#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hkx n GLU 341 N 0.00 0.00 0.18 -0.67 -0.58 -1.26 -4.57 120.64 113.74 1hkx n GLU 341 Ca 0.00 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 1hkx n GLU 341 Cb 0.00 -3.37 0.11 0.00 -0.57 0.00 0.00 31.44 27.61 1hkx n GLU 341 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1hkx h ASP 342 N 0.00 0.00 0.39 1.62 2.03 -2.05 -2.80 116.42 115.61 1hkx h ASP 342 Ca 0.00 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.23 1hkx h ASP 342 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 1hkx h ASP 342 CO 0.00 0.07 -0.31 0.71 -1.03 0.00 0.00 179.24 178.68 1hkx h THR 343 N 0.00 1.11 -0.32 1.15 1.35 -1.99 0.39 112.91 114.60 1hkx h THR 343 Ca -0.01 -1.10 -0.06 0.00 -0.55 0.00 0.00 66.41 64.69 1hkx h THR 343 Cb 1.06 1.61 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 1hkx h THR 343 CO 0.01 0.30 -0.02 0.50 -0.25 0.00 0.00 175.52 176.06 1hkx h LYS 344 N 0.00 0.58 0.00 4.72 1.63 -1.86 -1.35 116.57 120.29 1hkx h LYS 344 Ca -0.00 -0.20 -0.16 0.00 -0.85 0.00 0.00 60.65 59.44 1hkx h LYS 344 Cb 0.59 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.15 1hkx h LYS 344 CO 0.04 0.73 -0.76 -0.39 -3.45 0.00 0.00 179.45 175.62 1hkx h VAL 345 N 0.37 1.41 -0.55 2.00 -1.51 -1.31 -2.58 116.25 114.07 1hkx h VAL 345 Ca 0.09 -2.71 -0.09 0.00 -1.23 0.00 0.00 66.70 62.75 1hkx h VAL 345 Cb 0.48 2.52 -0.02 0.00 -2.13 0.00 0.00 31.29 32.14 1hkx h VAL 345 CO 0.02 0.74 -0.03 0.03 -1.23 0.00 0.00 177.57 177.10 1hkx h ARG 346 N 0.00 0.98 -0.41 5.19 3.08 -0.15 -0.77 114.38 122.31 1hkx h ARG 346 Ca -0.01 -0.33 -0.11 0.00 0.07 0.00 0.00 59.98 59.60 1hkx h ARG 346 Cb 1.46 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 1hkx h ARG 346 CO 0.10 1.00 -0.19 0.87 -1.07 0.00 0.00 179.97 180.68 1hkx h LYS 347 N 0.86 0.80 -0.06 0.04 1.57 -1.22 -1.75 116.57 116.81 1hkx h LYS 347 Ca 0.15 -0.31 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 1hkx h LYS 347 Cb 0.58 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1hkx h LYS 347 CO 0.03 0.93 -0.31 0.37 -0.57 0.00 0.00 179.45 179.90 1hkx h GLN 348 N 0.70 0.11 -0.05 3.15 5.75 -1.23 -0.01 115.11 123.54 1hkx h GLN 348 Ca 0.10 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1hkx h GLN 348 Cb 0.70 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.24 1hkx h GLN 348 CO 0.05 0.42 0.03 1.49 -2.65 0.00 0.00 178.83 178.17 1hkx h GLU 349 N 0.10 0.07 -0.74 1.69 4.57 -0.44 -0.20 114.58 119.63 1hkx h GLU 349 Ca 0.01 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 1hkx h GLU 349 Cb 0.61 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.15 1hkx h GLU 349 CO 0.04 0.08 0.21 0.82 -1.18 0.00 0.00 179.01 178.98 1hkx h ILE 350 N 0.04 1.26 -0.42 2.32 5.03 -0.70 -2.31 117.51 122.72 1hkx h ILE 350 Ca 0.02 -0.94 -0.04 0.00 -0.12 0.00 0.00 64.86 63.77 1hkx h ILE 350 Cb 0.03 0.47 -0.02 0.00 -3.03 0.00 0.00 36.82 34.27 1hkx h ILE 350 CO -0.00 0.37 0.08 0.40 -0.68 0.00 0.00 178.15 178.31 1hkx h ILE 351 N 1.10 1.20 -0.27 -0.67 2.04 -0.68 -1.84 117.51 118.40 1hkx h ILE 351 Ca 0.23 -0.73 -0.07 0.00 1.00 0.00 0.00 64.86 65.30 1hkx h ILE 351 Cb 0.34 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1hkx h ILE 351 CO -0.00 0.26 -0.09 0.50 0.00 0.00 0.00 178.15 178.82 1hkx h LYS 352 N 0.62 0.53 -0.19 2.37 3.64 -0.57 -1.40 116.57 121.57 1hkx h LYS 352 Ca 0.14 -0.21 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 1hkx h LYS 352 Cb 0.27 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1hkx h LYS 352 CO 0.00 0.76 -0.26 -0.39 -2.27 0.00 0.00 179.45 177.29 1hkx h VAL 353 N 0.28 1.26 -0.49 2.00 -1.51 -1.26 0.37 116.25 116.90 1hkx h VAL 353 Ca 0.07 -1.21 -0.08 0.00 -1.23 0.00 0.00 66.70 64.25 1hkx h VAL 353 Cb 0.57 1.40 -0.02 0.00 -2.13 0.00 0.00 31.29 31.12 1hkx h VAL 353 CO 0.03 0.37 0.01 0.74 -1.23 0.00 0.00 177.57 177.49 1hkx h THR 354 N 0.31 1.26 -0.61 7.19 2.02 -1.22 0.19 112.91 122.06 1hkx h THR 354 Ca 0.05 -1.06 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 1hkx h THR 354 Cb 0.63 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1hkx h THR 354 CO 0.05 0.37 0.23 -0.33 0.37 0.00 0.00 175.52 176.20 1hkx h GLU 355 N 0.72 0.92 -0.54 6.66 5.08 -0.84 -0.21 114.58 126.37 1hkx h GLU 355 Ca 0.14 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1hkx h GLU 355 Cb 0.51 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1hkx h GLU 355 CO 0.02 0.79 0.25 1.96 -1.00 0.00 0.00 179.01 181.04 1hkx h GLN 356 N 0.85 0.78 0.00 2.33 4.20 -0.59 -0.44 115.11 122.24 1hkx h GLN 356 Ca 0.20 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1hkx h GLN 356 Cb 0.23 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1hkx h GLN 356 CO -0.01 0.64 -0.02 1.25 -0.67 0.00 0.00 178.83 180.03 1hkx h LEU 357 N 0.72 -0.04 -1.21 1.46 5.85 -0.25 -1.03 115.31 120.80 1hkx h LEU 357 Ca 0.18 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.93 1hkx h LEU 357 Cb 0.13 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1hkx h LEU 357 CO -0.02 -0.02 0.54 0.40 -0.34 0.00 0.00 178.44 178.99 1hkx h ILE 358 N -0.03 1.17 -0.49 4.05 2.04 -0.79 -0.96 117.51 122.50 1hkx h ILE 358 Ca 0.01 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 1hkx h ILE 358 Cb 0.04 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 1hkx h ILE 358 CO -0.01 0.19 0.09 -0.33 0.00 0.00 0.00 178.15 178.09 1hkx h GLU 359 N 1.05 0.80 -0.23 2.37 5.08 -0.62 0.26 114.58 123.30 1hkx h GLU 359 Ca 0.31 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1hkx h GLU 359 Cb -0.04 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1hkx h GLU 359 CO -0.08 0.80 0.15 0.00 -1.00 0.00 0.00 179.01 178.87 1hkx h ALA 360 N 0.97 0.29 -0.01 3.43 0.00 -0.62 0.64 119.26 123.95 1hkx h ALA 360 Ca 0.15 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1hkx h ALA 360 Cb 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1hkx h ALA 360 CO 0.01 -0.23 -0.03 0.82 0.00 0.00 0.00 179.25 179.82 1hkx h ILE 361 N 0.30 0.92 -0.07 0.00 2.04 -0.94 -0.98 117.51 118.78 1hkx h ILE 361 Ca 0.08 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.96 1hkx h ILE 361 Cb -0.02 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1hkx h ILE 361 CO -0.02 0.00 0.05 -1.28 0.00 0.00 0.00 178.15 176.91 1hkx h SER 362 N -0.04 0.00 -0.59 1.72 0.87 -0.13 -1.69 113.55 113.68 1hkx h SER 362 Ca 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1hkx h SER 362 Cb 0.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1hkx h SER 362 CO -0.04 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.85 1hkx n ASN 363 N -4.37 3.54 -2.01 6.23 3.02 0.19 -4.94 115.26 116.92 1hkx n ASN 363 Ca -0.01 -1.99 -0.20 0.00 -0.03 0.00 0.00 54.58 52.34 1hkx n ASN 363 Cb 0.16 -0.39 -0.04 0.00 -0.61 0.00 0.00 39.78 38.89 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 1.55 0.57 3.48 7.41 0.00 -0.64 -4.90 105.19 112.66 1hkx n GLY 364 Ca 0.22 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.38 6.94 0.46 1.61 3.68 -0.44 -4.86 116.67 121.70 1hkx s ASP 365 Ca 0.00 -2.70 0.12 0.00 2.13 0.00 0.00 52.55 52.10 1hkx s ASP 365 Cb 0.00 -2.43 1.06 0.00 -1.45 0.00 0.00 42.92 40.10 1hkx s ASP 365 CO 0.00 -0.89 2.09 0.15 0.13 0.00 0.00 175.17 176.65 1hkx h PHE 366 N 7.59 0.20 0.24 -5.34 3.57 -1.91 -2.50 116.94 118.79 1hkx h PHE 366 Ca 0.31 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 1hkx h PHE 366 Cb 0.90 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.58 1hkx h PHE 366 CO 1.17 0.16 -0.11 0.93 -2.23 0.00 0.00 178.31 178.22 1hkx h GLU 367 N 0.21 -0.31 -0.83 1.11 3.07 -1.98 -0.61 114.58 115.25 1hkx h GLU 367 Ca 0.06 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.93 1hkx h GLU 367 Cb 0.04 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 27.97 1hkx h GLU 367 CO -0.01 -0.14 0.49 0.77 -1.40 0.00 0.00 179.01 178.72 1hkx h SER 368 N -0.40 1.01 0.42 1.42 0.02 -1.94 -1.96 113.55 112.12 1hkx h SER 368 Ca -0.03 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1hkx h SER 368 Cb 0.30 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1hkx h SER 368 CO 0.05 0.78 -0.31 0.22 -1.14 0.00 0.00 176.83 176.43 1hkx h TYR 369 N 1.15 -0.83 -0.68 3.45 3.20 -1.16 -2.17 116.97 119.94 1hkx h TYR 369 Ca 0.30 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.22 1hkx h TYR 369 Cb -0.03 0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 1hkx h TYR 369 CO 0.01 -0.46 0.45 1.79 -1.64 0.00 0.00 178.16 178.30 1hkx h THR 370 N -0.72 1.04 -0.20 1.81 1.35 -0.92 0.10 112.91 115.37 1hkx h THR 370 Ca -0.04 -0.25 0.01 0.00 -0.55 0.00 0.00 66.41 65.58 1hkx h THR 370 Cb 0.62 0.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.28 1hkx h THR 370 CO 0.00 0.13 0.14 0.50 -0.25 0.00 0.00 175.52 176.04 1hkx h LYS 371 N 0.73 0.22 -0.01 4.72 3.11 -0.90 -1.96 116.57 122.48 1hkx h LYS 371 Ca 0.28 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 58.11 1hkx h LYS 371 Cb 0.20 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.38 1hkx h LYS 371 CO -0.09 0.14 -0.32 -1.33 -2.81 0.00 0.00 179.45 175.05 1hkx n MET 372 N -4.51 0.90 -4.62 1.90 2.81 0.31 -4.91 117.12 109.00 1hkx n MET 372 Ca 0.00 -0.59 -0.33 0.00 -1.81 0.00 0.00 57.70 54.97 1hkx n MET 372 Cb 0.11 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 31.02 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 -1.01 7.09 0.40 0.00 3.68 -0.30 -4.81 116.67 121.72 1hkx s ASP 374 Ca 0.14 2.30 0.14 0.00 2.13 0.00 0.00 52.55 57.26 1hkx s ASP 374 Cb -0.11 -2.62 0.98 0.00 -1.45 0.00 0.00 42.92 39.72 1hkx s ASP 374 CO 0.03 -0.27 1.87 -0.65 0.13 0.00 0.00 175.17 176.28 1hkx h PRO 375 N 3.51 0.50 -1.00 4.34 0.11 -1.91 -0.09 132.00 137.45 1hkx h PRO 375 Ca -0.47 -0.03 -0.35 0.00 0.11 0.00 0.00 66.00 65.26 1hkx h PRO 375 Cb 1.22 -0.11 -0.21 0.00 0.11 0.00 0.00 31.00 32.01 1hkx h PRO 375 CO 0.66 0.33 0.44 0.41 -0.21 0.00 0.00 178.00 179.63 1hkx n GLY 376 N -1.48 3.68 3.77 -0.55 0.00 -1.26 -4.13 105.19 105.22 1hkx n GLY 376 Ca 0.18 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.60 2.69 -4.38 1.61 0.00 -0.05 -4.71 117.12 111.68 1hkx n MET 377 Ca 0.40 0.95 -0.30 0.00 0.00 0.00 0.00 57.70 58.75 1hkx n MET 377 Cb 1.28 -2.69 -0.11 0.00 0.00 0.00 0.00 33.22 31.70 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 -0.84 3.00 -0.04 1.12 2.01 -0.61 -0.82 115.64 119.46 1hkx s THR 378 Ca 0.56 -1.32 -0.19 0.00 0.31 0.00 0.00 61.69 61.05 1hkx s THR 378 Cb -0.48 -2.35 0.04 0.00 0.01 0.00 0.00 72.50 69.71 1hkx s THR 378 CO 0.60 0.18 0.42 0.00 -0.69 0.00 0.00 174.62 175.13 1hkx s ALA 379 N -1.10 -1.07 -0.12 7.40 0.00 0.06 -1.35 121.76 125.58 1hkx s ALA 379 Ca 0.18 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.85 1hkx s ALA 379 Cb -0.11 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1hkx s ALA 379 CO 0.10 -0.28 -0.15 -0.06 0.00 0.00 0.00 175.76 175.37 1hkx s PHE 380 N -1.08 2.04 0.01 0.00 2.99 -0.21 -1.05 117.98 120.68 1hkx s PHE 380 Ca -0.11 -1.01 -0.28 0.00 0.00 0.00 0.00 56.93 55.52 1hkx s PHE 380 Cb -0.04 -1.48 0.07 0.00 0.00 0.00 0.00 43.02 41.58 1hkx s PHE 380 CO 0.05 -0.53 0.68 -1.83 -0.00 0.00 0.00 175.22 173.59 1hkx s GLU 381 N 1.13 1.10 0.33 0.44 -1.05 -1.26 0.29 118.70 119.67 1hkx s GLU 381 Ca -0.03 -0.01 0.11 0.00 -0.15 0.00 0.00 54.97 54.89 1hkx s GLU 381 Cb -0.14 0.51 0.95 0.00 -0.44 0.00 0.00 34.13 35.01 1hkx s GLU 381 CO -0.04 -0.40 1.71 -1.35 0.95 0.00 0.00 175.26 176.13 1hkx h PRO 382 N 2.61 0.49 0.00 -4.83 0.11 -1.89 0.14 132.00 128.63 1hkx h PRO 382 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1hkx h PRO 382 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1hkx h PRO 382 CO 0.38 0.33 0.00 0.93 -0.21 0.00 0.00 178.00 179.43 1hkx h GLU 383 N 0.51 0.00 -0.33 1.05 3.07 -1.94 -2.32 114.58 114.62 1hkx h GLU 383 Ca 0.67 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.53 1hkx h GLU 383 Cb 1.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 1hkx h GLU 383 CO -0.51 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.10 1hkx n ALA 384 N -1.96 2.46 -4.05 3.43 0.00 0.49 -4.97 120.51 115.91 1hkx n ALA 384 Ca -0.01 -0.75 -0.29 0.00 0.00 0.00 0.00 53.44 52.39 1hkx n ALA 384 Cb 0.16 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 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 0.81 -2.03 0.00 0.00 4.77 -0.87 -1.28 117.00 118.40 1hkx n LEU 385 Ca 0.17 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 1hkx n LEU 385 Cb 0.42 -2.17 0.00 0.00 -2.33 0.00 0.00 43.42 39.34 1hkx n LEU 385 CO 0.13 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1hkx n GLY 386 N -1.80 0.85 3.85 -0.72 0.00 -1.26 -5.04 105.19 101.08 1hkx n GLY 386 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.84 6.03 -0.31 1.61 0.01 -0.40 -5.07 114.94 113.97 1hkx s ASN 387 Ca 0.00 0.21 -0.23 0.00 -0.71 0.00 0.00 52.86 52.13 1hkx s ASN 387 Cb 0.00 -1.80 0.00 0.00 0.41 0.00 0.00 41.25 39.86 1hkx s ASN 387 CO 0.00 0.23 0.77 -0.22 -1.51 0.00 0.00 177.10 176.37 1hkx s LEU 388 N -2.10 4.10 0.03 0.60 0.20 -1.26 -4.62 118.68 115.63 1hkx s LEU 388 Ca 0.28 0.61 -0.04 0.00 0.69 0.00 0.00 54.13 55.67 1hkx s LEU 388 Cb -0.12 -3.04 -0.05 0.00 -0.43 0.00 0.00 46.19 42.54 1hkx s LEU 388 CO 0.20 -0.61 0.26 -0.69 -0.29 0.00 0.00 176.35 175.22 1hkx s VAL 389 N 2.94 5.32 0.14 1.68 1.01 -0.21 -4.91 120.40 126.37 1hkx s VAL 389 Ca 0.32 -0.00 0.10 0.00 0.00 0.00 0.00 61.98 62.39 1hkx s VAL 389 Cb -0.14 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1hkx s VAL 389 CO 0.13 0.27 -0.19 -1.61 0.00 0.00 0.00 175.10 173.70 1hkx s GLU 390 N -2.04 1.73 0.12 2.72 2.02 -1.26 -0.76 118.70 121.22 1hkx s GLU 390 Ca 0.31 -1.27 0.00 0.00 0.02 0.00 0.00 54.97 54.03 1hkx s GLU 390 Cb -0.13 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.05 1hkx s GLU 390 CO 0.20 0.46 0.00 0.41 0.02 0.00 0.00 175.26 176.34 1hkx n GLY 391 N 0.61 -1.63 0.01 -1.39 0.00 0.00 -4.57 105.19 98.22 1hkx n GLY 391 Ca -0.15 -1.41 0.11 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.28 0.75 -0.28 0.99 4.32 -1.26 -4.42 117.00 114.82 1hkx n LEU 392 Ca -0.00 -0.27 0.08 0.00 -0.02 0.00 0.00 56.01 55.80 1hkx n LEU 392 Cb 0.21 -0.07 0.23 0.00 -1.62 0.00 0.00 43.42 42.17 1hkx n LEU 392 CO 0.00 0.17 1.03 -0.78 -1.22 0.00 0.00 177.39 176.59 1hkx h ASP 393 N 0.00 0.30 0.33 -1.43 3.58 -1.94 -1.01 116.42 116.25 1hkx h ASP 393 Ca 0.00 0.12 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1hkx h ASP 393 Cb 0.57 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 1hkx h ASP 393 CO 0.00 0.07 -0.30 0.15 -2.88 0.00 0.00 179.24 176.28 1hkx h PHE 394 N 0.44 0.00 0.00 0.28 3.04 -1.81 -2.77 116.94 116.12 1hkx h PHE 394 Ca 0.47 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.34 1hkx h PHE 394 Cb 0.77 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.27 1hkx h PHE 394 CO -0.16 0.30 -0.42 0.45 -2.02 0.00 0.00 178.31 176.47 1hkx h HIS 395 N 0.00 0.00 -2.45 0.41 -0.00 -1.48 -3.42 115.15 108.21 1hkx h HIS 395 Ca -0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 60.37 59.83 1hkx h HIS 395 Cb 0.55 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.92 1hkx h HIS 395 CO 0.00 0.35 1.24 0.50 -0.00 0.00 0.00 177.93 180.02 1hkx s ARG 396 N -3.04 3.04 0.00 2.45 3.52 -0.92 -2.25 118.95 121.75 1hkx s ARG 396 Ca 0.04 0.74 0.00 0.00 -0.13 0.00 0.00 55.73 56.39 1hkx s ARG 396 Cb 0.07 -4.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.21 1hkx s ARG 396 CO 0.73 -2.23 0.00 0.34 -0.81 0.00 0.00 175.30 173.33 1hkx n PHE 397 N 11.00 0.00 1.53 5.12 7.35 -1.26 -4.85 117.46 136.35 1hkx n PHE 397 Ca 0.18 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 57.02 1hkx n PHE 397 Cb 0.50 0.00 0.76 0.00 0.35 0.00 0.00 39.48 41.08 1hkx n PHE 397 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1hkx n TYR 398 N 0.00 0.00 -0.12 -5.13 4.02 -0.95 -1.22 117.16 113.75 1hkx n TYR 398 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.67 1hkx n TYR 398 Cb 0.00 -0.20 -0.10 0.00 -0.02 0.00 0.00 39.34 39.02 1hkx n TYR 398 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1hkx n PHE 399 N -1.13 0.00 -0.00 -0.72 3.72 -1.25 -3.63 117.46 114.45 1hkx n PHE 399 Ca 0.16 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.52 1hkx n PHE 399 Cb 0.23 -0.93 0.17 0.00 -0.94 0.00 0.00 39.48 38.01 1hkx n PHE 399 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1hkx h GLU 400 N -0.43 0.54 -0.28 -1.08 5.08 -1.86 -3.06 114.58 113.49 1hkx h GLU 400 Ca -0.59 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 57.56 1hkx h GLU 400 Cb 1.71 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.94 1hkx h GLU 400 CO -0.23 0.75 0.00 0.09 -1.00 0.00 0.00 179.01 178.62 1hkx n ASN 401 N -4.11 2.72 -0.03 1.42 4.13 -0.35 -4.41 115.26 114.63 1hkx n ASN 401 Ca -0.00 -1.93 0.01 0.00 1.68 0.00 0.00 54.58 54.34 1hkx n ASN 401 Cb 0.42 -0.19 -0.01 0.00 -1.54 0.00 0.00 39.78 38.46 1hkx n ASN 401 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1hkx n LEU 402 N 0.44 0.39 0.00 3.41 0.00 -1.24 -4.54 117.00 115.47 1hkx n LEU 402 Ca 0.10 -0.62 0.03 0.00 0.00 0.00 0.00 56.01 55.51 1hkx n LEU 402 Cb 0.39 0.00 0.12 0.00 0.00 0.00 0.00 43.42 43.94 1hkx n LEU 402 CO 0.07 0.09 0.52 1.87 0.00 0.00 0.00 177.39 179.94 1hkx n TRP 403 N -0.76 0.00 0.56 1.96 -0.00 -1.15 -2.40 117.44 115.64 1hkx n TRP 403 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.51 1hkx n TRP 403 Cb 0.05 -0.33 0.00 0.00 -0.00 0.00 0.00 31.31 31.03 1hkx n TRP 403 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1hkx n SER 404 N -1.33 0.08 0.00 5.87 2.88 -1.26 -3.80 113.62 116.06 1hkx n SER 404 Ca 0.02 -0.64 0.00 0.00 -1.33 0.00 0.00 58.87 56.92 1hkx n SER 404 Cb 0.04 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1hkx n SER 404 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1hkx n ARG 405 N -0.28 0.00 -0.83 -1.46 1.74 -1.01 -2.90 116.66 111.92 1hkx n ARG 405 Ca 0.00 0.13 -0.09 0.00 -0.77 0.00 0.00 57.85 57.12 1hkx n ARG 405 Cb 0.02 -1.52 -0.07 0.00 -1.02 0.00 0.00 32.46 29.87 1hkx n ARG 405 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1hkx n ASN 406 N -1.07 5.51 -0.42 0.55 4.13 -1.25 -2.15 115.26 120.55 1hkx n ASN 406 Ca 0.00 -2.57 0.00 0.00 1.68 0.00 0.00 54.58 53.69 1hkx n ASN 406 Cb 0.02 -1.25 0.00 0.00 -1.54 0.00 0.00 39.78 37.01 1hkx n ASN 406 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1hkx n SER 407 N 1.75 0.00 -3.15 6.41 3.41 -1.14 -5.10 113.62 115.80 1hkx n SER 407 Ca 0.25 -0.90 0.06 0.00 -0.26 0.00 0.00 58.87 58.01 1hkx n SER 407 Cb 0.68 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.62 1hkx n SER 407 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1hkx s LYS 408 N 0.00 0.12 0.28 4.33 -2.85 -0.92 -4.78 119.74 115.92 1hkx s LYS 408 Ca 0.00 0.18 -0.29 0.00 -1.00 0.00 0.00 55.97 54.85 1hkx s LYS 408 Cb 0.00 0.09 -0.10 0.00 -2.06 0.00 0.00 37.83 35.77 1hkx s LYS 408 CO 0.00 -0.16 1.29 -2.14 0.10 0.00 0.00 175.35 174.44 1hkx s PRO 409 N 2.97 4.40 -0.06 1.78 0.02 -1.26 -4.90 135.00 137.94 1hkx s PRO 409 Ca 0.06 2.12 0.03 0.00 0.02 0.00 0.00 61.00 63.24 1hkx s PRO 409 Cb -0.07 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1hkx s PRO 409 CO -0.14 -0.16 -0.16 0.54 -0.33 0.00 0.00 177.00 176.75 1hkx s VAL 410 N -0.73 1.38 -0.07 3.83 0.11 -1.26 -4.20 120.40 119.45 1hkx s VAL 410 Ca 0.51 -0.65 0.05 0.00 -2.93 0.00 0.00 61.98 58.96 1hkx s VAL 410 Cb -0.38 -1.22 -0.00 0.00 -1.53 0.00 0.00 36.38 33.25 1hkx s VAL 410 CO 0.47 0.41 -0.22 -2.28 -3.33 0.00 0.00 175.10 170.14 1hkx s HIS 411 N 0.38 2.24 0.01 1.54 2.46 -0.70 -5.00 115.29 116.21 1hkx s HIS 411 Ca -0.11 -0.77 0.07 0.00 0.47 0.00 0.00 55.06 54.71 1hkx s HIS 411 Cb -0.14 -1.50 -0.03 0.00 -0.13 0.00 0.00 32.58 30.78 1hkx s HIS 411 CO 0.04 -0.28 -0.19 0.99 -2.47 0.00 0.00 174.74 172.82 1hkx s THR 412 N 0.13 2.66 -0.04 0.89 2.01 -1.26 -0.84 115.64 119.20 1hkx s THR 412 Ca -0.10 -1.08 0.03 0.00 0.31 0.00 0.00 61.69 60.85 1hkx s THR 412 Cb -0.15 -2.06 0.00 0.00 0.01 0.00 0.00 72.50 70.30 1hkx s THR 412 CO 0.05 0.44 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.41 1hkx s THR 413 N -0.81 1.07 -0.31 -0.82 2.01 -0.22 -5.00 115.64 111.56 1hkx s THR 413 Ca 0.13 -0.50 -0.09 0.00 0.31 0.00 0.00 61.69 61.54 1hkx s THR 413 Cb -0.10 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1hkx s THR 413 CO 0.03 0.32 0.13 -0.63 -0.69 0.00 0.00 174.62 173.77 1hkx s ILE 414 N 0.24 4.34 0.06 1.82 1.01 -1.26 -1.27 121.20 126.14 1hkx s ILE 414 Ca -0.06 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.08 1hkx s ILE 414 Cb -0.11 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 39.09 1hkx s ILE 414 CO 0.02 0.06 0.01 -0.76 0.00 0.00 0.00 174.94 174.27 1hkx s LEU 415 N 1.57 3.52 -1.48 2.97 1.43 -0.09 -4.72 118.68 121.88 1hkx s LEU 415 Ca 0.04 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.03 1hkx s LEU 415 Cb -0.17 -2.17 0.01 0.00 0.03 0.00 0.00 46.19 43.88 1hkx s LEU 415 CO 0.05 0.21 0.25 -3.20 0.23 0.00 0.00 176.35 173.89 1hkx n ASN 416 N 0.82 0.14 -4.74 2.29 5.15 -1.26 -1.84 115.26 115.82 1hkx n ASN 416 Ca -0.12 -1.13 -0.38 0.00 -0.60 0.00 0.00 54.58 52.36 1hkx n ASN 416 Cb 0.52 -2.40 0.05 0.00 -0.53 0.00 0.00 39.78 37.42 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 -6.93 2.89 -0.12 1.20 0.02 -1.26 -4.69 135.00 126.12 1hkx s PRO 417 Ca 0.03 2.20 -0.04 0.00 0.02 0.00 0.00 61.00 63.21 1hkx s PRO 417 Cb -0.02 -2.10 0.06 0.00 0.02 0.00 0.00 34.50 32.46 1hkx s PRO 417 CO 0.94 -1.37 0.19 -1.01 -0.33 0.00 0.00 177.00 175.42 1hkx s HIS 418 N -1.32 -0.22 -0.01 6.54 3.76 -0.61 -5.00 115.29 118.43 1hkx s HIS 418 Ca 0.76 0.54 0.01 0.00 -0.15 0.00 0.00 55.06 56.21 1hkx s HIS 418 Cb -0.40 -0.27 -0.04 0.00 1.11 0.00 0.00 32.58 32.98 1hkx s HIS 418 CO 0.45 -0.37 0.03 0.42 -0.85 0.00 0.00 174.74 174.42 1hkx s ILE 419 N 2.31 4.38 -0.15 0.60 1.09 -1.26 -1.56 121.20 126.62 1hkx s ILE 419 Ca 0.04 -0.51 0.00 0.00 -1.10 0.00 0.00 60.65 59.08 1hkx s ILE 419 Cb -0.13 -2.97 0.03 0.00 -1.06 0.00 0.00 42.46 38.33 1hkx s ILE 419 CO -0.08 0.38 -0.13 -1.00 -0.10 0.00 0.00 174.94 174.01 1hkx s HIS 420 N -1.11 2.15 -0.07 3.97 3.76 0.56 -4.98 115.29 119.57 1hkx s HIS 420 Ca 0.20 -1.24 -0.14 0.00 -0.15 0.00 0.00 55.06 53.73 1hkx s HIS 420 Cb -0.12 -1.58 -0.05 0.00 1.11 0.00 0.00 32.58 31.95 1hkx s HIS 420 CO 0.11 -0.67 0.37 -0.51 -0.85 0.00 0.00 174.74 173.19 1hkx s LEU 421 N 1.49 4.38 -0.37 0.89 1.43 -1.26 -1.04 118.68 124.20 1hkx s LEU 421 Ca 0.04 0.79 0.01 0.00 -1.03 0.00 0.00 54.13 53.94 1hkx s LEU 421 Cb -0.13 -2.51 0.14 0.00 0.03 0.00 0.00 46.19 43.72 1hkx s LEU 421 CO -0.10 0.23 0.23 -0.04 0.23 0.00 0.00 176.35 176.89 1hkx s MET 422 N -0.44 0.68 0.00 1.70 -1.94 0.70 -5.00 119.30 114.99 1hkx s MET 422 Ca 0.22 -1.49 0.00 0.00 -1.71 0.00 0.00 55.69 52.71 1hkx s MET 422 Cb -0.15 -1.45 0.00 0.00 2.01 0.00 0.00 34.83 35.24 1hkx s MET 422 CO 0.10 -1.22 0.00 0.41 -0.01 0.00 0.00 175.02 174.30 1hkx n GLY 423 N 3.87 -1.24 0.02 -0.03 0.00 -1.26 -3.08 105.19 103.46 1hkx n GLY 423 Ca 0.13 -1.57 0.13 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.16 0.41 -0.25 1.61 8.00 -1.26 -3.92 116.55 119.98 1hkx n ASP 424 Ca 0.00 -0.12 0.02 0.00 0.71 0.00 0.00 54.79 55.40 1hkx n ASP 424 Cb 0.00 0.06 0.05 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.43 1.87 -3.82 -1.24 -0.58 -1.26 -4.85 120.64 109.32 1hkx n GLU 425 Ca 0.07 -1.42 -0.19 0.00 -0.42 0.00 0.00 57.16 55.19 1hkx n GLU 425 Cb 0.33 -1.11 -0.17 0.00 -0.57 0.00 0.00 31.44 29.93 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 -0.80 0.89 0.09 1.62 0.15 -1.18 0.13 113.70 114.60 1hkx s SER 426 Ca 0.08 -0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.73 1hkx s SER 426 Cb 0.05 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.06 1hkx s SER 426 CO 0.06 -0.16 -0.05 0.00 1.20 0.00 0.00 173.24 174.30 1hkx s ALA 427 N 1.54 0.89 -0.04 5.45 0.00 -0.31 -0.22 121.76 129.08 1hkx s ALA 427 Ca -0.02 -1.34 -0.01 0.00 0.00 0.00 0.00 51.96 50.58 1hkx s ALA 427 Cb -0.13 0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.28 1hkx s ALA 427 CO -0.03 -0.29 0.07 0.00 0.00 0.00 0.00 175.76 175.51 1hkx s ILE 429 N 1.69 1.54 -0.06 0.00 2.07 -0.77 -0.32 121.20 125.35 1hkx s ILE 429 Ca -0.02 -0.79 0.03 0.00 -1.41 0.00 0.00 60.65 58.46 1hkx s ILE 429 Cb -0.12 -1.31 0.01 0.00 0.13 0.00 0.00 42.46 41.16 1hkx s ILE 429 CO -0.04 0.44 -0.15 0.00 -1.91 0.00 0.00 174.94 173.29 1hkx s ALA 430 N -0.07 1.43 0.21 1.50 0.00 -0.60 -0.98 121.76 123.24 1hkx s ALA 430 Ca -0.02 -0.54 -0.18 0.00 0.00 0.00 0.00 51.96 51.21 1hkx s ALA 430 Cb -0.11 -0.58 0.03 0.00 0.00 0.00 0.00 23.12 22.45 1hkx s ALA 430 CO 0.02 0.17 0.55 1.52 0.00 0.00 0.00 175.76 178.02 1hkx s TYR 431 N 0.48 -0.13 -0.13 0.00 -0.85 -0.72 -1.57 117.35 114.43 1hkx s TYR 431 Ca -0.13 -0.22 -0.16 0.00 -0.52 0.00 0.00 57.07 56.05 1hkx s TYR 431 Cb -0.15 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.58 1hkx s TYR 431 CO 0.04 -0.96 0.39 0.42 -1.52 0.00 0.00 175.55 173.93 1hkx s ILE 432 N -3.88 5.23 -0.29 -3.49 -1.09 -0.77 -1.33 121.20 115.58 1hkx s ILE 432 Ca 0.10 0.77 -0.07 0.00 -2.23 0.00 0.00 60.65 59.22 1hkx s ILE 432 Cb -0.02 -3.73 0.01 0.00 -1.58 0.00 0.00 42.46 37.14 1hkx s ILE 432 CO -0.02 0.38 0.07 -0.60 -1.23 0.00 0.00 174.94 173.54 1hkx s ARG 433 N 0.40 3.15 -0.17 2.79 3.52 0.13 -0.92 118.95 127.86 1hkx s ARG 433 Ca 0.22 -0.81 -0.04 0.00 -0.13 0.00 0.00 55.73 54.96 1hkx s ARG 433 Cb -0.14 -3.34 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1hkx s ARG 433 CO 0.08 -0.41 -0.02 0.42 -0.81 0.00 0.00 175.30 174.56 1hkx s ILE 434 N 1.51 4.03 -0.12 4.11 1.01 -0.40 -1.37 121.20 129.97 1hkx s ILE 434 Ca 0.03 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.40 1hkx s ILE 434 Cb -0.17 -2.78 0.00 0.00 0.01 0.00 0.00 42.46 39.52 1hkx s ILE 434 CO 0.02 0.48 -0.22 -0.89 0.00 0.00 0.00 174.94 174.33 1hkx s THR 435 N 0.45 2.14 -0.25 2.92 2.01 0.74 -1.06 115.64 122.59 1hkx s THR 435 Ca -0.02 -0.97 -0.06 0.00 0.31 0.00 0.00 61.69 60.94 1hkx s THR 435 Cb -0.14 -1.84 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 1hkx s THR 435 CO 0.02 0.55 0.04 -1.10 -0.69 0.00 0.00 174.62 173.45 1hkx s GLN 436 N 0.57 3.41 0.17 4.92 -0.21 -0.02 -0.35 119.66 128.16 1hkx s GLN 436 Ca -0.13 -0.63 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1hkx s GLN 436 Cb -0.17 -3.25 -0.04 0.00 1.00 0.00 0.00 33.01 30.55 1hkx s GLN 436 CO 0.04 -0.26 0.06 1.52 -2.12 0.00 0.00 175.29 174.52 1hkx s TYR 437 N 1.54 1.09 0.00 0.91 -0.85 -0.43 -1.73 117.35 117.89 1hkx s TYR 437 Ca 0.05 -1.20 0.00 0.00 -0.52 0.00 0.00 57.07 55.41 1hkx s TYR 437 Cb -0.15 -0.61 0.00 0.00 0.38 0.00 0.00 41.96 41.58 1hkx s TYR 437 CO 0.01 -0.43 0.00 1.28 -1.52 0.00 0.00 175.55 174.89 1hkx n LEU 438 N -0.21 0.00 0.00 -3.49 4.77 -1.26 -0.02 117.00 116.79 1hkx n LEU 438 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1hkx n LEU 438 Cb 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1hkx n LEU 438 CO 0.33 0.00 0.00 0.47 -1.33 0.00 0.00 177.39 176.86 1hkx n ASP 439 N 0.00 -0.07 -3.65 -1.43 9.92 -1.26 -4.61 116.55 115.45 1hkx n ASP 439 Ca 0.00 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 53.99 1hkx n ASP 439 Cb 0.00 0.00 0.03 0.00 -0.64 0.00 0.00 41.12 40.51 1hkx n ASP 439 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hkx n ALA 440 N 3.41 -1.21 0.00 2.24 0.00 -1.26 -0.90 120.51 122.80 1hkx n ALA 440 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1hkx n ALA 440 Cb 0.00 -4.33 0.00 0.00 0.00 0.00 0.00 19.45 15.12 1hkx n ALA 440 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hkx n GLY 441 N -1.64 0.99 0.00 0.00 0.00 -1.26 -4.51 105.19 98.77 1hkx n GLY 441 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 1.26 3.86 -0.02 0.00 -0.08 -5.12 105.19 105.10 1hkx n GLY 442 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.98 5.15 0.07 -0.61 1.09 -1.13 -4.38 121.20 119.40 1hkx s ILE 443 Ca 0.00 0.53 -0.34 0.00 -1.10 0.00 0.00 60.65 59.74 1hkx s ILE 443 Cb 0.00 -3.63 -0.13 0.00 -1.06 0.00 0.00 42.46 37.64 1hkx s ILE 443 CO 0.00 0.45 1.71 -2.65 -0.10 0.00 0.00 174.94 174.34 1hkx n PRO 444 N 1.40 2.20 -4.19 2.79 -0.02 -1.26 -4.25 135.00 131.67 1hkx n PRO 444 Ca -0.12 0.80 -0.12 0.00 -2.02 0.00 0.00 63.50 62.04 1hkx n PRO 444 Cb 0.53 -2.60 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 1hkx n PRO 444 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1hkx s ARG 445 N 2.20 0.90 -0.05 -0.52 0.52 0.97 -5.00 118.95 117.97 1hkx s ARG 445 Ca 0.84 -1.36 0.04 0.00 -0.52 0.00 0.00 55.73 54.74 1hkx s ARG 445 Cb -0.67 -0.35 -0.00 0.00 0.52 0.00 0.00 34.95 34.44 1hkx s ARG 445 CO 0.43 0.02 -0.18 0.99 0.02 0.00 0.00 175.30 176.58 1hkx s THR 446 N -3.45 1.51 0.04 0.02 2.01 -1.26 -1.31 115.64 113.21 1hkx s THR 446 Ca 0.13 -0.75 0.09 0.00 0.31 0.00 0.00 61.69 61.47 1hkx s THR 446 Cb 0.04 -1.30 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 1hkx s THR 446 CO -0.03 0.43 -0.26 0.00 -0.69 0.00 0.00 174.62 174.08 1hkx s ALA 447 N 0.10 2.19 0.05 7.40 0.00 0.53 -4.95 121.76 127.08 1hkx s ALA 447 Ca -0.06 -1.24 0.08 0.00 0.00 0.00 0.00 51.96 50.74 1hkx s ALA 447 Cb -0.13 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1hkx s ALA 447 CO 0.03 0.52 -0.22 -1.14 0.00 0.00 0.00 175.76 174.95 1hkx s GLN 448 N -1.22 1.43 -0.14 0.00 0.74 -1.26 -0.19 119.66 119.02 1hkx s GLN 448 Ca 0.11 -1.02 -0.20 0.00 0.05 0.00 0.00 55.36 54.30 1hkx s GLN 448 Cb -0.10 -1.59 0.05 0.00 1.10 0.00 0.00 33.01 32.47 1hkx s GLN 448 CO 0.02 0.40 0.52 -1.54 -0.55 0.00 0.00 175.29 174.14 1hkx s SER 449 N -1.32 -0.51 -0.14 6.67 1.04 -0.47 -2.18 113.70 116.79 1hkx s SER 449 Ca 0.08 0.84 -0.16 0.00 0.48 0.00 0.00 55.95 57.19 1hkx s SER 449 Cb -0.09 0.86 -0.04 0.00 0.10 0.00 0.00 66.02 66.84 1hkx s SER 449 CO 0.02 -0.31 0.39 -1.61 0.98 0.00 0.00 173.24 172.72 1hkx s GLU 450 N -0.26 4.30 0.01 4.02 8.01 0.92 0.18 118.70 135.88 1hkx s GLU 450 Ca -0.04 0.28 0.05 0.00 0.01 0.00 0.00 54.97 55.27 1hkx s GLU 450 Cb -0.03 -3.44 -0.02 0.00 -4.31 0.00 0.00 34.13 26.33 1hkx s GLU 450 CO 0.03 0.18 -0.16 -1.21 0.01 0.00 0.00 175.26 174.11 1hkx s GLU 451 N 0.60 1.17 -0.08 1.61 2.02 -0.44 -1.24 118.70 122.34 1hkx s GLU 451 Ca 0.21 -0.68 0.03 0.00 0.02 0.00 0.00 54.97 54.56 1hkx s GLU 451 Cb -0.14 -1.17 0.01 0.00 0.10 0.00 0.00 34.13 32.92 1hkx s GLU 451 CO 0.07 0.31 -0.18 0.99 0.02 0.00 0.00 175.26 176.47 1hkx s THR 452 N -0.59 1.60 -0.09 3.63 2.01 -0.27 -1.76 115.64 120.17 1hkx s THR 452 Ca 0.05 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.31 1hkx s THR 452 Cb -0.07 -1.41 0.01 0.00 0.01 0.00 0.00 72.50 71.05 1hkx s THR 452 CO 0.00 0.46 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.10 1hkx s ARG 453 N 0.44 2.24 -0.27 4.92 1.81 -0.15 -1.30 118.95 126.63 1hkx s ARG 453 Ca -0.15 -0.58 -0.08 0.00 -1.72 0.00 0.00 55.73 53.20 1hkx s ARG 453 Cb -0.16 -1.83 -0.02 0.00 -0.45 0.00 0.00 34.95 32.49 1hkx s ARG 453 CO 0.06 0.01 0.09 0.08 -0.68 0.00 0.00 175.30 174.86 1hkx s VAL 454 N 0.76 4.28 -0.11 3.52 1.01 0.70 -1.84 120.40 128.71 1hkx s VAL 454 Ca -0.11 -0.34 -0.06 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 0.02 0.23 0.10 0.26 0.00 0.00 0.00 175.10 175.71 1hkx s TRP 455 N 1.59 3.47 -0.05 5.22 0.52 0.71 -0.81 118.94 129.59 1hkx s TRP 455 Ca 0.05 0.43 0.01 0.00 0.02 0.00 0.00 56.10 56.61 1hkx s TRP 455 Cb -0.16 -1.91 0.02 0.00 -1.15 0.00 0.00 33.47 30.28 1hkx s TRP 455 CO 0.04 0.65 -0.05 -1.58 0.02 0.00 0.00 176.95 176.03 1hkx s HIS 456 N -0.94 0.84 -0.31 -1.98 2.46 0.18 -1.16 115.29 114.38 1hkx s HIS 456 Ca 0.14 -0.26 -0.29 0.00 0.47 0.00 0.00 55.06 55.13 1hkx s HIS 456 Cb -0.12 -0.75 0.02 0.00 -0.13 0.00 0.00 32.58 31.60 1hkx s HIS 456 CO 0.03 -0.23 1.05 0.50 -2.47 0.00 0.00 174.74 173.62 1hkx s ARG 457 N 1.08 4.08 -0.12 2.88 6.06 0.34 -0.87 118.95 132.39 1hkx s ARG 457 Ca -0.08 1.07 0.00 0.00 -2.50 0.00 0.00 55.73 54.22 1hkx s ARG 457 Cb -0.14 -3.73 0.02 0.00 0.06 0.00 0.00 34.95 31.16 1hkx s ARG 457 CO -0.01 -0.86 -0.11 0.50 -2.50 0.00 0.00 175.30 172.32 1hkx s ARG 458 N 3.57 1.92 -1.54 5.12 3.52 -0.58 -4.83 118.95 126.13 1hkx s ARG 458 Ca 0.44 -0.42 -0.07 0.00 -0.13 0.00 0.00 55.73 55.56 1hkx s ARG 458 Cb -0.13 -1.80 0.06 0.00 -1.56 0.00 0.00 34.95 31.52 1hkx s ARG 458 CO 0.14 -0.20 0.46 -0.25 -0.81 0.00 0.00 175.30 174.64 1hkx n ASP 459 N 4.68 -1.04 0.00 -2.12 8.00 -1.26 -2.45 116.55 122.35 1hkx n ASP 459 Ca -0.16 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.28 1hkx n ASP 459 Cb 0.50 -2.65 0.00 0.00 -0.02 0.00 0.00 41.12 38.95 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 3.85 0.44 0.00 -1.26 -5.04 105.19 104.26 1hkx n GLY 460 Ca -0.18 -0.79 -0.32 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 3.22 0.25 1.61 -2.85 -1.03 -5.06 119.74 115.89 1hkx s LYS 461 Ca 0.00 -0.47 -0.30 0.00 -1.00 0.00 0.00 55.97 54.20 1hkx s LYS 461 Cb 0.00 -2.94 -0.09 0.00 -2.06 0.00 0.00 37.83 32.74 1hkx s LYS 461 CO 0.00 0.63 1.07 -1.58 0.10 0.00 0.00 175.35 175.57 1hkx s TRP 462 N -1.35 3.66 0.02 1.78 0.52 -1.26 -1.52 118.94 120.79 1hkx s TRP 462 Ca 0.28 1.73 0.03 0.00 0.02 0.00 0.00 56.10 58.16 1hkx s TRP 462 Cb -0.12 -3.22 -0.01 0.00 -1.15 0.00 0.00 33.47 28.96 1hkx s TRP 462 CO 0.20 -0.36 -0.08 -0.65 0.02 0.00 0.00 176.95 176.08 1hkx s GLN 463 N -1.21 0.61 -0.03 4.98 -0.21 -0.05 -4.80 119.66 118.96 1hkx s GLN 463 Ca 0.45 -0.47 -0.30 0.00 0.02 0.00 0.00 55.36 55.05 1hkx s GLN 463 Cb -0.30 -0.54 -0.03 0.00 1.00 0.00 0.00 33.01 33.14 1hkx s GLN 463 CO 0.38 0.14 1.01 0.42 -2.12 0.00 0.00 175.29 175.12 1hkx s ILE 464 N -0.61 4.76 -0.07 1.08 1.01 0.44 -0.65 121.20 127.16 1hkx s ILE 464 Ca -0.01 1.99 0.17 0.00 0.00 0.00 0.00 60.65 62.80 1hkx s ILE 464 Cb -0.06 -4.28 -0.25 0.00 0.01 0.00 0.00 42.46 37.89 1hkx s ILE 464 CO 0.00 0.11 0.27 0.55 0.00 0.00 0.00 174.94 175.87 1hkx n VAL 465 N 4.10 0.40 -3.58 2.92 3.14 0.00 -1.15 118.33 124.17 1hkx n VAL 465 Ca 0.07 -0.51 -0.13 0.00 -2.96 0.00 0.00 64.34 60.82 1hkx n VAL 465 Cb 0.50 -0.14 -0.06 0.00 -1.06 0.00 0.00 33.84 33.08 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 -2.92 -0.53 -0.01 1.45 5.65 -1.22 -1.57 115.29 116.13 1hkx s HIS 466 Ca -0.07 1.04 -0.13 0.00 0.25 0.00 0.00 55.06 56.15 1hkx s HIS 466 Cb 0.09 0.40 0.02 0.00 -1.18 0.00 0.00 32.58 31.91 1hkx s HIS 466 CO 0.71 -0.41 0.27 -0.59 -0.65 0.00 0.00 174.74 174.07 1hkx s PHE 467 N -0.71 -0.13 -0.08 3.88 -0.12 -0.45 -0.22 117.98 120.15 1hkx s PHE 467 Ca -0.03 0.19 -0.01 0.00 -0.05 0.00 0.00 56.93 57.03 1hkx s PHE 467 Cb -0.02 0.06 0.03 0.00 -0.63 0.00 0.00 43.02 42.46 1hkx s PHE 467 CO 0.03 -0.35 -0.02 -1.58 -0.05 0.00 0.00 175.22 173.24 1hkx s HIS 468 N -1.27 0.84 -0.08 3.49 2.46 -0.42 -1.05 115.29 119.27 1hkx s HIS 468 Ca -0.13 -0.29 0.04 0.00 0.47 0.00 0.00 55.06 55.16 1hkx s HIS 468 Cb -0.06 -0.87 -0.01 0.00 -0.13 0.00 0.00 32.58 31.51 1hkx s HIS 468 CO 0.03 -0.35 -0.22 0.50 -2.47 0.00 0.00 174.74 172.24 1hkx s ARG 469 N 1.80 2.79 -0.04 2.88 3.52 0.14 -1.11 118.95 128.93 1hkx s ARG 469 Ca 0.03 -0.84 0.01 0.00 -0.13 0.00 0.00 55.73 54.80 1hkx s ARG 469 Cb -0.13 -2.30 0.02 0.00 -1.56 0.00 0.00 34.95 30.99 1hkx s ARG 469 CO -0.05 0.34 -0.03 -1.54 -0.81 0.00 0.00 175.30 173.21 1hkx s SER 470 N -0.04 0.92 0.00 -2.12 1.04 -0.37 -3.91 113.70 109.22 1hkx s SER 470 Ca -0.06 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.27 1hkx s SER 470 Cb -0.15 -0.39 0.00 0.00 0.10 0.00 0.00 66.02 65.58 1hkx s SER 470 CO 0.05 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.79 1hkx n GLY 471 N 4.23 0.55 0.80 7.32 0.00 -1.26 -0.06 105.19 116.77 1hkx n GLY 471 Ca -0.23 -1.03 -0.02 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.00 2.42 -0.18 4.61 0.00 -0.93 -4.85 120.51 120.58 1hkx n ALA 472 Ca 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 1hkx n ALA 472 Cb 0.00 0.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.60 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 -3.51 0.00 -3.30 0.00 -0.02 -1.26 -4.90 135.00 122.01 1hkx n PRO 473 Ca -0.03 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.15 1hkx n PRO 473 Cb 0.11 -0.15 -0.06 0.00 -0.02 0.00 0.00 33.50 33.38 1hkx n PRO 473 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1hkx n SER 474 N 0.23 4.42 0.00 2.55 3.41 -1.26 -4.94 113.62 118.03 1hkx n SER 474 Ca 0.02 -3.46 0.00 0.00 -0.26 0.00 0.00 58.87 55.18 1hkx n SER 474 Cb 0.02 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 1hkx n SER 474 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21