#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hkx n THR 336 N 0.00 2.56 0.08 1.12 -2.24 -1.26 -4.75 114.28 109.79 1hkx n THR 336 Ca 0.00 -1.94 -0.05 0.00 -2.27 0.00 0.00 64.05 59.79 1hkx n THR 336 Cb 0.00 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 67.91 1hkx n THR 336 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hkx h THR 337 N 2.05 0.00 -3.99 4.28 1.03 -2.05 -3.38 112.91 110.84 1hkx h THR 337 Ca 0.12 0.00 -0.49 0.00 -0.01 0.00 0.00 66.41 66.03 1hkx h THR 337 Cb 1.79 0.00 0.17 0.00 -1.07 0.00 0.00 68.15 69.04 1hkx h THR 337 CO 0.42 0.00 0.20 -0.63 -0.01 0.00 0.00 175.52 175.50 1hkx s ILE 338 N -3.69 2.43 -0.62 0.00 1.09 -1.26 -2.69 121.20 116.46 1hkx s ILE 338 Ca -0.04 0.14 -0.11 0.00 -1.10 0.00 0.00 60.65 59.54 1hkx s ILE 338 Cb 0.01 -2.40 0.02 0.00 -1.06 0.00 0.00 42.46 39.03 1hkx s ILE 338 CO 0.14 -0.18 0.65 -0.62 -0.10 0.00 0.00 174.94 174.83 1hkx n GLU 339 N -4.17 -1.78 0.00 2.79 1.02 -1.26 -4.49 120.64 112.76 1hkx n GLU 339 Ca 0.08 1.53 0.00 0.00 -0.02 0.00 0.00 57.16 58.75 1hkx n GLU 339 Cb 0.54 -4.48 0.00 0.00 -0.02 0.00 0.00 31.44 27.48 1hkx n GLU 339 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1hkx n ASP 340 N -1.25 0.00 0.22 1.62 2.03 -1.25 -4.80 116.55 113.12 1hkx n ASP 340 Ca -0.04 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.41 1hkx n ASP 340 Cb 0.56 0.00 0.37 0.00 -0.72 0.00 0.00 41.12 41.33 1hkx n ASP 340 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1hkx h GLU 341 N 0.00 0.00 0.00 -0.67 4.22 -1.73 -2.70 114.58 113.69 1hkx h GLU 341 Ca 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 59.36 59.25 1hkx h GLU 341 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1hkx h GLU 341 CO 0.00 0.00 -1.72 -0.40 -2.18 0.00 0.00 179.01 174.71 1hkx n ASP 342 N -2.97 0.54 0.20 1.04 5.75 -1.26 -3.21 116.55 116.64 1hkx n ASP 342 Ca 0.03 0.24 0.05 0.00 -0.01 0.00 0.00 54.79 55.09 1hkx n ASP 342 Cb 0.43 0.63 0.42 0.00 -1.03 0.00 0.00 41.12 41.57 1hkx n ASP 342 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1hkx h THR 343 N 0.00 1.08 -0.25 2.12 1.35 -1.88 0.34 112.91 115.67 1hkx h THR 343 Ca -0.22 -1.20 -0.04 0.00 -0.55 0.00 0.00 66.41 64.40 1hkx h THR 343 Cb 1.64 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 69.73 1hkx h THR 343 CO 0.04 0.32 0.01 0.50 -0.25 0.00 0.00 175.52 176.14 1hkx h LYS 344 N 0.00 0.44 0.00 4.72 1.63 -1.53 -1.39 116.57 120.44 1hkx h LYS 344 Ca -0.00 -0.14 -0.15 0.00 -0.85 0.00 0.00 60.65 59.51 1hkx h LYS 344 Cb 0.65 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.21 1hkx h LYS 344 CO 0.04 0.60 -0.73 -0.39 -3.45 0.00 0.00 179.45 175.53 1hkx h VAL 345 N 0.22 1.40 -0.52 2.00 -1.51 -1.35 -2.54 116.25 113.94 1hkx h VAL 345 Ca 0.07 -2.59 -0.12 0.00 -1.23 0.00 0.00 66.70 62.83 1hkx h VAL 345 Cb 0.40 2.45 -0.02 0.00 -2.13 0.00 0.00 31.29 31.99 1hkx h VAL 345 CO 0.01 0.71 -0.13 0.03 -1.23 0.00 0.00 177.57 176.97 1hkx h ARG 346 N 0.00 1.00 -0.36 5.19 3.08 -0.25 -0.58 114.38 122.46 1hkx h ARG 346 Ca -0.01 -0.37 -0.13 0.00 0.07 0.00 0.00 59.98 59.54 1hkx h ARG 346 Cb 1.39 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.37 1hkx h ARG 346 CO 0.09 1.05 -0.29 0.87 -1.07 0.00 0.00 179.97 180.63 1hkx h LYS 347 N 0.89 0.78 -0.07 0.04 1.57 -1.22 -1.90 116.57 116.65 1hkx h LYS 347 Ca 0.13 -0.35 -0.07 0.00 -1.87 0.00 0.00 60.65 58.49 1hkx h LYS 347 Cb 0.69 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1hkx h LYS 347 CO 0.05 0.97 -0.29 0.37 -0.57 0.00 0.00 179.45 179.98 1hkx h GLN 348 N 0.66 0.13 -0.06 3.15 5.75 -1.21 -0.18 115.11 123.35 1hkx h GLN 348 Ca 0.08 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1hkx h GLN 348 Cb 0.82 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.36 1hkx h GLN 348 CO 0.07 0.41 0.04 1.49 -2.65 0.00 0.00 178.83 178.19 1hkx h GLU 349 N 0.12 0.09 -0.76 1.69 4.57 -0.57 -0.46 114.58 119.26 1hkx h GLU 349 Ca 0.02 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 1hkx h GLU 349 Cb 0.58 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1hkx h GLU 349 CO 0.04 0.12 0.26 0.82 -1.18 0.00 0.00 179.01 179.07 1hkx h ILE 350 N 0.03 1.26 -0.34 2.32 5.03 -0.77 -2.38 117.51 122.67 1hkx h ILE 350 Ca 0.02 -0.88 -0.05 0.00 -0.12 0.00 0.00 64.86 63.83 1hkx h ILE 350 Cb 0.05 0.40 -0.02 0.00 -3.03 0.00 0.00 36.82 34.23 1hkx h ILE 350 CO -0.00 0.35 -0.01 0.40 -0.68 0.00 0.00 178.15 178.21 1hkx h ILE 351 N 1.12 1.20 -0.29 -0.67 2.04 -0.72 -1.95 117.51 118.23 1hkx h ILE 351 Ca 0.25 -0.79 -0.07 0.00 1.00 0.00 0.00 64.86 65.24 1hkx h ILE 351 Cb 0.28 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1hkx h ILE 351 CO -0.01 0.27 -0.10 0.50 0.00 0.00 0.00 178.15 178.81 1hkx h LYS 352 N 0.50 0.59 -0.20 2.37 3.64 -0.60 -1.34 116.57 121.52 1hkx h LYS 352 Ca 0.11 -0.24 -0.10 0.00 -1.27 0.00 0.00 60.65 59.15 1hkx h LYS 352 Cb 0.34 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1hkx h LYS 352 CO 0.01 0.80 -0.30 -0.39 -2.27 0.00 0.00 179.45 177.30 1hkx h VAL 353 N 0.34 1.27 -0.51 2.00 -1.51 -1.30 0.33 116.25 116.87 1hkx h VAL 353 Ca 0.07 -1.33 -0.07 0.00 -1.23 0.00 0.00 66.70 64.14 1hkx h VAL 353 Cb 0.60 1.45 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 1hkx h VAL 353 CO 0.04 0.41 0.04 0.74 -1.23 0.00 0.00 177.57 177.58 1hkx h THR 354 N 0.35 1.26 -0.67 7.19 2.02 -1.25 0.20 112.91 122.01 1hkx h THR 354 Ca 0.05 -1.01 -0.05 0.00 0.77 0.00 0.00 66.41 66.17 1hkx h THR 354 Cb 0.71 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1hkx h THR 354 CO 0.05 0.36 0.23 -0.33 0.37 0.00 0.00 175.52 176.20 1hkx h GLU 355 N 0.75 1.03 -0.49 6.66 5.08 -0.85 -0.46 114.58 126.29 1hkx h GLU 355 Ca 0.15 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1hkx h GLU 355 Cb 0.46 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1hkx h GLU 355 CO 0.02 0.88 0.17 1.96 -1.00 0.00 0.00 179.01 181.04 1hkx h GLN 356 N 0.96 0.76 -0.09 2.33 4.20 -0.57 -0.73 115.11 121.97 1hkx h GLN 356 Ca 0.22 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1hkx h GLN 356 Cb 0.27 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1hkx h GLN 356 CO -0.01 0.70 0.03 1.25 -0.67 0.00 0.00 178.83 180.12 1hkx h LEU 357 N 0.66 0.03 -1.20 1.46 5.85 -0.28 -1.09 115.31 120.73 1hkx h LEU 357 Ca 0.16 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1hkx h LEU 357 Cb 0.24 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1hkx h LEU 357 CO -0.01 0.03 0.43 0.40 -0.34 0.00 0.00 178.44 178.96 1hkx h ILE 358 N 0.07 1.20 -0.49 4.05 2.04 -0.89 -0.80 117.51 122.70 1hkx h ILE 358 Ca 0.04 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 1hkx h ILE 358 Cb 0.02 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1hkx h ILE 358 CO -0.04 0.21 0.07 -0.33 0.00 0.00 0.00 178.15 178.06 1hkx h GLU 359 N 0.99 0.81 -0.34 2.37 5.08 -0.64 0.31 114.58 123.16 1hkx h GLU 359 Ca 0.26 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1hkx h GLU 359 Cb -0.04 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1hkx h GLU 359 CO -0.05 0.82 0.21 0.00 -1.00 0.00 0.00 179.01 178.99 1hkx h ALA 360 N 0.96 0.44 0.02 3.43 0.00 -0.72 0.78 119.26 124.17 1hkx h ALA 360 Ca 0.15 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1hkx h ALA 360 Cb 0.41 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1hkx h ALA 360 CO 0.01 -0.07 -0.01 0.82 0.00 0.00 0.00 179.25 180.00 1hkx h ILE 361 N 0.45 0.97 -0.02 0.00 2.04 -0.88 -0.83 117.51 119.23 1hkx h ILE 361 Ca 0.12 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.99 1hkx h ILE 361 Cb 0.00 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1hkx h ILE 361 CO -0.02 0.00 0.02 -1.28 0.00 0.00 0.00 178.15 176.87 1hkx h SER 362 N -0.03 0.00 -0.60 1.72 0.87 0.00 -1.53 113.55 113.97 1hkx h SER 362 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1hkx h SER 362 Cb 0.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1hkx h SER 362 CO 0.00 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.89 1hkx n ASN 363 N -4.23 3.66 -1.92 6.23 3.02 0.23 -4.94 115.26 117.32 1hkx n ASN 363 Ca -0.02 -1.99 -0.20 0.00 -0.03 0.00 0.00 54.58 52.34 1hkx n ASN 363 Cb 0.11 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 38.84 1hkx n ASN 363 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hkx n GLY 364 N 1.59 0.62 3.48 7.41 0.00 -0.58 -4.91 105.19 112.80 1hkx n GLY 364 Ca 0.22 -0.06 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1hkx n GLY 364 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hkx s ASP 365 N -2.42 6.91 0.47 1.61 3.68 -0.38 -4.85 116.67 121.69 1hkx s ASP 365 Ca 0.00 -2.63 0.13 0.00 2.13 0.00 0.00 52.55 52.19 1hkx s ASP 365 Cb 0.00 -2.43 1.07 0.00 -1.45 0.00 0.00 42.92 40.12 1hkx s ASP 365 CO 0.00 -0.91 2.07 0.15 0.13 0.00 0.00 175.17 176.61 1hkx h PHE 366 N 7.74 0.12 0.13 -5.34 3.57 -1.91 -2.45 116.94 118.80 1hkx h PHE 366 Ca 0.29 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1hkx h PHE 366 Cb 0.92 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1hkx h PHE 366 CO 1.16 0.15 -0.06 0.93 -2.23 0.00 0.00 178.31 178.26 1hkx h GLU 367 N 0.12 -0.17 -0.81 1.11 3.07 -1.97 -0.58 114.58 115.35 1hkx h GLU 367 Ca 0.03 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.89 1hkx h GLU 367 Cb 0.12 0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.03 1hkx h GLU 367 CO 0.00 0.01 0.45 0.77 -1.40 0.00 0.00 179.01 178.84 1hkx h SER 368 N -0.33 0.99 0.49 1.42 0.02 -1.94 -2.07 113.55 112.14 1hkx h SER 368 Ca -0.02 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1hkx h SER 368 Cb 0.26 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1hkx h SER 368 CO 0.03 0.79 -0.35 0.22 -1.14 0.00 0.00 176.83 176.38 1hkx h TYR 369 N 1.12 -0.94 -0.62 3.45 3.20 -1.15 -2.09 116.97 119.93 1hkx h TYR 369 Ca 0.29 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.22 1hkx h TYR 369 Cb 0.01 0.35 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 1hkx h TYR 369 CO 0.01 -0.52 0.41 1.79 -1.64 0.00 0.00 178.16 178.21 1hkx h THR 370 N -0.82 0.99 -0.16 1.81 1.35 -0.96 0.19 112.91 115.32 1hkx h THR 370 Ca -0.05 -0.20 -0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1hkx h THR 370 Cb 0.69 0.34 -0.01 0.00 -1.73 0.00 0.00 68.15 67.45 1hkx h THR 370 CO 0.02 0.11 0.08 0.50 -0.25 0.00 0.00 175.52 175.98 1hkx h LYS 371 N 0.60 0.21 -0.01 4.72 3.11 -0.92 -2.07 116.57 122.20 1hkx h LYS 371 Ca 0.27 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 58.09 1hkx h LYS 371 Cb 0.30 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.48 1hkx h LYS 371 CO -0.08 0.16 -0.31 -1.33 -2.81 0.00 0.00 179.45 175.08 1hkx n MET 372 N -4.49 0.97 -4.51 1.90 2.81 0.61 -4.91 117.12 109.50 1hkx n MET 372 Ca -0.01 -0.66 -0.32 0.00 -1.81 0.00 0.00 57.70 54.90 1hkx n MET 372 Cb 0.09 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 31.01 1hkx n MET 372 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1hkx s ASP 374 N -1.28 7.22 0.41 0.00 3.68 -0.16 -4.80 116.67 121.75 1hkx s ASP 374 Ca 0.16 2.27 0.16 0.00 2.13 0.00 0.00 52.55 57.26 1hkx s ASP 374 Cb -0.11 -2.62 1.03 0.00 -1.45 0.00 0.00 42.92 39.77 1hkx s ASP 374 CO 0.06 -0.17 1.87 -0.65 0.13 0.00 0.00 175.17 176.41 1hkx h PRO 375 N 3.72 0.44 -1.00 4.34 0.11 -1.91 0.30 132.00 138.01 1hkx h PRO 375 Ca -0.47 -0.03 -0.36 0.00 0.11 0.00 0.00 66.00 65.25 1hkx h PRO 375 Cb 1.21 -0.10 -0.22 0.00 0.11 0.00 0.00 31.00 32.01 1hkx h PRO 375 CO 0.67 0.29 0.46 0.41 -0.21 0.00 0.00 178.00 179.62 1hkx n GLY 376 N -1.50 3.75 3.76 -0.55 0.00 -1.26 -4.12 105.19 105.26 1hkx n GLY 376 Ca 0.18 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 1hkx n GLY 376 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1hkx n MET 377 N -0.65 2.66 -4.25 1.61 0.00 0.09 -4.69 117.12 111.88 1hkx n MET 377 Ca 0.42 0.94 -0.29 0.00 0.00 0.00 0.00 57.70 58.76 1hkx n MET 377 Cb 1.33 -2.68 -0.10 0.00 0.00 0.00 0.00 33.22 31.76 1hkx n MET 377 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1hkx s THR 378 N -0.63 3.18 -0.06 1.12 2.01 -0.82 -0.69 115.64 119.75 1hkx s THR 378 Ca 0.58 -1.37 -0.21 0.00 0.31 0.00 0.00 61.69 61.00 1hkx s THR 378 Cb -0.49 -2.48 0.04 0.00 0.01 0.00 0.00 72.50 69.58 1hkx s THR 378 CO 0.57 0.09 0.48 0.00 -0.69 0.00 0.00 174.62 175.07 1hkx s ALA 379 N -1.22 -1.21 -0.12 7.40 0.00 0.06 -1.79 121.76 124.88 1hkx s ALA 379 Ca 0.20 0.88 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1hkx s ALA 379 Cb -0.11 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1hkx s ALA 379 CO 0.13 -0.29 -0.17 -0.06 0.00 0.00 0.00 175.76 175.36 1hkx s PHE 380 N -0.97 2.19 -0.04 0.00 2.99 -0.56 -1.04 117.98 120.55 1hkx s PHE 380 Ca -0.10 -1.07 -0.29 0.00 0.00 0.00 0.00 56.93 55.47 1hkx s PHE 380 Cb -0.03 -1.55 0.09 0.00 0.00 0.00 0.00 43.02 41.53 1hkx s PHE 380 CO 0.06 -0.53 0.76 -1.83 -0.00 0.00 0.00 175.22 173.68 1hkx s GLU 381 N 0.96 0.96 0.32 0.44 -1.05 -1.26 -0.28 118.70 118.78 1hkx s GLU 381 Ca -0.06 0.08 0.09 0.00 -0.15 0.00 0.00 54.97 54.94 1hkx s GLU 381 Cb -0.15 0.45 0.91 0.00 -0.44 0.00 0.00 34.13 34.90 1hkx s GLU 381 CO -0.02 -0.33 1.70 -1.35 0.95 0.00 0.00 175.26 176.21 1hkx h PRO 382 N 2.67 0.43 0.00 -4.83 0.11 -1.87 0.17 132.00 128.68 1hkx h PRO 382 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1hkx h PRO 382 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1hkx h PRO 382 CO 0.36 0.28 0.00 0.93 -0.21 0.00 0.00 178.00 179.37 1hkx h GLU 383 N 0.44 0.00 -0.42 1.05 3.07 -1.90 -2.22 114.58 114.60 1hkx h GLU 383 Ca 0.65 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.51 1hkx h GLU 383 Cb 1.32 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.23 1hkx h GLU 383 CO -0.54 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.07 1hkx n ALA 384 N -1.95 2.44 -4.11 3.43 0.00 0.58 -4.97 120.51 115.92 1hkx n ALA 384 Ca -0.01 -0.82 -0.30 0.00 0.00 0.00 0.00 53.44 52.32 1hkx n ALA 384 Cb 0.15 -0.97 -0.04 0.00 0.00 0.00 0.00 19.45 18.59 1hkx n ALA 384 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1hkx n LEU 385 N 0.90 -1.80 0.00 0.00 4.77 -0.83 -1.02 117.00 119.01 1hkx n LEU 385 Ca 0.17 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 1hkx n LEU 385 Cb 0.42 -2.04 0.00 0.00 -2.33 0.00 0.00 43.42 39.47 1hkx n LEU 385 CO 0.12 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1hkx n GLY 386 N -1.94 0.85 3.87 -0.72 0.00 -1.26 -5.03 105.19 100.96 1hkx n GLY 386 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1hkx n GLY 386 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hkx s ASN 387 N -2.73 6.15 -0.29 1.61 0.01 -0.19 -5.07 114.94 114.42 1hkx s ASN 387 Ca 0.00 0.25 -0.24 0.00 -0.71 0.00 0.00 52.86 52.16 1hkx s ASN 387 Cb 0.00 -1.87 0.00 0.00 0.41 0.00 0.00 41.25 39.79 1hkx s ASN 387 CO 0.00 0.24 0.83 -0.22 -1.51 0.00 0.00 177.10 176.44 1hkx s LEU 388 N -2.07 4.07 0.01 0.60 0.20 -1.26 -4.63 118.68 115.60 1hkx s LEU 388 Ca 0.28 0.81 -0.03 0.00 0.69 0.00 0.00 54.13 55.88 1hkx s LEU 388 Cb -0.13 -3.16 -0.04 0.00 -0.43 0.00 0.00 46.19 42.43 1hkx s LEU 388 CO 0.20 -0.61 0.22 -0.69 -0.29 0.00 0.00 176.35 175.17 1hkx s VAL 389 N 3.00 5.39 0.15 1.68 1.01 -0.21 -4.91 120.40 126.51 1hkx s VAL 389 Ca 0.34 -0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.31 1hkx s VAL 389 Cb -0.14 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1hkx s VAL 389 CO 0.11 0.29 -0.18 -1.61 0.00 0.00 0.00 175.10 173.71 1hkx s GLU 390 N -2.02 1.75 0.15 2.72 2.02 -1.26 -0.76 118.70 121.29 1hkx s GLU 390 Ca 0.29 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.98 1hkx s GLU 390 Cb -0.13 -2.04 0.00 0.00 0.10 0.00 0.00 34.13 32.06 1hkx s GLU 390 CO 0.20 0.45 0.00 0.41 0.02 0.00 0.00 175.26 176.33 1hkx n GLY 391 N 0.49 -1.76 0.00 -1.39 0.00 0.13 -4.57 105.19 98.09 1hkx n GLY 391 Ca -0.14 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.61 1hkx n GLY 391 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hkx n LEU 392 N -2.56 0.76 -0.29 0.99 4.32 -1.26 -4.38 117.00 114.57 1hkx n LEU 392 Ca -0.00 -0.26 0.08 0.00 -0.02 0.00 0.00 56.01 55.80 1hkx n LEU 392 Cb 0.25 -0.11 0.23 0.00 -1.62 0.00 0.00 43.42 42.17 1hkx n LEU 392 CO 0.01 0.18 1.07 -0.78 -1.22 0.00 0.00 177.39 176.64 1hkx h ASP 393 N 0.00 0.42 0.33 -1.43 3.58 -1.96 -0.84 116.42 116.53 1hkx h ASP 393 Ca 0.00 0.11 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 1hkx h ASP 393 Cb 0.52 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.62 1hkx h ASP 393 CO 0.00 0.15 -0.31 0.15 -2.88 0.00 0.00 179.24 176.35 1hkx h PHE 394 N 0.53 0.00 0.00 0.28 3.04 -1.81 -3.10 116.94 115.88 1hkx h PHE 394 Ca 0.47 0.00 -0.22 0.00 3.98 0.00 0.00 57.97 62.20 1hkx h PHE 394 Cb 0.72 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.20 1hkx h PHE 394 CO -0.12 0.31 -1.13 0.45 -2.02 0.00 0.00 178.31 175.80 1hkx h HIS 395 N 0.00 0.00 -0.99 0.41 -0.00 -1.45 -3.33 115.15 109.79 1hkx h HIS 395 Ca -0.00 0.00 0.24 0.00 -0.00 0.00 0.00 60.37 60.61 1hkx h HIS 395 Cb 0.56 0.00 -0.08 0.00 -0.00 0.00 0.00 27.41 27.89 1hkx h HIS 395 CO 0.00 0.94 0.65 -0.09 -0.00 0.00 0.00 177.93 179.43 1hkx h ARG 396 N 0.00 0.37 -0.39 2.45 2.43 -1.32 -2.06 114.38 115.87 1hkx h ARG 396 Ca -0.08 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1hkx h ARG 396 Cb 1.79 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 31.18 1hkx h ARG 396 CO 0.11 0.24 -0.10 0.35 -1.51 0.00 0.00 179.97 179.06 1hkx h PHE 397 N 0.38 -0.23 0.00 2.20 3.57 -1.72 -0.67 116.94 120.47 1hkx h PHE 397 Ca 0.54 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 62.03 1hkx h PHE 397 Cb 1.41 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 40.30 1hkx h PHE 397 CO -0.00 -0.18 -0.22 1.88 -2.23 0.00 0.00 178.31 177.57 1hkx h TYR 398 N -0.01 0.00 0.26 0.41 -1.99 -1.62 -1.34 116.97 112.68 1hkx h TYR 398 Ca 0.19 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.90 1hkx h TYR 398 Cb 0.29 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.03 1hkx h TYR 398 CO -0.35 0.22 -0.12 0.74 -0.00 0.00 0.00 178.16 178.64 1hkx h PHE 399 N 0.00 -0.32 0.00 4.88 -1.00 -1.23 -3.24 116.94 116.03 1hkx h PHE 399 Ca -0.00 -0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.75 1hkx h PHE 399 Cb 0.70 0.11 -0.00 0.00 3.61 0.00 0.00 35.95 40.37 1hkx h PHE 399 CO 0.00 -0.02 -0.09 1.49 -1.61 0.00 0.00 178.31 178.08 1hkx h GLU 400 N -1.00 0.00 -0.89 1.51 4.81 -1.14 -3.00 114.58 114.87 1hkx h GLU 400 Ca -0.04 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.58 1hkx h GLU 400 Cb 0.45 0.00 -0.34 0.00 0.63 0.00 0.00 28.75 29.49 1hkx h GLU 400 CO 0.06 0.09 0.23 0.09 -0.73 0.00 0.00 179.01 178.75 1hkx n ASN 401 N -3.77 6.46 -2.83 1.04 4.13 -0.51 -4.57 115.26 115.21 1hkx n ASN 401 Ca -0.02 -3.77 -0.11 0.00 1.68 0.00 0.00 54.58 52.36 1hkx n ASN 401 Cb 0.19 -0.74 0.03 0.00 -1.54 0.00 0.00 39.78 37.72 1hkx n ASN 401 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1hkx n LEU 402 N -0.86 -2.31 -0.13 3.41 4.77 -1.13 -4.94 117.00 115.82 1hkx n LEU 402 Ca 0.55 -3.59 -0.21 0.00 -0.03 0.00 0.00 56.01 52.73 1hkx n LEU 402 Cb 0.81 0.81 -0.11 0.00 -2.33 0.00 0.00 43.42 42.60 1hkx n LEU 402 CO 0.63 2.02 -1.35 0.79 -1.33 0.00 0.00 177.39 178.15 1hkx n TRP 403 N 1.52 0.00 -0.15 -1.77 5.03 -1.26 -4.36 117.44 116.45 1hkx n TRP 403 Ca 0.11 0.00 0.29 0.00 3.03 0.00 0.00 57.50 60.93 1hkx n TRP 403 Cb 0.62 -0.96 0.68 0.00 -1.03 0.00 0.00 31.31 30.62 1hkx n TRP 403 CO 0.00 0.00 0.00 0.77 -0.03 0.00 0.00 177.69 178.43 1hkx h SER 404 N -0.29 0.00 -0.18 -0.99 0.02 -1.97 1.04 113.55 111.18 1hkx h SER 404 Ca -0.60 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.41 1hkx h SER 404 Cb 1.79 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.32 1hkx h SER 404 CO -0.18 0.00 0.21 0.03 -1.14 0.00 0.00 176.83 175.75 1hkx h ARG 405 N 0.00 0.00 -0.59 3.45 3.08 -1.88 -1.94 114.38 116.50 1hkx h ARG 405 Ca 0.42 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.56 1hkx h ARG 405 Cb 2.02 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.96 1hkx h ARG 405 CO -0.00 0.00 -0.45 -0.91 -1.07 0.00 0.00 179.97 177.54 1hkx h ASN 406 N 0.00 -1.54 -0.38 7.04 4.21 0.86 0.30 115.58 126.07 1hkx h ASN 406 Ca 0.09 0.25 -0.15 0.00 1.21 0.00 0.00 56.30 57.69 1hkx h ASN 406 Cb 0.51 0.70 -0.01 0.00 -1.12 0.00 0.00 38.32 38.40 1hkx h ASN 406 CO -0.00 -0.34 -0.35 0.77 -1.29 0.00 0.00 177.43 176.23 1hkx h SER 407 N -0.23 0.99 -1.71 5.81 4.64 -1.57 -3.42 113.55 118.06 1hkx h SER 407 Ca 0.18 -0.43 -0.62 0.00 -0.47 0.00 0.00 61.79 60.45 1hkx h SER 407 Cb 0.56 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1hkx h SER 407 CO -0.70 1.23 1.43 1.17 -0.87 0.00 0.00 176.83 179.09 1hkx n LYS 408 N -4.07 1.73 -2.04 4.77 4.81 0.11 -4.90 118.16 118.57 1hkx n LYS 408 Ca -0.02 0.50 -0.42 0.00 -0.87 0.00 0.00 58.31 57.51 1hkx n LYS 408 Cb 0.52 -2.93 -0.03 0.00 0.02 0.00 0.00 35.03 32.62 1hkx n LYS 408 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1hkx s PRO 409 N 6.06 4.28 -0.07 1.64 0.02 -1.26 -4.82 135.00 140.86 1hkx s PRO 409 Ca 1.03 2.26 -0.00 0.00 0.02 0.00 0.00 61.00 64.31 1hkx s PRO 409 Cb -0.54 -3.14 0.02 0.00 0.02 0.00 0.00 34.50 30.87 1hkx s PRO 409 CO 0.41 -0.43 -0.03 0.08 -0.33 0.00 0.00 177.00 176.71 1hkx s VAL 410 N 0.26 0.54 -0.10 3.83 1.01 -1.26 -4.25 120.40 120.42 1hkx s VAL 410 Ca 0.61 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.58 1hkx s VAL 410 Cb -0.41 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 1hkx s VAL 410 CO 0.40 0.26 -0.19 -2.28 0.00 0.00 0.00 175.10 173.29 1hkx s HIS 411 N 1.51 2.65 0.01 5.22 2.46 -0.77 -5.00 115.29 121.37 1hkx s HIS 411 Ca -0.02 -0.76 0.07 0.00 0.47 0.00 0.00 55.06 54.82 1hkx s HIS 411 Cb -0.13 -1.74 -0.03 0.00 -0.13 0.00 0.00 32.58 30.56 1hkx s HIS 411 CO -0.03 -0.25 -0.21 0.99 -2.47 0.00 0.00 174.74 172.77 1hkx s THR 412 N 0.16 2.55 -0.03 0.89 2.01 -1.26 -0.92 115.64 119.05 1hkx s THR 412 Ca -0.11 -1.10 0.03 0.00 0.31 0.00 0.00 61.69 60.83 1hkx s THR 412 Cb -0.16 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.35 1hkx s THR 412 CO 0.06 0.46 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.44 1hkx s THR 413 N -0.78 1.06 -0.31 -0.82 2.01 -0.09 -5.00 115.64 111.71 1hkx s THR 413 Ca 0.12 -0.51 -0.08 0.00 0.31 0.00 0.00 61.69 61.53 1hkx s THR 413 Cb -0.10 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.48 1hkx s THR 413 CO 0.02 0.32 0.12 -0.63 -0.69 0.00 0.00 174.62 173.76 1hkx s ILE 414 N 0.15 4.22 0.05 1.82 1.01 -1.26 -1.13 121.20 126.06 1hkx s ILE 414 Ca -0.04 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1hkx s ILE 414 Cb -0.10 -3.21 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1hkx s ILE 414 CO 0.01 0.02 0.02 -0.76 0.00 0.00 0.00 174.94 174.23 1hkx s LEU 415 N 1.53 3.56 -1.46 2.97 1.43 0.06 -4.70 118.68 122.07 1hkx s LEU 415 Ca 0.03 -0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1hkx s LEU 415 Cb -0.18 -2.18 0.00 0.00 0.03 0.00 0.00 46.19 43.87 1hkx s LEU 415 CO 0.04 0.22 0.27 -3.20 0.23 0.00 0.00 176.35 173.91 1hkx n ASN 416 N 0.90 0.14 -4.75 2.29 5.15 -1.26 -1.72 115.26 116.00 1hkx n ASN 416 Ca -0.12 -1.11 -0.38 0.00 -0.60 0.00 0.00 54.58 52.37 1hkx n ASN 416 Cb 0.52 -2.51 0.05 0.00 -0.53 0.00 0.00 39.78 37.31 1hkx n ASN 416 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1hkx s PRO 417 N -6.87 3.02 -0.09 1.20 0.02 -1.26 -4.69 135.00 126.34 1hkx s PRO 417 Ca 0.01 2.19 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 1hkx s PRO 417 Cb -0.01 -2.17 0.05 0.00 0.02 0.00 0.00 34.50 32.39 1hkx s PRO 417 CO 0.93 -1.27 0.15 -1.01 -0.33 0.00 0.00 177.00 175.47 1hkx s HIS 418 N -1.33 -0.14 -0.01 6.54 3.76 -0.57 -5.00 115.29 118.54 1hkx s HIS 418 Ca 0.74 0.50 0.01 0.00 -0.15 0.00 0.00 55.06 56.16 1hkx s HIS 418 Cb -0.40 -0.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.94 1hkx s HIS 418 CO 0.46 -0.29 -0.01 0.42 -0.85 0.00 0.00 174.74 174.46 1hkx s ILE 419 N 2.27 4.09 -0.18 0.60 1.09 -1.26 -1.40 121.20 126.42 1hkx s ILE 419 Ca 0.04 -0.57 0.01 0.00 -1.10 0.00 0.00 60.65 59.02 1hkx s ILE 419 Cb -0.12 -2.80 0.03 0.00 -1.06 0.00 0.00 42.46 38.51 1hkx s ILE 419 CO -0.06 0.42 -0.13 -1.00 -0.10 0.00 0.00 174.94 174.07 1hkx s HIS 420 N -1.04 2.39 -0.02 3.97 3.76 0.61 -4.98 115.29 119.98 1hkx s HIS 420 Ca 0.18 -1.46 -0.16 0.00 -0.15 0.00 0.00 55.06 53.47 1hkx s HIS 420 Cb -0.11 -1.67 -0.05 0.00 1.11 0.00 0.00 32.58 31.85 1hkx s HIS 420 CO 0.08 -0.72 0.45 -0.51 -0.85 0.00 0.00 174.74 173.19 1hkx s LEU 421 N 1.41 4.44 -0.35 0.89 1.43 -1.26 -1.14 118.68 124.09 1hkx s LEU 421 Ca 0.02 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 1hkx s LEU 421 Cb -0.14 -2.66 0.14 0.00 0.03 0.00 0.00 46.19 43.56 1hkx s LEU 421 CO -0.10 0.24 0.21 -0.04 0.23 0.00 0.00 176.35 176.89 1hkx s MET 422 N -0.66 0.57 0.00 1.70 -1.94 0.78 -5.00 119.30 114.75 1hkx s MET 422 Ca 0.25 -1.36 0.00 0.00 -1.71 0.00 0.00 55.69 52.87 1hkx s MET 422 Cb -0.17 -1.33 0.00 0.00 2.01 0.00 0.00 34.83 35.34 1hkx s MET 422 CO 0.13 -1.21 0.00 0.41 -0.01 0.00 0.00 175.02 174.34 1hkx n GLY 423 N 4.02 -1.46 0.02 -0.03 0.00 -1.26 -3.04 105.19 103.44 1hkx n GLY 423 Ca 0.12 -1.54 0.13 0.00 0.00 0.00 0.00 46.02 44.73 1hkx n GLY 423 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1hkx n ASP 424 N -1.49 0.39 -0.34 1.61 8.00 -1.26 -3.82 116.55 119.64 1hkx n ASP 424 Ca 0.00 0.12 0.03 0.00 0.71 0.00 0.00 54.79 55.66 1hkx n ASP 424 Cb 0.00 -0.10 0.07 0.00 -0.02 0.00 0.00 41.12 41.07 1hkx n ASP 424 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1hkx n GLU 425 N -1.65 1.73 -3.84 -1.24 -0.58 -1.26 -4.90 120.64 108.89 1hkx n GLU 425 Ca 0.06 -1.46 -0.20 0.00 -0.42 0.00 0.00 57.16 55.13 1hkx n GLU 425 Cb 0.36 -1.15 -0.17 0.00 -0.57 0.00 0.00 31.44 29.91 1hkx n GLU 425 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1hkx s SER 426 N -0.82 1.09 0.08 1.62 0.15 -1.17 0.13 113.70 114.78 1hkx s SER 426 Ca 0.12 -0.04 0.01 0.00 0.70 0.00 0.00 55.95 56.74 1hkx s SER 426 Cb 0.07 -0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 1hkx s SER 426 CO 0.09 -0.16 -0.06 0.00 1.20 0.00 0.00 173.24 174.31 1hkx s ALA 427 N 1.61 0.83 -0.04 5.45 0.00 -0.39 -0.15 121.76 129.06 1hkx s ALA 427 Ca -0.01 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.69 1hkx s ALA 427 Cb -0.13 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.19 1hkx s ALA 427 CO -0.03 -0.24 0.03 0.00 0.00 0.00 0.00 175.76 175.52 1hkx s ILE 429 N 1.72 1.67 -0.06 0.00 2.07 -0.52 -0.28 121.20 125.80 1hkx s ILE 429 Ca -0.00 -0.86 0.03 0.00 -1.41 0.00 0.00 60.65 58.41 1hkx s ILE 429 Cb -0.13 -1.42 0.00 0.00 0.13 0.00 0.00 42.46 41.05 1hkx s ILE 429 CO -0.03 0.47 -0.16 0.00 -1.91 0.00 0.00 174.94 173.32 1hkx s ALA 430 N -0.10 1.45 0.24 1.50 0.00 -0.50 -0.67 121.76 123.70 1hkx s ALA 430 Ca -0.02 -0.60 -0.18 0.00 0.00 0.00 0.00 51.96 51.17 1hkx s ALA 430 Cb -0.12 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.47 1hkx s ALA 430 CO 0.02 0.21 0.59 1.52 0.00 0.00 0.00 175.76 178.11 1hkx s TYR 431 N 0.31 -0.02 -0.16 0.00 -0.85 -0.25 -1.52 117.35 114.86 1hkx s TYR 431 Ca -0.09 -0.37 -0.13 0.00 -0.52 0.00 0.00 57.07 55.95 1hkx s TYR 431 Cb -0.14 0.47 -0.05 0.00 0.38 0.00 0.00 41.96 42.62 1hkx s TYR 431 CO 0.03 -1.07 0.27 0.42 -1.52 0.00 0.00 175.55 173.68 1hkx s ILE 432 N -3.93 5.32 -0.28 -3.49 -1.09 -0.70 -0.81 121.20 116.21 1hkx s ILE 432 Ca 0.14 0.49 -0.07 0.00 -2.23 0.00 0.00 60.65 58.98 1hkx s ILE 432 Cb -0.03 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 1hkx s ILE 432 CO 0.04 0.41 0.07 -0.60 -1.23 0.00 0.00 174.94 173.63 1hkx s ARG 433 N 0.34 3.21 -0.17 2.79 3.52 0.14 -0.76 118.95 128.02 1hkx s ARG 433 Ca 0.15 -0.77 -0.04 0.00 -0.13 0.00 0.00 55.73 54.94 1hkx s ARG 433 Cb -0.13 -3.34 -0.02 0.00 -1.56 0.00 0.00 34.95 29.90 1hkx s ARG 433 CO 0.03 -0.38 -0.04 0.42 -0.81 0.00 0.00 175.30 174.52 1hkx s ILE 434 N 1.52 3.79 -0.12 4.11 1.01 -0.28 -1.84 121.20 129.38 1hkx s ILE 434 Ca 0.03 -0.38 0.02 0.00 0.00 0.00 0.00 60.65 60.32 1hkx s ILE 434 Cb -0.17 -2.67 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 1hkx s ILE 434 CO 0.02 0.48 -0.19 -0.89 0.00 0.00 0.00 174.94 174.35 1hkx s THR 435 N 0.59 2.41 -0.26 2.92 2.01 -0.46 -0.91 115.64 121.93 1hkx s THR 435 Ca -0.03 -0.88 -0.06 0.00 0.31 0.00 0.00 61.69 61.03 1hkx s THR 435 Cb -0.14 -1.97 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 1hkx s THR 435 CO 0.03 0.54 0.05 -1.10 -0.69 0.00 0.00 174.62 173.44 1hkx s GLN 436 N 0.49 3.38 0.21 4.92 -0.21 -0.09 -1.52 119.66 126.84 1hkx s GLN 436 Ca -0.13 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 54.60 1hkx s GLN 436 Cb -0.17 -3.27 -0.04 0.00 1.00 0.00 0.00 33.01 30.53 1hkx s GLN 436 CO 0.05 -0.29 0.10 1.52 -2.12 0.00 0.00 175.29 174.55 1hkx s TYR 437 N 1.54 1.25 0.00 0.91 -0.85 -0.99 -1.84 117.35 117.37 1hkx s TYR 437 Ca 0.05 -1.26 0.00 0.00 -0.52 0.00 0.00 57.07 55.34 1hkx s TYR 437 Cb -0.16 -0.68 0.00 0.00 0.38 0.00 0.00 41.96 41.51 1hkx s TYR 437 CO 0.02 -0.48 0.00 1.28 -1.52 0.00 0.00 175.55 174.84 1hkx n LEU 438 N -0.31 0.00 0.00 -3.49 4.77 -1.26 -1.38 117.00 115.33 1hkx n LEU 438 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1hkx n LEU 438 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1hkx n LEU 438 CO 0.34 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.73 1hkx n ASP 439 N 0.00 0.00 -4.72 -1.43 -0.08 -1.06 -4.60 116.55 104.66 1hkx n ASP 439 Ca 0.00 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.93 1hkx n ASP 439 Cb 0.00 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.38 1hkx n ASP 439 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1hkx s ALA 440 N -1.00 3.60 0.00 -1.67 0.00 -1.26 -3.53 121.76 117.90 1hkx s ALA 440 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1hkx s ALA 440 Cb 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 21.11 1hkx s ALA 440 CO 0.00 0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.44 1hkx n GLY 441 N 3.19 0.77 2.67 0.00 0.00 -1.26 -3.76 105.19 106.79 1hkx n GLY 441 Ca -0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.68 1hkx n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hkx n GLY 442 N -2.00 -0.24 3.70 -0.02 0.00 -1.23 -4.97 105.19 100.43 1hkx n GLY 442 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1hkx n GLY 442 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hkx s ILE 443 N -3.00 4.45 -0.11 -0.61 1.01 -1.25 -4.57 121.20 117.12 1hkx s ILE 443 Ca 0.21 1.75 -0.30 0.00 0.00 0.00 0.00 60.65 62.31 1hkx s ILE 443 Cb -0.09 -4.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 1hkx s ILE 443 CO 0.26 0.05 1.03 -2.84 0.00 0.00 0.00 174.94 173.44 1hkx s PRO 444 N 1.73 4.40 0.12 2.79 0.02 -1.26 -2.56 135.00 140.24 1hkx s PRO 444 Ca 0.54 1.43 0.03 0.00 0.02 0.00 0.00 61.00 63.01 1hkx s PRO 444 Cb -0.23 -3.55 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 1hkx s PRO 444 CO 0.23 -0.35 -0.08 1.03 -0.33 0.00 0.00 177.00 177.51 1hkx s ARG 445 N 2.10 0.93 -0.04 5.54 0.52 -0.48 -5.01 118.95 122.51 1hkx s ARG 445 Ca 0.49 -1.39 0.05 0.00 -0.52 0.00 0.00 55.73 54.36 1hkx s ARG 445 Cb -0.19 -0.38 -0.01 0.00 0.52 0.00 0.00 34.95 34.90 1hkx s ARG 445 CO 0.18 0.02 -0.18 0.99 0.02 0.00 0.00 175.30 176.33 1hkx s THR 446 N -3.50 1.48 0.04 0.02 2.01 -1.26 -2.35 115.64 112.08 1hkx s THR 446 Ca 0.14 -0.75 0.09 0.00 0.31 0.00 0.00 61.69 61.47 1hkx s THR 446 Cb 0.04 -1.26 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 1hkx s THR 446 CO -0.02 0.42 -0.24 0.00 -0.69 0.00 0.00 174.62 174.08 1hkx s ALA 447 N -0.08 2.07 0.06 7.40 0.00 -0.58 -4.99 121.76 125.65 1hkx s ALA 447 Ca -0.01 -1.18 0.08 0.00 0.00 0.00 0.00 51.96 50.84 1hkx s ALA 447 Cb -0.11 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 1hkx s ALA 447 CO 0.02 0.48 -0.22 -1.14 0.00 0.00 0.00 175.76 174.90 1hkx s GLN 448 N -1.17 1.39 -0.15 0.00 0.74 -1.26 -1.35 119.66 117.85 1hkx s GLN 448 Ca 0.10 -1.03 -0.22 0.00 0.05 0.00 0.00 55.36 54.26 1hkx s GLN 448 Cb -0.10 -1.57 0.05 0.00 1.10 0.00 0.00 33.01 32.50 1hkx s GLN 448 CO 0.02 0.39 0.56 -1.54 -0.55 0.00 0.00 175.29 174.17 1hkx s SER 449 N -1.39 -0.56 -0.15 6.67 1.04 -0.77 -4.31 113.70 114.24 1hkx s SER 449 Ca 0.08 0.92 -0.16 0.00 0.48 0.00 0.00 55.95 57.27 1hkx s SER 449 Cb -0.09 0.93 -0.04 0.00 0.10 0.00 0.00 66.02 66.91 1hkx s SER 449 CO 0.03 -0.32 0.41 -1.61 0.98 0.00 0.00 173.24 172.72 1hkx s GLU 450 N -0.24 4.29 0.02 4.02 8.01 -0.60 0.23 118.70 134.43 1hkx s GLU 450 Ca -0.04 0.30 0.05 0.00 0.01 0.00 0.00 54.97 55.29 1hkx s GLU 450 Cb -0.03 -3.45 -0.02 0.00 -4.31 0.00 0.00 34.13 26.32 1hkx s GLU 450 CO 0.03 0.14 -0.16 -1.21 0.01 0.00 0.00 175.26 174.08 1hkx s GLU 451 N 0.72 1.12 -0.09 1.61 2.02 0.01 -0.78 118.70 123.30 1hkx s GLU 451 Ca 0.22 -0.72 0.03 0.00 0.02 0.00 0.00 54.97 54.52 1hkx s GLU 451 Cb -0.14 -1.13 0.01 0.00 0.10 0.00 0.00 34.13 32.96 1hkx s GLU 451 CO 0.08 0.29 -0.17 0.99 0.02 0.00 0.00 175.26 176.47 1hkx s THR 452 N -0.67 1.54 -0.10 3.63 2.01 -0.23 -1.09 115.64 120.73 1hkx s THR 452 Ca 0.04 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.37 1hkx s THR 452 Cb -0.07 -1.37 0.01 0.00 0.01 0.00 0.00 72.50 71.07 1hkx s THR 452 CO 0.01 0.45 -0.17 -0.13 -0.69 0.00 0.00 174.62 174.08 1hkx s ARG 453 N 0.67 2.35 -0.27 4.92 1.81 0.16 -1.11 118.95 127.47 1hkx s ARG 453 Ca -0.13 -0.62 -0.08 0.00 -1.72 0.00 0.00 55.73 53.18 1hkx s ARG 453 Cb -0.16 -1.90 -0.02 0.00 -0.45 0.00 0.00 34.95 32.43 1hkx s ARG 453 CO 0.04 0.03 0.09 0.08 -0.68 0.00 0.00 175.30 174.85 1hkx s VAL 454 N 0.71 4.27 -0.11 3.52 1.01 0.72 -1.44 120.40 129.07 1hkx s VAL 454 Ca -0.12 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 1hkx s VAL 454 Cb -0.16 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1hkx s VAL 454 CO 0.03 0.23 0.09 0.26 0.00 0.00 0.00 175.10 175.71 1hkx s TRP 455 N 1.59 3.45 -0.05 5.22 0.52 0.82 -0.64 118.94 129.85 1hkx s TRP 455 Ca 0.05 0.42 0.01 0.00 0.02 0.00 0.00 56.10 56.60 1hkx s TRP 455 Cb -0.16 -1.89 0.02 0.00 -1.15 0.00 0.00 33.47 30.29 1hkx s TRP 455 CO 0.04 0.65 -0.05 -1.58 0.02 0.00 0.00 176.95 176.02 1hkx s HIS 456 N -0.99 0.89 -0.31 -1.98 2.46 0.11 -1.26 115.29 114.21 1hkx s HIS 456 Ca 0.15 -0.28 -0.28 0.00 0.47 0.00 0.00 55.06 55.11 1hkx s HIS 456 Cb -0.12 -0.77 0.01 0.00 -0.13 0.00 0.00 32.58 31.58 1hkx s HIS 456 CO 0.04 -0.24 1.04 0.50 -2.47 0.00 0.00 174.74 173.61 1hkx s ARG 457 N 1.03 4.08 -0.13 2.88 6.06 0.12 -0.78 118.95 132.21 1hkx s ARG 457 Ca -0.09 1.06 0.00 0.00 -2.50 0.00 0.00 55.73 54.21 1hkx s ARG 457 Cb -0.14 -3.72 0.02 0.00 0.06 0.00 0.00 34.95 31.17 1hkx s ARG 457 CO -0.00 -0.85 -0.12 0.50 -2.50 0.00 0.00 175.30 172.33 1hkx s ARG 458 N 3.53 2.00 -1.53 5.12 3.52 -0.51 -4.83 118.95 126.25 1hkx s ARG 458 Ca 0.44 -0.45 -0.06 0.00 -0.13 0.00 0.00 55.73 55.53 1hkx s ARG 458 Cb -0.13 -1.86 0.05 0.00 -1.56 0.00 0.00 34.95 31.45 1hkx s ARG 458 CO 0.14 -0.21 0.47 -0.25 -0.81 0.00 0.00 175.30 174.64 1hkx n ASP 459 N 4.70 -1.05 0.00 -2.12 8.00 -1.26 -2.37 116.55 122.45 1hkx n ASP 459 Ca -0.16 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.28 1hkx n ASP 459 Cb 0.50 -2.69 0.00 0.00 -0.02 0.00 0.00 41.12 38.92 1hkx n ASP 459 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hkx n GLY 460 N -1.88 2.96 3.83 0.44 0.00 -1.26 -5.04 105.19 104.24 1hkx n GLY 460 Ca -0.19 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 1hkx n GLY 460 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hkx s LYS 461 N 0.00 3.13 0.19 1.61 -2.85 -1.00 -5.06 119.74 115.76 1hkx s LYS 461 Ca 0.00 -0.54 -0.30 0.00 -1.00 0.00 0.00 55.97 54.13 1hkx s LYS 461 Cb 0.00 -2.88 -0.08 0.00 -2.06 0.00 0.00 37.83 32.81 1hkx s LYS 461 CO 0.00 0.61 1.04 -1.58 0.10 0.00 0.00 175.35 175.52 1hkx s TRP 462 N -1.37 3.71 0.03 1.78 0.52 -1.26 -1.42 118.94 120.93 1hkx s TRP 462 Ca 0.29 1.72 0.04 0.00 0.02 0.00 0.00 56.10 58.16 1hkx s TRP 462 Cb -0.12 -3.17 -0.02 0.00 -1.15 0.00 0.00 33.47 29.01 1hkx s TRP 462 CO 0.21 -0.22 -0.11 -0.65 0.02 0.00 0.00 176.95 176.20 1hkx s GLN 463 N -0.60 0.75 0.00 4.98 -0.21 0.04 -4.78 119.66 119.83 1hkx s GLN 463 Ca 0.47 -0.62 -0.30 0.00 0.02 0.00 0.00 55.36 54.93 1hkx s GLN 463 Cb -0.28 -0.70 -0.03 0.00 1.00 0.00 0.00 33.01 33.00 1hkx s GLN 463 CO 0.34 0.17 0.99 0.42 -2.12 0.00 0.00 175.29 175.09 1hkx s ILE 464 N -0.78 4.83 -0.05 1.08 1.01 0.84 -0.71 121.20 127.42 1hkx s ILE 464 Ca -0.01 2.03 0.16 0.00 0.00 0.00 0.00 60.65 62.83 1hkx s ILE 464 Cb -0.07 -4.30 -0.24 0.00 0.01 0.00 0.00 42.46 37.86 1hkx s ILE 464 CO 0.01 0.15 0.30 0.55 0.00 0.00 0.00 174.94 175.95 1hkx n VAL 465 N 3.92 0.24 -3.59 2.92 3.14 0.19 -0.98 118.33 124.16 1hkx n VAL 465 Ca 0.06 -0.45 -0.11 0.00 -2.96 0.00 0.00 64.34 60.88 1hkx n VAL 465 Cb 0.51 -0.04 -0.06 0.00 -1.06 0.00 0.00 33.84 33.18 1hkx n VAL 465 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1hkx s HIS 466 N -2.98 -0.46 -0.01 1.45 5.65 -1.22 -1.95 115.29 115.76 1hkx s HIS 466 Ca -0.06 0.95 -0.11 0.00 0.25 0.00 0.00 55.06 56.08 1hkx s HIS 466 Cb 0.09 0.40 0.01 0.00 -1.18 0.00 0.00 32.58 31.91 1hkx s HIS 466 CO 0.68 -0.34 0.23 -0.59 -0.65 0.00 0.00 174.74 174.08 1hkx s PHE 467 N -0.57 -0.08 -0.09 3.88 -0.12 -0.74 -0.20 117.98 120.06 1hkx s PHE 467 Ca -0.01 0.09 -0.01 0.00 -0.05 0.00 0.00 56.93 56.95 1hkx s PHE 467 Cb -0.02 0.03 0.03 0.00 -0.63 0.00 0.00 43.02 42.43 1hkx s PHE 467 CO -0.00 -0.34 -0.02 -1.58 -0.05 0.00 0.00 175.22 173.23 1hkx s HIS 468 N -1.33 0.96 -0.11 3.49 2.46 -0.27 -1.49 115.29 119.00 1hkx s HIS 468 Ca -0.14 -0.40 0.01 0.00 0.47 0.00 0.00 55.06 55.01 1hkx s HIS 468 Cb -0.06 -0.96 -0.01 0.00 -0.13 0.00 0.00 32.58 31.42 1hkx s HIS 468 CO 0.03 -0.41 -0.16 0.50 -2.47 0.00 0.00 174.74 172.23 1hkx s ARG 469 N 1.88 3.18 0.31 2.88 3.52 0.61 -1.07 118.95 130.26 1hkx s ARG 469 Ca 0.05 -0.74 0.08 0.00 -0.13 0.00 0.00 55.73 54.99 1hkx s ARG 469 Cb -0.13 -2.51 -0.06 0.00 -1.56 0.00 0.00 34.95 30.70 1hkx s ARG 469 CO -0.06 0.26 -0.08 -1.12 -0.81 0.00 0.00 175.30 173.49 1hkx s SER 470 N 0.20 3.21 0.00 -2.12 0.01 0.04 -4.00 113.70 111.04 1hkx s SER 470 Ca -0.10 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 55.98 1hkx s SER 470 Cb -0.16 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.82 1hkx s SER 470 CO 0.06 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.05 1hkx n GLY 471 N -0.67 -2.62 0.11 3.44 0.00 -1.26 -1.56 105.19 102.62 1hkx n GLY 471 Ca -0.05 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1hkx n GLY 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hkx n ALA 472 N 0.15 0.00 -1.09 4.61 0.00 -1.26 -4.71 120.51 118.21 1hkx n ALA 472 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1hkx n ALA 472 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 1hkx n ALA 472 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1hkx n PRO 473 N -1.35 0.11 -1.68 0.00 -0.02 -1.26 -4.84 135.00 125.95 1hkx n PRO 473 Ca 0.00 0.09 -0.29 0.00 -2.02 0.00 0.00 63.50 61.28 1hkx n PRO 473 Cb 0.57 -2.02 0.10 0.00 -0.02 0.00 0.00 33.50 32.13 1hkx n PRO 473 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1hkx s SER 474 N -1.82 4.35 0.00 2.55 0.01 -1.26 -4.79 113.70 112.75 1hkx s SER 474 Ca 0.66 1.06 0.00 0.00 1.31 0.00 0.00 55.95 58.97 1hkx s SER 474 Cb -0.29 -1.70 0.00 0.00 0.21 0.00 0.00 66.02 64.23 1hkx s SER 474 CO 0.58 -2.03 0.00 0.52 0.41 0.00 0.00 173.24 172.72