#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 0.02 0.13 -1.24 -0.58 -1.26 -4.59 120.64 113.13 1hkx n GLU 341 Ca 0.00 -0.17 0.11 0.00 -0.42 0.00 0.00 57.16 56.68 1hkx n GLU 341 Cb 0.00 -1.32 0.04 0.00 -0.57 0.00 0.00 31.44 29.60 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 9.68 0.00 0.36 1.62 2.03 -2.05 -3.12 116.42 124.95 1hkx h ASP 342 Ca 0.01 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.25 1hkx h ASP 342 Cb 1.02 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.52 1hkx h ASP 342 CO 1.12 0.05 -0.29 0.71 -1.03 0.00 0.00 179.24 179.80 1hkx h THR 343 N 0.00 1.11 -0.31 1.15 1.35 -1.99 0.43 112.91 114.66 1hkx h THR 343 Ca -0.01 -1.03 -0.05 0.00 -0.55 0.00 0.00 66.41 64.77 1hkx h THR 343 Cb 1.05 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 69.03 1hkx h THR 343 CO 0.01 0.28 0.01 0.50 -0.25 0.00 0.00 175.52 176.07 1hkx h LYS 344 N 0.00 0.54 0.00 4.72 1.63 -1.91 -1.38 116.57 120.17 1hkx h LYS 344 Ca -0.00 -0.17 -0.17 0.00 -0.85 0.00 0.00 60.65 59.46 1hkx h LYS 344 Cb 0.55 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.10 1hkx h LYS 344 CO 0.04 0.67 -0.80 -0.39 -3.45 0.00 0.00 179.45 175.51 1hkx h VAL 345 N 0.33 1.51 -0.63 2.00 -1.51 -1.42 -2.61 116.25 113.93 1hkx h VAL 345 Ca 0.09 -2.82 -0.09 0.00 -1.23 0.00 0.00 66.70 62.65 1hkx h VAL 345 Cb 0.42 2.55 -0.02 0.00 -2.13 0.00 0.00 31.29 32.11 1hkx h VAL 345 CO 0.01 0.79 0.02 0.03 -1.23 0.00 0.00 177.57 177.20 1hkx h ARG 346 N 0.00 1.09 -0.38 5.19 3.08 -0.05 -0.32 114.38 122.99 1hkx h ARG 346 Ca -0.01 -0.33 -0.13 0.00 0.07 0.00 0.00 59.98 59.58 1hkx h ARG 346 Cb 1.48 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.41 1hkx h ARG 346 CO 0.10 1.05 -0.28 0.87 -1.07 0.00 0.00 179.97 180.64 1hkx h LYS 347 N 1.00 0.81 -0.09 0.04 1.57 -1.23 -1.86 116.57 116.80 1hkx h LYS 347 Ca 0.18 -0.36 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 1hkx h LYS 347 Cb 0.54 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1hkx h LYS 347 CO 0.03 0.99 -0.27 0.37 -0.57 0.00 0.00 179.45 179.99 1hkx h GLN 348 N 0.69 0.16 -0.03 3.15 5.75 -1.19 0.19 115.11 123.83 1hkx h GLN 348 Ca 0.08 -0.05 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 0.43 0.01 1.49 -2.65 0.00 0.00 178.83 178.18 1hkx h GLU 349 N 0.15 0.02 -0.69 1.69 4.57 -0.42 -0.40 114.58 119.50 1hkx h GLU 349 Ca 0.02 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 1hkx h GLU 349 Cb 0.57 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.12 1hkx h GLU 349 CO 0.04 0.02 0.18 0.82 -1.18 0.00 0.00 179.01 178.89 1hkx h ILE 350 N 0.03 1.26 -0.30 2.32 5.03 -0.72 -2.39 117.51 122.74 1hkx h ILE 350 Ca 0.01 -0.93 -0.05 0.00 -0.12 0.00 0.00 64.86 63.77 1hkx h ILE 350 Cb 0.00 0.53 -0.02 0.00 -3.03 0.00 0.00 36.82 34.30 1hkx h ILE 350 CO -0.01 0.36 -0.04 0.40 -0.68 0.00 0.00 178.15 178.18 1hkx h ILE 351 N 1.04 1.20 -0.22 -0.67 2.04 -0.63 -2.09 117.51 118.19 1hkx h ILE 351 Ca 0.22 -0.82 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 1hkx h ILE 351 Cb 0.34 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1hkx h ILE 351 CO -0.00 0.27 -0.13 0.50 0.00 0.00 0.00 178.15 178.79 1hkx h LYS 352 N 0.45 0.47 -0.24 2.37 3.64 -0.60 -1.37 116.57 121.29 1hkx h LYS 352 Ca 0.09 -0.22 -0.07 0.00 -1.27 0.00 0.00 60.65 59.18 1hkx h LYS 352 Cb 0.36 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1hkx h LYS 352 CO 0.02 0.77 -0.17 -0.39 -2.27 0.00 0.00 179.45 177.40 1hkx h VAL 353 N 0.17 1.23 -0.47 2.00 -1.51 -1.33 0.71 116.25 117.05 1hkx h VAL 353 Ca 0.04 -1.06 -0.08 0.00 -1.23 0.00 0.00 66.70 64.37 1hkx h VAL 353 Cb 0.65 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 31.03 1hkx h VAL 353 CO 0.04 0.34 -0.00 0.74 -1.23 0.00 0.00 177.57 177.46 1hkx h THR 354 N 0.39 1.26 -0.63 7.19 2.02 -1.29 0.27 112.91 122.13 1hkx h THR 354 Ca 0.07 -1.06 -0.04 0.00 0.77 0.00 0.00 66.41 66.14 1hkx h THR 354 Cb 0.53 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 1hkx h THR 354 CO 0.03 0.37 0.23 -0.33 0.37 0.00 0.00 175.52 176.19 1hkx h GLU 355 N 0.69 0.96 -0.41 6.66 5.08 -0.81 0.01 114.58 126.77 1hkx h GLU 355 Ca 0.13 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1hkx h GLU 355 Cb 0.51 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1hkx h GLU 355 CO 0.02 0.82 0.20 1.96 -1.00 0.00 0.00 179.01 181.02 1hkx h GLN 356 N 0.89 0.59 -0.14 2.33 4.20 -0.48 -0.80 115.11 121.69 1hkx h GLN 356 Ca 0.21 -0.09 0.02 0.00 0.06 0.00 0.00 58.65 58.86 1hkx h GLN 356 Cb 0.24 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1hkx h GLN 356 CO -0.01 0.51 -0.01 1.25 -0.67 0.00 0.00 178.83 179.90 1hkx h LEU 357 N 0.52 -0.07 -1.30 1.46 5.85 -0.05 -0.92 115.31 120.80 1hkx h LEU 357 Ca 0.14 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1hkx h LEU 357 Cb 0.12 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1hkx h LEU 357 CO -0.02 -0.01 0.41 0.40 -0.34 0.00 0.00 178.44 178.88 1hkx h ILE 358 N 0.04 1.18 -0.40 4.05 2.04 -0.75 -1.06 117.51 122.61 1hkx h ILE 358 Ca 0.07 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 1hkx h ILE 358 Cb 0.08 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1hkx h ILE 358 CO -0.12 0.18 0.03 -0.33 0.00 0.00 0.00 178.15 177.92 1hkx h GLU 359 N 0.90 0.69 -0.27 2.37 5.08 -0.51 0.31 114.58 123.14 1hkx h GLU 359 Ca 0.24 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1hkx h GLU 359 Cb -0.06 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1hkx h GLU 359 CO -0.05 0.76 0.17 0.00 -1.00 0.00 0.00 179.01 178.89 1hkx h ALA 360 N 0.90 0.34 -0.07 3.43 0.00 -0.72 0.11 119.26 123.26 1hkx h ALA 360 Ca 0.12 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1hkx h ALA 360 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1hkx h ALA 360 CO 0.01 -0.20 0.00 0.82 0.00 0.00 0.00 179.25 179.89 1hkx h ILE 361 N 0.35 0.96 0.00 0.00 2.04 -0.95 -1.08 117.51 118.83 1hkx h ILE 361 Ca 0.10 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 1hkx h ILE 361 Cb -0.03 0.93 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1hkx h ILE 361 CO -0.03 0.00 -0.01 -1.28 0.00 0.00 0.00 178.15 176.83 1hkx h SER 362 N 0.03 0.00 -0.52 1.72 0.87 0.04 -1.80 113.55 113.89 1hkx h SER 362 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 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 -0.05 0.01 0.00 0.59 -0.53 0.00 0.00 176.83 176.85 1hkx n ASN 363 N -4.40 3.33 -1.89 6.23 3.02 0.35 -4.74 115.26 117.17 1hkx n ASN 363 Ca -0.03 -1.97 -0.19 0.00 -0.03 0.00 0.00 54.58 52.35 1hkx n ASN 363 Cb 0.10 -0.34 -0.04 0.00 -0.61 0.00 0.00 39.78 38.88 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 1.50 0.59 3.47 7.41 0.00 -0.68 -4.88 105.19 112.60 1hkx n GLY 364 Ca 0.21 -0.08 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 6.94 0.45 1.61 3.68 -0.48 -4.86 116.67 121.60 1hkx s ASP 365 Ca 0.00 -2.71 0.12 0.00 2.13 0.00 0.00 52.55 52.08 1hkx s ASP 365 Cb 0.00 -2.41 1.02 0.00 -1.45 0.00 0.00 42.92 40.07 1hkx s ASP 365 CO 0.00 -0.86 2.06 0.15 0.13 0.00 0.00 175.17 176.66 1hkx h PHE 366 N 7.63 0.23 0.15 -5.34 3.57 -1.91 -2.44 116.94 118.82 1hkx h PHE 366 Ca 0.28 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 1hkx h PHE 366 Cb 0.91 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.58 1hkx h PHE 366 CO 1.14 0.20 -0.07 0.93 -2.23 0.00 0.00 178.31 178.27 1hkx h GLU 367 N 0.24 -0.19 -0.81 1.11 3.07 -1.97 -0.53 114.58 115.48 1hkx h GLU 367 Ca 0.06 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1hkx h GLU 367 Cb 0.07 0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 27.99 1hkx h GLU 367 CO -0.01 -0.04 0.45 0.77 -1.40 0.00 0.00 179.01 178.78 1hkx h SER 368 N -0.30 1.00 0.49 1.42 0.02 -1.94 -1.93 113.55 112.32 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 0.24 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1hkx h SER 368 CO 0.03 0.80 -0.40 0.22 -1.14 0.00 0.00 176.83 176.35 1hkx h TYR 369 N 1.13 -1.07 -0.73 3.45 3.20 -1.12 -2.19 116.97 119.64 1hkx h TYR 369 Ca 0.29 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.24 1hkx h TYR 369 Cb 0.01 0.40 -0.05 0.00 1.54 0.00 0.00 36.73 38.64 1hkx h TYR 369 CO 0.01 -0.57 0.48 1.79 -1.64 0.00 0.00 178.16 178.23 1hkx h THR 370 N -0.88 0.99 -0.31 1.81 1.35 -0.92 0.17 112.91 115.11 1hkx h THR 370 Ca -0.05 -0.24 0.03 0.00 -0.55 0.00 0.00 66.41 65.59 1hkx h THR 370 Cb 0.75 0.22 -0.02 0.00 -1.73 0.00 0.00 68.15 67.37 1hkx h THR 370 CO -0.01 0.13 0.21 0.50 -0.25 0.00 0.00 175.52 176.10 1hkx h LYS 371 N 0.71 0.32 -0.01 4.72 3.11 -0.92 -1.90 116.57 122.59 1hkx h LYS 371 Ca 0.32 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 58.14 1hkx h LYS 371 Cb 0.34 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.50 1hkx h LYS 371 CO -0.11 0.21 -0.32 -1.33 -2.81 0.00 0.00 179.45 175.09 1hkx n MET 372 N -4.49 0.81 -4.56 1.90 2.81 0.55 -4.91 117.12 109.22 1hkx n MET 372 Ca 0.03 -0.51 -0.33 0.00 -1.81 0.00 0.00 57.70 55.07 1hkx n MET 372 Cb 0.15 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 31.06 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 -1.12 7.12 0.40 0.00 3.68 -0.11 -4.82 116.67 121.82 1hkx s ASP 374 Ca 0.15 2.32 0.15 0.00 2.13 0.00 0.00 52.55 57.30 1hkx s ASP 374 Cb -0.11 -2.63 1.01 0.00 -1.45 0.00 0.00 42.92 39.74 1hkx s ASP 374 CO 0.04 -0.26 1.87 -0.65 0.13 0.00 0.00 175.17 176.31 1hkx h PRO 375 N 3.59 0.47 -0.99 4.34 0.11 -1.91 0.07 132.00 137.68 1hkx h PRO 375 Ca -0.47 -0.03 -0.33 0.00 0.11 0.00 0.00 66.00 65.28 1hkx h PRO 375 Cb 1.22 -0.11 -0.20 0.00 0.11 0.00 0.00 31.00 32.02 1hkx h PRO 375 CO 0.66 0.31 0.42 0.41 -0.21 0.00 0.00 178.00 179.59 1hkx n GLY 376 N -1.49 3.63 3.75 -0.55 0.00 -1.26 -4.13 105.19 105.13 1hkx n GLY 376 Ca 0.18 -0.73 -0.42 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 -0.56 2.54 -4.31 1.61 0.00 0.01 -4.69 117.12 111.71 1hkx n MET 377 Ca 0.39 0.89 -0.30 0.00 0.00 0.00 0.00 57.70 58.69 1hkx n MET 377 Cb 1.28 -2.59 -0.11 0.00 0.00 0.00 0.00 33.22 31.79 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 -0.95 3.02 -0.07 1.12 2.01 -0.84 -0.84 115.64 119.07 1hkx s THR 378 Ca 0.55 -1.39 -0.17 0.00 0.31 0.00 0.00 61.69 60.99 1hkx s THR 378 Cb -0.50 -2.38 0.04 0.00 0.01 0.00 0.00 72.50 69.66 1hkx s THR 378 CO 0.61 0.13 0.41 0.00 -0.69 0.00 0.00 174.62 175.08 1hkx s ALA 379 N -1.14 -1.03 -0.13 7.40 0.00 0.15 -1.68 121.76 125.33 1hkx s ALA 379 Ca 0.19 0.80 0.02 0.00 0.00 0.00 0.00 51.96 52.97 1hkx s ALA 379 Cb -0.11 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.80 1hkx s ALA 379 CO 0.11 -0.25 -0.19 -0.06 0.00 0.00 0.00 175.76 175.37 1hkx s PHE 380 N -0.72 2.34 -0.03 0.00 2.99 -0.63 -1.16 117.98 120.77 1hkx s PHE 380 Ca -0.08 -1.15 -0.29 0.00 0.00 0.00 0.00 56.93 55.40 1hkx s PHE 380 Cb -0.04 -1.63 0.08 0.00 0.00 0.00 0.00 43.02 41.43 1hkx s PHE 380 CO 0.04 -0.55 0.74 -1.83 -0.00 0.00 0.00 175.22 173.62 1hkx s GLU 381 N 0.90 0.99 0.32 0.44 -1.05 -1.26 -0.08 118.70 118.97 1hkx s GLU 381 Ca -0.07 0.07 0.11 0.00 -0.15 0.00 0.00 54.97 54.93 1hkx s GLU 381 Cb -0.15 0.46 0.95 0.00 -0.44 0.00 0.00 34.13 34.95 1hkx s GLU 381 CO -0.02 -0.34 1.70 -1.35 0.95 0.00 0.00 175.26 176.19 1hkx h PRO 382 N 2.67 0.43 0.00 -4.83 0.11 -1.89 0.15 132.00 128.64 1hkx h PRO 382 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.82 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 0.37 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 -0.44 1.05 3.07 -1.90 -2.35 114.58 114.45 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 1.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.30 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 -1.92 2.43 -4.13 3.43 0.00 0.52 -4.97 120.51 115.87 1hkx n ALA 384 Ca -0.00 -0.83 -0.29 0.00 0.00 0.00 0.00 53.44 52.32 1hkx n ALA 384 Cb 0.18 -0.97 -0.05 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 0.92 -1.67 0.00 0.00 4.77 -0.88 -1.08 117.00 119.05 1hkx n LEU 385 Ca 0.17 -1.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 1hkx n LEU 385 Cb 0.42 -1.96 0.00 0.00 -2.33 0.00 0.00 43.42 39.56 1hkx n LEU 385 CO 0.12 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1hkx n GLY 386 N -2.14 0.93 3.87 -0.72 0.00 -1.26 -5.03 105.19 100.84 1hkx n GLY 386 Ca -0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.98 6.15 -0.28 1.61 0.01 -0.24 -5.07 114.94 114.14 1hkx s ASN 387 Ca 0.00 0.28 -0.25 0.00 -0.71 0.00 0.00 52.86 52.18 1hkx s ASN 387 Cb 0.00 -1.88 -0.00 0.00 0.41 0.00 0.00 41.25 39.78 1hkx s ASN 387 CO 0.00 0.26 0.84 -0.22 -1.51 0.00 0.00 177.10 176.47 1hkx s LEU 388 N -1.92 4.07 0.02 0.60 0.20 -1.26 -4.63 118.68 115.76 1hkx s LEU 388 Ca 0.26 0.88 -0.03 0.00 0.69 0.00 0.00 54.13 55.94 1hkx s LEU 388 Cb -0.12 -3.18 -0.04 0.00 -0.43 0.00 0.00 46.19 42.42 1hkx s LEU 388 CO 0.18 -0.59 0.22 -0.69 -0.29 0.00 0.00 176.35 175.18 1hkx s VAL 389 N 2.97 5.37 0.15 1.68 1.01 -0.31 -4.91 120.40 126.37 1hkx s VAL 389 Ca 0.35 -0.13 0.10 0.00 0.00 0.00 0.00 61.98 62.30 1hkx s VAL 389 Cb -0.14 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1hkx s VAL 389 CO 0.10 0.26 -0.21 -1.61 0.00 0.00 0.00 175.10 173.64 1hkx s GLU 390 N -2.11 1.64 0.15 2.72 2.02 -1.26 -0.67 118.70 121.19 1hkx s GLU 390 Ca 0.30 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1hkx s GLU 390 Cb -0.13 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.12 1hkx s GLU 390 CO 0.21 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.34 1hkx n GLY 391 N 0.57 -1.76 0.01 -1.39 0.00 -0.02 -4.57 105.19 98.03 1hkx n GLY 391 Ca -0.15 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.60 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 0.72 -0.30 0.99 4.32 -1.26 -4.38 117.00 114.52 1hkx n LEU 392 Ca -0.00 -0.22 0.11 0.00 -0.02 0.00 0.00 56.01 55.87 1hkx n LEU 392 Cb 0.25 -0.10 0.27 0.00 -1.62 0.00 0.00 43.42 42.22 1hkx n LEU 392 CO 0.01 0.16 1.07 -0.78 -1.22 0.00 0.00 177.39 176.63 1hkx h ASP 393 N 0.00 0.43 0.35 -1.43 3.58 -1.96 -0.70 116.42 116.70 1hkx h ASP 393 Ca 0.00 0.12 -0.07 0.00 0.42 0.00 0.00 57.03 57.50 1hkx h ASP 393 Cb 0.57 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 1hkx h ASP 393 CO 0.00 0.10 -0.35 0.15 -2.88 0.00 0.00 179.24 176.27 1hkx h PHE 394 N 0.51 0.00 0.00 0.28 3.04 -1.81 -3.02 116.94 115.94 1hkx h PHE 394 Ca 0.52 0.00 -0.17 0.00 3.98 0.00 0.00 57.97 62.30 1hkx h PHE 394 Cb 0.88 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.36 1hkx h PHE 394 CO -0.11 0.35 -0.94 0.45 -2.02 0.00 0.00 178.31 176.03 1hkx h HIS 395 N 0.00 0.00 -1.01 0.41 -0.00 -1.43 -3.32 115.15 109.80 1hkx h HIS 395 Ca -0.00 0.00 0.23 0.00 -0.00 0.00 0.00 60.37 60.60 1hkx h HIS 395 Cb 0.62 0.00 -0.12 0.00 -0.00 0.00 0.00 27.41 27.91 1hkx h HIS 395 CO 0.00 0.74 0.60 -0.09 -0.00 0.00 0.00 177.93 179.18 1hkx h ARG 396 N 0.00 0.61 -0.27 2.45 2.43 -1.22 -1.64 114.38 116.74 1hkx h ARG 396 Ca -0.06 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.13 1hkx h ARG 396 Cb 1.62 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.98 1hkx h ARG 396 CO 0.09 0.41 -0.04 0.35 -1.51 0.00 0.00 179.97 179.26 1hkx h PHE 397 N 0.63 -0.09 0.00 2.20 3.57 -1.70 -1.40 116.94 120.15 1hkx h PHE 397 Ca 0.63 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 62.14 1hkx h PHE 397 Cb 1.14 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.96 1hkx h PHE 397 CO -0.01 -0.09 -0.03 1.88 -2.23 0.00 0.00 178.31 177.84 1hkx h TYR 398 N 0.03 0.00 0.00 0.41 -1.99 -1.52 0.26 116.97 114.16 1hkx h TYR 398 Ca 0.13 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.86 1hkx h TYR 398 Cb 0.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.92 1hkx h TYR 398 CO -0.24 0.03 0.00 1.19 -0.00 0.00 0.00 178.16 179.14 1hkx n PHE 399 N -3.73 0.00 -0.07 4.88 3.72 -0.77 -3.09 117.46 118.41 1hkx n PHE 399 Ca -0.03 0.00 0.22 0.00 -0.05 0.00 0.00 57.45 57.60 1hkx n PHE 399 Cb 0.13 -0.36 0.42 0.00 -0.94 0.00 0.00 39.48 38.73 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 0.00 0.00 0.00 -1.08 5.08 -1.20 -0.52 114.58 116.85 1hkx h GLU 400 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1hkx h GLU 400 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1hkx h GLU 400 CO 0.00 0.00 -0.29 0.09 -1.00 0.00 0.00 179.01 177.81 1hkx n ASN 401 N -3.17 1.82 -3.38 1.42 3.02 0.07 -4.87 115.26 110.18 1hkx n ASN 401 Ca 0.17 -3.20 -0.23 0.00 -0.03 0.00 0.00 54.58 51.29 1hkx n ASN 401 Cb 1.29 -0.43 -0.09 0.00 -0.61 0.00 0.00 39.78 39.93 1hkx n ASN 401 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1hkx s LEU 402 N -2.54 0.59 0.00 3.41 2.96 -0.20 -4.95 118.68 117.94 1hkx s LEU 402 Ca 0.31 -2.16 0.11 0.00 -0.22 0.00 0.00 54.13 52.17 1hkx s LEU 402 Cb 0.29 0.04 0.26 0.00 0.50 0.00 0.00 46.19 47.28 1hkx s LEU 402 CO -0.02 -0.25 1.17 0.79 -1.32 0.00 0.00 176.35 176.72 1hkx n TRP 403 N 3.79 0.37 1.54 5.38 5.03 -1.26 -4.25 117.44 128.03 1hkx n TRP 403 Ca 0.16 -0.39 0.13 0.00 3.03 0.00 0.00 57.50 60.43 1hkx n TRP 403 Cb 0.43 -0.02 0.76 0.00 -1.03 0.00 0.00 31.31 31.45 1hkx n TRP 403 CO 0.00 0.00 0.00 0.43 -0.03 0.00 0.00 177.69 178.09 1hkx n SER 404 N 0.55 0.00 0.07 -0.99 7.64 -1.26 -2.31 113.62 117.32 1hkx n SER 404 Ca 0.11 -0.57 -0.21 0.00 1.01 0.00 0.00 58.87 59.20 1hkx n SER 404 Cb 0.40 -0.11 -0.13 0.00 -1.01 0.00 0.00 64.21 63.36 1hkx n SER 404 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1hkx h ARG 405 N 0.00 0.53 -0.29 1.43 3.08 -1.91 -3.29 114.38 113.94 1hkx h ARG 405 Ca 0.00 -0.72 -0.13 0.00 0.07 0.00 0.00 59.98 59.20 1hkx h ARG 405 Cb 0.09 0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1hkx h ARG 405 CO 0.00 1.31 -0.37 -0.91 -1.07 0.00 0.00 179.97 178.93 1hkx h ASN 406 N 0.09 0.69 -1.75 7.04 2.35 -1.75 -3.26 115.58 118.99 1hkx h ASN 406 Ca -0.16 -0.30 -0.78 0.00 -0.55 0.00 0.00 56.30 54.51 1hkx h ASN 406 Cb 1.77 -0.19 -0.20 0.00 0.05 0.00 0.00 38.32 39.75 1hkx h ASN 406 CO 0.20 0.99 1.69 -1.54 -1.65 0.00 0.00 177.43 177.13 1hkx n SER 407 N -4.05 7.51 0.00 5.81 3.41 -1.20 -4.85 113.62 120.25 1hkx n SER 407 Ca -0.01 -3.40 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 1hkx n SER 407 Cb 0.51 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.18 1hkx n SER 407 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1hkx n LYS 408 N 1.01 0.00 -1.93 4.33 4.81 -1.23 -4.91 118.16 120.23 1hkx n LYS 408 Ca 0.52 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.54 1hkx n LYS 408 Cb 0.26 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.28 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 0.00 4.19 -0.15 1.64 0.02 -1.26 -4.89 135.00 134.54 1hkx s PRO 409 Ca 0.00 2.31 0.02 0.00 0.02 0.00 0.00 61.00 63.34 1hkx s PRO 409 Cb 0.00 -3.84 0.01 0.00 0.02 0.00 0.00 34.50 30.70 1hkx s PRO 409 CO 0.00 -0.81 -0.21 0.08 -0.33 0.00 0.00 177.00 175.73 1hkx s VAL 410 N 3.46 2.04 -0.13 3.83 1.01 -1.26 -4.55 120.40 124.80 1hkx s VAL 410 Ca 0.76 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1hkx s VAL 410 Cb -0.37 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1hkx s VAL 410 CO 0.32 0.54 -0.12 -2.28 0.00 0.00 0.00 175.10 173.57 1hkx s HIS 411 N 1.01 2.84 -0.01 5.22 2.46 -0.83 -5.00 115.29 120.98 1hkx s HIS 411 Ca -0.02 -0.56 0.06 0.00 0.47 0.00 0.00 55.06 55.00 1hkx s HIS 411 Cb -0.14 -1.85 -0.03 0.00 -0.13 0.00 0.00 32.58 30.43 1hkx s HIS 411 CO -0.06 -0.16 -0.19 0.99 -2.47 0.00 0.00 174.74 172.84 1hkx s THR 412 N 0.30 2.64 -0.03 0.89 2.01 -1.26 -0.85 115.64 119.34 1hkx s THR 412 Ca -0.09 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 60.96 1hkx s THR 412 Cb -0.15 -2.02 -0.00 0.00 0.01 0.00 0.00 72.50 70.33 1hkx s THR 412 CO 0.05 0.52 -0.14 -0.89 -0.69 0.00 0.00 174.62 173.47 1hkx s THR 413 N -0.74 1.17 -0.33 -0.82 2.01 -0.06 -5.00 115.64 111.87 1hkx s THR 413 Ca 0.12 -0.58 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1hkx s THR 413 Cb -0.10 -1.01 0.02 0.00 0.01 0.00 0.00 72.50 71.41 1hkx s THR 413 CO 0.01 0.34 0.13 -0.63 -0.69 0.00 0.00 174.62 173.79 1hkx s ILE 414 N 0.08 4.19 0.03 1.82 1.01 -1.26 -1.21 121.20 125.85 1hkx s ILE 414 Ca -0.03 -0.80 0.01 0.00 0.00 0.00 0.00 60.65 59.83 1hkx s ILE 414 Cb -0.10 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 1hkx s ILE 414 CO 0.01 -0.07 0.06 -0.76 0.00 0.00 0.00 174.94 174.18 1hkx s LEU 415 N 1.51 3.77 -1.44 2.97 1.43 -0.03 -4.69 118.68 122.20 1hkx s LEU 415 Ca 0.02 0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1hkx s LEU 415 Cb -0.18 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.74 1hkx s LEU 415 CO 0.04 0.23 0.29 -3.20 0.23 0.00 0.00 176.35 173.94 1hkx n ASN 416 N 0.94 -0.26 -4.74 2.29 5.15 -1.26 -1.75 115.26 115.62 1hkx n ASN 416 Ca -0.12 -1.13 -0.37 0.00 -0.60 0.00 0.00 54.58 52.36 1hkx n ASN 416 Cb 0.52 -2.43 0.05 0.00 -0.53 0.00 0.00 39.78 37.40 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 -6.90 2.80 -0.12 1.20 0.02 -1.26 -4.67 135.00 126.06 1hkx s PRO 417 Ca 0.05 2.08 -0.04 0.00 0.02 0.00 0.00 61.00 63.12 1hkx s PRO 417 Cb -0.02 -1.99 0.06 0.00 0.02 0.00 0.00 34.50 32.57 1hkx s PRO 417 CO 0.94 -1.41 0.19 -1.01 -0.33 0.00 0.00 177.00 175.38 1hkx s HIS 418 N -1.39 -0.24 -0.01 6.54 3.76 -0.59 -5.00 115.29 118.36 1hkx s HIS 418 Ca 0.78 0.58 0.01 0.00 -0.15 0.00 0.00 55.06 56.28 1hkx s HIS 418 Cb -0.37 -0.25 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 1hkx s HIS 418 CO 0.41 -0.37 0.01 0.42 -0.85 0.00 0.00 174.74 174.37 1hkx s ILE 419 N 2.32 4.26 -0.16 0.60 1.09 -1.26 -1.53 121.20 126.52 1hkx s ILE 419 Ca 0.03 -0.52 0.00 0.00 -1.10 0.00 0.00 60.65 59.06 1hkx s ILE 419 Cb -0.13 -2.89 0.03 0.00 -1.06 0.00 0.00 42.46 38.41 1hkx s ILE 419 CO -0.08 0.41 -0.13 -1.00 -0.10 0.00 0.00 174.94 174.03 1hkx s HIS 420 N -1.07 2.22 -0.01 3.97 3.76 0.60 -4.98 115.29 119.77 1hkx s HIS 420 Ca 0.19 -1.30 -0.16 0.00 -0.15 0.00 0.00 55.06 53.64 1hkx s HIS 420 Cb -0.12 -1.61 -0.06 0.00 1.11 0.00 0.00 32.58 31.91 1hkx s HIS 420 CO 0.10 -0.69 0.45 -0.51 -0.85 0.00 0.00 174.74 173.24 1hkx s LEU 421 N 1.47 4.44 -0.35 0.89 1.43 -1.26 -1.00 118.68 124.30 1hkx s LEU 421 Ca 0.04 0.98 0.00 0.00 -1.03 0.00 0.00 54.13 54.12 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 0.25 0.22 -0.04 0.23 0.00 0.00 176.35 176.90 1hkx s MET 422 N -0.72 0.55 0.00 1.70 -1.94 0.79 -5.00 119.30 114.69 1hkx s MET 422 Ca 0.25 -1.34 0.00 0.00 -1.71 0.00 0.00 55.69 52.89 1hkx s MET 422 Cb -0.17 -1.29 0.00 0.00 2.01 0.00 0.00 34.83 35.38 1hkx s MET 422 CO 0.14 -1.22 0.00 0.41 -0.01 0.00 0.00 175.02 174.34 1hkx n GLY 423 N 4.01 -1.22 0.01 -0.03 0.00 -1.26 -3.02 105.19 103.69 1hkx n GLY 423 Ca 0.13 -1.57 0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.06 0.43 -0.33 1.61 8.00 -1.26 -3.95 116.55 119.98 1hkx n ASP 424 Ca 0.00 -0.06 0.03 0.00 0.71 0.00 0.00 54.79 55.47 1hkx n ASP 424 Cb 0.00 0.09 0.07 0.00 -0.02 0.00 0.00 41.12 41.26 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 -1.57 2.02 -3.80 -1.24 -0.58 -1.26 -4.86 120.64 109.35 1hkx n GLU 425 Ca 0.06 -1.54 -0.18 0.00 -0.42 0.00 0.00 57.16 55.07 1hkx n GLU 425 Cb 0.35 -1.14 -0.17 0.00 -0.57 0.00 0.00 31.44 29.90 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 -0.86 0.74 0.08 1.62 0.15 -1.17 0.12 113.70 114.38 1hkx s SER 426 Ca 0.12 0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.78 1hkx s SER 426 Cb 0.06 -0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.14 1hkx s SER 426 CO 0.09 -0.16 -0.05 0.00 1.20 0.00 0.00 173.24 174.31 1hkx s ALA 427 N 1.51 0.81 -0.03 5.45 0.00 0.02 -0.15 121.76 129.38 1hkx s ALA 427 Ca -0.03 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 1hkx s ALA 427 Cb -0.13 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1hkx s ALA 427 CO -0.03 -0.28 0.04 0.00 0.00 0.00 0.00 175.76 175.49 1hkx s ILE 429 N 1.49 1.51 -0.07 0.00 2.07 -0.53 -0.30 121.20 125.38 1hkx s ILE 429 Ca -0.04 -0.76 0.03 0.00 -1.41 0.00 0.00 60.65 58.47 1hkx s ILE 429 Cb -0.13 -1.29 0.01 0.00 0.13 0.00 0.00 42.46 41.18 1hkx s ILE 429 CO -0.03 0.43 -0.15 0.00 -1.91 0.00 0.00 174.94 173.29 1hkx s ALA 430 N 0.01 1.42 0.23 1.50 0.00 -0.58 -0.82 121.76 123.51 1hkx s ALA 430 Ca -0.04 -0.53 -0.17 0.00 0.00 0.00 0.00 51.96 51.22 1hkx s ALA 430 Cb -0.12 -0.59 0.02 0.00 0.00 0.00 0.00 23.12 22.43 1hkx s ALA 430 CO 0.02 0.17 0.54 1.52 0.00 0.00 0.00 175.76 178.01 1hkx s TYR 431 N 0.51 0.02 -0.15 0.00 -0.85 -0.63 -1.54 117.35 114.70 1hkx s TYR 431 Ca -0.13 -0.39 -0.14 0.00 -0.52 0.00 0.00 57.07 55.88 1hkx s TYR 431 Cb -0.15 0.38 -0.05 0.00 0.38 0.00 0.00 41.96 42.52 1hkx s TYR 431 CO 0.04 -1.00 0.30 0.42 -1.52 0.00 0.00 175.55 173.80 1hkx s ILE 432 N -3.93 5.30 -0.29 -3.49 -1.09 -0.72 -1.38 121.20 115.59 1hkx s ILE 432 Ca 0.14 0.57 -0.07 0.00 -2.23 0.00 0.00 60.65 59.05 1hkx s ILE 432 Cb -0.02 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.23 1hkx s ILE 432 CO 0.03 0.40 0.09 -0.60 -1.23 0.00 0.00 174.94 173.62 1hkx s ARG 433 N 0.40 3.17 -0.16 2.79 3.52 0.76 -0.85 118.95 128.58 1hkx s ARG 433 Ca 0.17 -0.81 -0.04 0.00 -0.13 0.00 0.00 55.73 54.93 1hkx s ARG 433 Cb -0.13 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.83 1hkx s ARG 433 CO 0.04 -0.42 -0.03 0.42 -0.81 0.00 0.00 175.30 174.51 1hkx s ILE 434 N 1.53 3.94 -0.12 4.11 1.01 -0.35 -1.76 121.20 129.55 1hkx s ILE 434 Ca 0.03 -0.34 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1hkx s ILE 434 Cb -0.17 -2.74 0.00 0.00 0.01 0.00 0.00 42.46 39.57 1hkx s ILE 434 CO 0.03 0.48 -0.21 -0.89 0.00 0.00 0.00 174.94 174.35 1hkx s THR 435 N 0.46 2.24 -0.26 2.92 2.01 -0.04 -0.88 115.64 122.10 1hkx s THR 435 Ca -0.03 -0.94 -0.06 0.00 0.31 0.00 0.00 61.69 60.97 1hkx s THR 435 Cb -0.14 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 1hkx s THR 435 CO 0.03 0.55 0.05 -1.10 -0.69 0.00 0.00 174.62 173.45 1hkx s GLN 436 N 0.56 3.41 0.19 4.92 -0.21 -0.03 -1.03 119.66 127.48 1hkx s GLN 436 Ca -0.12 -0.63 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1hkx s GLN 436 Cb -0.17 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.54 1hkx s GLN 436 CO 0.04 -0.27 0.08 1.52 -2.12 0.00 0.00 175.29 174.54 1hkx s TYR 437 N 1.55 1.20 0.00 0.91 -0.85 -0.79 -1.96 117.35 117.41 1hkx s TYR 437 Ca 0.05 -1.22 0.00 0.00 -0.52 0.00 0.00 57.07 55.38 1hkx s TYR 437 Cb -0.16 -0.66 0.00 0.00 0.38 0.00 0.00 41.96 41.53 1hkx s TYR 437 CO 0.02 -0.45 0.00 1.28 -1.52 0.00 0.00 175.55 174.88 1hkx n LEU 438 N -0.28 0.00 0.00 -3.49 4.77 -1.26 -0.87 117.00 115.88 1hkx n LEU 438 Ca -0.02 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.03 1hkx n LEU 438 Cb 0.65 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.72 1hkx n LEU 438 CO 0.34 0.00 -0.10 0.47 -1.33 0.00 0.00 177.39 176.77 1hkx n ASP 439 N 0.00 -3.13 -0.83 -1.43 8.00 -1.24 -4.63 116.55 113.29 1hkx n ASP 439 Ca 0.00 0.56 -0.11 0.00 0.71 0.00 0.00 54.79 55.95 1hkx n ASP 439 Cb 0.00 -1.56 -0.05 0.00 -0.02 0.00 0.00 41.12 39.49 1hkx n ASP 439 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hkx n ALA 440 N -1.43 -0.16 0.00 2.24 0.00 -1.26 -1.37 120.51 118.52 1hkx n ALA 440 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1hkx n ALA 440 Cb 0.24 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 -1.40 1.95 2.20 0.00 0.00 -1.26 -4.50 105.19 102.18 1hkx n GLY 441 Ca -0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.61 0.78 3.76 -0.02 0.00 -1.09 -5.01 105.19 103.01 1hkx n GLY 442 Ca 0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.15 4.57 -0.10 -0.61 1.01 -0.47 -4.67 121.20 118.77 1hkx s ILE 443 Ca 0.00 1.66 -0.30 0.00 0.00 0.00 0.00 60.65 62.01 1hkx s ILE 443 Cb 0.00 -4.12 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 1hkx s ILE 443 CO 0.00 0.44 1.09 -2.84 0.00 0.00 0.00 174.94 173.63 1hkx s PRO 444 N -0.58 4.37 0.12 2.79 0.02 -1.26 -3.66 135.00 136.80 1hkx s PRO 444 Ca 0.37 1.50 0.03 0.00 0.02 0.00 0.00 61.00 62.92 1hkx s PRO 444 Cb -0.22 -3.57 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 1hkx s PRO 444 CO 0.24 -0.41 -0.08 1.03 -0.33 0.00 0.00 177.00 177.45 1hkx s ARG 445 N 2.26 0.94 -0.05 5.54 0.52 -0.05 -5.01 118.95 123.10 1hkx s ARG 445 Ca 0.51 -1.38 0.04 0.00 -0.52 0.00 0.00 55.73 54.38 1hkx s ARG 445 Cb -0.20 -0.40 -0.00 0.00 0.52 0.00 0.00 34.95 34.86 1hkx s ARG 445 CO 0.18 0.03 -0.17 0.99 0.02 0.00 0.00 175.30 176.35 1hkx s THR 446 N -3.46 1.46 0.05 0.02 2.01 -1.26 -1.89 115.64 112.57 1hkx s THR 446 Ca 0.14 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.51 1hkx s THR 446 Cb 0.04 -1.26 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 1hkx s THR 446 CO -0.02 0.42 -0.26 0.00 -0.69 0.00 0.00 174.62 174.07 1hkx s ALA 447 N 0.14 2.23 0.05 7.40 0.00 -0.19 -4.96 121.76 126.42 1hkx s ALA 447 Ca -0.06 -1.27 0.08 0.00 0.00 0.00 0.00 51.96 50.71 1hkx s ALA 447 Cb -0.13 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 1hkx s ALA 447 CO 0.03 0.53 -0.22 -1.14 0.00 0.00 0.00 175.76 174.96 1hkx s GLN 448 N -1.27 1.41 -0.12 0.00 0.74 -1.26 -0.86 119.66 118.30 1hkx s GLN 448 Ca 0.12 -1.01 -0.20 0.00 0.05 0.00 0.00 55.36 54.31 1hkx s GLN 448 Cb -0.10 -1.57 0.05 0.00 1.10 0.00 0.00 33.01 32.49 1hkx s GLN 448 CO 0.02 0.40 0.51 -1.54 -0.55 0.00 0.00 175.29 174.13 1hkx s SER 449 N -1.31 -0.49 -0.15 6.67 1.04 -0.72 -4.09 113.70 114.65 1hkx s SER 449 Ca 0.08 0.76 -0.16 0.00 0.48 0.00 0.00 55.95 57.11 1hkx s SER 449 Cb -0.09 0.78 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 1hkx s SER 449 CO 0.02 -0.34 0.37 -1.61 0.98 0.00 0.00 173.24 172.66 1hkx s GLU 450 N -0.42 4.29 0.02 4.02 8.01 0.11 -0.17 118.70 134.55 1hkx s GLU 450 Ca -0.06 0.24 0.05 0.00 0.01 0.00 0.00 54.97 55.21 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 0.04 0.19 -0.16 -1.21 0.01 0.00 0.00 175.26 174.13 1hkx s GLU 451 N 0.58 1.13 -0.08 1.61 2.02 -0.48 -0.40 118.70 123.08 1hkx s GLU 451 Ca 0.20 -0.70 0.03 0.00 0.02 0.00 0.00 54.97 54.52 1hkx s GLU 451 Cb -0.14 -1.14 0.01 0.00 0.10 0.00 0.00 34.13 32.95 1hkx s GLU 451 CO 0.06 0.30 -0.18 0.99 0.02 0.00 0.00 175.26 176.46 1hkx s THR 452 N -0.64 1.57 -0.10 3.63 2.01 -0.29 -1.60 115.64 120.22 1hkx s THR 452 Ca 0.04 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.33 1hkx s THR 452 Cb -0.07 -1.39 0.01 0.00 0.01 0.00 0.00 72.50 71.07 1hkx s THR 452 CO 0.01 0.45 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.10 1hkx s ARG 453 N 0.51 2.22 -0.27 4.92 1.81 -0.00 -1.26 118.95 126.89 1hkx s ARG 453 Ca -0.17 -0.57 -0.08 0.00 -1.72 0.00 0.00 55.73 53.20 1hkx s ARG 453 Cb -0.17 -1.86 -0.02 0.00 -0.45 0.00 0.00 34.95 32.45 1hkx s ARG 453 CO 0.06 -0.03 0.09 0.08 -0.68 0.00 0.00 175.30 174.82 1hkx s VAL 454 N 0.87 4.33 -0.11 3.52 1.01 0.42 -1.45 120.40 129.00 1hkx s VAL 454 Ca -0.09 -0.27 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1hkx s VAL 454 Cb -0.15 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1hkx s VAL 454 CO 0.00 0.26 0.06 0.26 0.00 0.00 0.00 175.10 175.69 1hkx s TRP 455 N 1.60 3.34 -0.05 5.22 0.52 0.10 -0.59 118.94 129.09 1hkx s TRP 455 Ca 0.06 0.32 0.01 0.00 0.02 0.00 0.00 56.10 56.50 1hkx s TRP 455 Cb -0.16 -1.87 0.02 0.00 -1.15 0.00 0.00 33.47 30.31 1hkx s TRP 455 CO 0.04 0.55 -0.06 -1.58 0.02 0.00 0.00 176.95 175.92 1hkx s HIS 456 N -0.84 0.94 -0.31 -1.98 2.46 0.15 -0.80 115.29 114.91 1hkx s HIS 456 Ca 0.13 -0.30 -0.28 0.00 0.47 0.00 0.00 55.06 55.08 1hkx s HIS 456 Cb -0.12 -0.79 0.01 0.00 -0.13 0.00 0.00 32.58 31.56 1hkx s HIS 456 CO 0.03 -0.23 1.02 0.50 -2.47 0.00 0.00 174.74 173.59 1hkx s ARG 457 N 0.94 4.05 -0.12 2.88 6.06 0.33 -0.80 118.95 132.28 1hkx s ARG 457 Ca -0.11 0.99 0.00 0.00 -2.50 0.00 0.00 55.73 54.12 1hkx s ARG 457 Cb -0.14 -3.73 0.02 0.00 0.06 0.00 0.00 34.95 31.15 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 3.51 1.97 -1.53 5.12 3.52 -0.53 -4.83 118.95 126.18 1hkx s ARG 458 Ca 0.43 -0.44 -0.06 0.00 -0.13 0.00 0.00 55.73 55.52 1hkx s ARG 458 Cb -0.13 -1.83 0.05 0.00 -1.56 0.00 0.00 34.95 31.49 1hkx s ARG 458 CO 0.14 -0.19 0.46 -0.25 -0.81 0.00 0.00 175.30 174.65 1hkx n ASP 459 N 4.65 -1.00 0.00 -2.12 8.00 -1.26 -2.40 116.55 122.41 1hkx n ASP 459 Ca -0.16 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.27 1hkx n ASP 459 Cb 0.50 -2.66 0.00 0.00 -0.02 0.00 0.00 41.12 38.94 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 -1.89 2.92 3.85 0.44 0.00 -1.26 -5.04 105.19 104.21 1hkx n GLY 460 Ca -0.19 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 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 3.20 0.24 1.61 -2.85 -1.01 -5.06 119.74 115.86 1hkx s LYS 461 Ca 0.00 -0.52 -0.30 0.00 -1.00 0.00 0.00 55.97 54.15 1hkx s LYS 461 Cb 0.00 -2.91 -0.09 0.00 -2.06 0.00 0.00 37.83 32.77 1hkx s LYS 461 CO 0.00 0.61 1.03 -1.58 0.10 0.00 0.00 175.35 175.50 1hkx s TRP 462 N -1.40 3.76 0.02 1.78 0.52 -1.26 -1.45 118.94 120.90 1hkx s TRP 462 Ca 0.31 1.78 0.03 0.00 0.02 0.00 0.00 56.10 58.23 1hkx s TRP 462 Cb -0.13 -3.15 -0.02 0.00 -1.15 0.00 0.00 33.47 29.03 1hkx s TRP 462 CO 0.23 -0.11 -0.09 -0.65 0.02 0.00 0.00 176.95 176.36 1hkx s GLN 463 N -1.06 0.62 -0.02 4.98 -0.21 0.02 -4.85 119.66 119.13 1hkx s GLN 463 Ca 0.44 -0.55 -0.30 0.00 0.02 0.00 0.00 55.36 54.97 1hkx s GLN 463 Cb -0.29 -0.54 -0.03 0.00 1.00 0.00 0.00 33.01 33.16 1hkx s GLN 463 CO 0.36 0.13 1.01 0.42 -2.12 0.00 0.00 175.29 175.09 1hkx s ILE 464 N -0.76 4.76 -0.06 1.08 1.01 0.13 -0.68 121.20 126.68 1hkx s ILE 464 Ca -0.02 1.99 0.17 0.00 0.00 0.00 0.00 60.65 62.79 1hkx s ILE 464 Cb -0.06 -4.28 -0.25 0.00 0.01 0.00 0.00 42.46 37.88 1hkx s ILE 464 CO 0.00 0.11 0.30 0.55 0.00 0.00 0.00 174.94 175.91 1hkx n VAL 465 N 4.08 0.29 -3.59 2.92 3.14 0.25 -0.93 118.33 124.49 1hkx n VAL 465 Ca 0.07 -0.47 -0.12 0.00 -2.96 0.00 0.00 64.34 60.86 1hkx n VAL 465 Cb 0.50 -0.07 -0.06 0.00 -1.06 0.00 0.00 33.84 33.15 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 -3.00 -0.48 -0.01 1.45 5.65 -1.22 -1.99 115.29 115.69 1hkx s HIS 466 Ca -0.07 0.97 -0.11 0.00 0.25 0.00 0.00 55.06 56.10 1hkx s HIS 466 Cb 0.10 0.40 0.01 0.00 -1.18 0.00 0.00 32.58 31.91 1hkx s HIS 466 CO 0.71 -0.35 0.23 -0.59 -0.65 0.00 0.00 174.74 174.09 1hkx s PHE 467 N -0.60 -0.08 -0.11 3.88 -0.12 -0.68 -0.44 117.98 119.84 1hkx s PHE 467 Ca -0.02 0.08 -0.01 0.00 -0.05 0.00 0.00 56.93 56.94 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 0.01 -0.34 -0.03 -1.58 -0.05 0.00 0.00 175.22 173.22 1hkx s HIS 468 N -1.34 1.15 -0.15 3.49 2.46 -0.39 -1.61 115.29 118.90 1hkx s HIS 468 Ca -0.14 -0.56 -0.01 0.00 0.47 0.00 0.00 55.06 54.82 1hkx s HIS 468 Cb -0.06 -1.06 -0.01 0.00 -0.13 0.00 0.00 32.58 31.32 1hkx s HIS 468 CO 0.03 -0.46 -0.11 0.50 -2.47 0.00 0.00 174.74 172.23 1hkx s ARG 469 N 1.82 3.41 -0.11 2.88 3.52 0.88 -1.13 118.95 130.22 1hkx s ARG 469 Ca 0.04 -0.66 0.03 0.00 -0.13 0.00 0.00 55.73 55.01 1hkx s ARG 469 Cb -0.13 -2.72 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1hkx s ARG 469 CO -0.07 0.15 -0.22 0.45 -0.81 0.00 0.00 175.30 174.79 1hkx s SER 470 N 0.54 3.21 0.00 -2.12 0.15 0.46 -4.02 113.70 111.93 1hkx s SER 470 Ca -0.07 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.04 1hkx s SER 470 Cb -0.15 -1.44 0.00 0.00 -1.71 0.00 0.00 66.02 62.72 1hkx s SER 470 CO 0.04 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.23 1hkx n GLY 471 N 3.61 1.11 0.00 9.45 0.00 -1.26 0.05 105.19 118.14 1hkx n GLY 471 Ca -0.19 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.19 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 0.07 -0.92 4.61 0.00 -1.26 -4.86 120.51 117.15 1hkx n ALA 472 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1hkx n ALA 472 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.58 -0.30 -3.48 0.00 -0.02 -1.26 -4.89 135.00 124.46 1hkx n PRO 473 Ca 0.00 -0.12 -0.24 0.00 -2.02 0.00 0.00 63.50 61.12 1hkx n PRO 473 Cb 0.00 -0.23 -0.13 0.00 -0.02 0.00 0.00 33.50 33.12 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 -1.60 2.79 0.00 2.55 0.01 -1.26 -4.85 113.70 111.34 1hkx s SER 474 Ca 0.05 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.23 1hkx s SER 474 Cb -0.01 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1hkx s SER 474 CO 0.05 -0.42 0.00 0.52 0.41 0.00 0.00 173.24 173.80