h ALA 401 Cb -0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1ngr h ALA 401 CO -0.11 0.50 0.57 0.00 0.00 0.00 0.00 179.25 180.22 1ngr h ALA 402 N 0.68 1.09 -0.99 0.00 0.00 -0.17 -1.19 119.26 118.68 1ngr h ALA 402 Ca 0.03 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1ngr h ALA 402 Cb 0.97 -0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1ngr h ALA 402 CO 0.09 0.50 0.64 -0.07 0.00 0.00 0.00 179.25 180.41 1ngr h LEU 403 N 1.17 1.05 -1.54 0.00 3.38 -0.84 -2.08 115.31 116.44 1ngr h LEU 403 Ca 0.32 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 1ngr h LEU 403 Cb -0.13 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.38 1ngr h LEU 403 CO -0.07 0.69 -0.24 -0.09 0.09 0.00 0.00 178.44 178.82 1ngr h ARG 404 N 1.21 0.00 -0.95 1.13 2.43 -1.00 -0.68 114.38 116.52 1ngr h ARG 404 Ca 0.41 0.00 0.16 0.00 -0.81 0.00 0.00 59.98 59.74 1ngr h ARG 404 Cb 0.09 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 29.54 1ngr h ARG 404 CO -0.15 0.24 0.56 0.00 -1.51 0.00 0.00 179.97 179.11 1ngr h ARG 405 N 0.00 0.75 -0.65 0.20 2.47 -0.69 -2.12 114.38 114.33 1ngr h ARG 405 Ca -0.00 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 1ngr h ARG 405 Cb 0.48 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.63 1ngr h ARG 405 CO 0.03 0.49 0.00 0.44 0.56 0.00 0.00 179.97 181.50 1ngr n ILE 406 N -4.77 1.36 -2.20 2.04 -5.35 -0.90 -4.94 119.36 104.61 1ngr n ILE 406 Ca 0.20 -1.10 -0.10 0.00 -0.27 0.00 0.00 62.75 61.47 1ngr n ILE 406 Cb 0.48 0.34 -0.01 0.00 -1.74 0.00 0.00 39.64 38.70 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 1.27 -2.11 -1.12 6.28 3.00 -0.80 -4.85 117.38 119.06 1ngr n GLN 407 Ca 0.24 0.53 -0.26 0.00 -0.01 0.00 0.00 57.00 57.50 1ngr n GLN 407 Cb 0.72 -5.03 -0.09 0.00 0.00 0.00 0.00 30.24 25.84 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 -2.53 2.80 0.23 -1.09 5.12 -0.31 -4.45 116.66 116.44 1ngr n ARG 408 Ca -0.12 -1.59 0.13 0.00 -1.93 0.00 0.00 57.85 54.33 1ngr n ARG 408 Cb 0.54 -2.41 0.43 0.00 -1.16 0.00 0.00 32.46 29.86 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 4.24 0.98 -0.24 7.54 0.00 -1.89 -3.12 119.26 126.76 1ngr h ALA 409 Ca 0.54 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.41 1ngr h ALA 409 Cb 0.80 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 1ngr h ALA 409 CO 1.07 0.13 -0.34 0.38 0.00 0.00 0.00 179.25 180.49 1ngr h ASP 410 N 0.00 -1.10 0.38 0.00 2.03 -1.96 -1.93 116.42 113.83 1ngr h ASP 410 Ca -0.00 0.17 -0.09 0.00 -0.73 0.00 0.00 57.03 56.38 1ngr h ASP 410 Cb 0.79 0.48 -0.01 0.00 -0.83 0.00 0.00 39.33 39.76 1ngr h ASP 410 CO 0.01 -0.36 -0.41 0.40 -1.03 0.00 0.00 179.24 177.85 1ngr h ILE 411 N -0.36 1.30 0.85 4.15 2.04 -1.89 -2.19 117.51 121.42 1ngr h ILE 411 Ca 0.12 -1.45 -0.04 0.00 1.00 0.00 0.00 64.86 64.49 1ngr h ILE 411 Cb 0.56 1.75 0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1ngr h ILE 411 CO -0.44 0.42 -0.41 0.58 0.00 0.00 0.00 178.15 178.30 1ngr h VAL 412 N 0.04 0.00 0.00 1.67 2.07 -1.37 0.22 116.25 118.88 1ngr h VAL 412 Ca 0.00 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1ngr h VAL 412 Cb 0.75 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1ngr h VAL 412 CO 0.06 0.00 -0.10 1.05 0.02 0.00 0.00 177.57 178.60 1ngr h GLU 413 N -1.21 0.00 -0.41 1.57 4.11 -1.39 -0.67 114.58 116.59 1ngr h GLU 413 Ca -0.12 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.17 1ngr h GLU 413 Cb 0.87 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 1ngr h GLU 413 CO 0.19 0.10 -0.32 1.03 0.07 0.00 0.00 179.01 180.09 1ngr h SER 414 N 0.00 0.95 -0.95 3.06 0.87 -1.38 -2.65 113.55 113.46 1ngr h SER 414 Ca -0.00 -0.40 0.15 0.00 -1.23 0.00 0.00 61.79 60.30 1ngr h SER 414 Cb 0.18 -0.27 -0.08 0.00 -0.44 0.00 0.00 62.40 61.79 1ngr h SER 414 CO 0.01 1.18 0.60 -0.07 -0.53 0.00 0.00 176.83 178.02 1ngr h LEU 415 N 0.76 0.75 -1.15 2.23 3.38 0.43 0.27 115.31 121.98 1ngr h LEU 415 Ca 0.08 0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.25 1ngr h LEU 415 Cb 0.89 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.46 1ngr h LEU 415 CO 0.08 0.37 0.60 0.00 0.09 0.00 0.00 178.44 179.58 1ngr n SER 417 N -4.61 0.54 0.00 0.00 3.41 -0.25 -5.12 113.62 107.59 1ngr n SER 417 Ca 0.19 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1ngr n SER 417 Cb 0.46 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1ngr n SER 417 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09