#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hkx s ILE 338 N 0.00 4.81 0.57 1.09 1.01 -1.26 -4.92 121.20 122.50 1hkx s ILE 338 Ca 0.00 0.53 0.33 0.00 0.00 0.00 0.00 60.65 61.50 1hkx s ILE 338 Cb 0.00 -3.85 0.48 0.00 0.01 0.00 0.00 42.46 39.10 1hkx s ILE 338 CO 0.00 -0.93 1.75 1.05 0.00 0.00 0.00 174.94 176.81 1hkx h GLU 339 N 0.13 0.00 0.00 2.79 4.11 -2.11 -3.39 114.58 116.11 1hkx h GLU 339 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1hkx h GLU 339 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1hkx h GLU 339 CO 0.62 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.30 1hkx n ASP 340 N -3.87 0.00 0.00 3.06 5.68 -1.26 -4.16 116.55 115.99 1hkx n ASP 340 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.49 1hkx n ASP 340 Cb 1.12 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 41.10 1hkx n ASP 340 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1hkx n GLU 341 N 0.00 0.00 0.00 0.11 -0.58 -1.26 -4.49 120.64 114.42 1hkx n GLU 341 Ca 0.00 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.84 1hkx n GLU 341 Cb 0.00 -2.16 0.49 0.00 -0.57 0.00 0.00 31.44 29.20 1hkx n GLU 341 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1hkx n ASP 342 N 0.12 0.00 -0.25 1.62 5.75 -1.26 -2.38 116.55 120.15 1hkx n ASP 342 Ca 0.00 0.15 0.26 0.00 -0.01 0.00 0.00 54.79 55.19 1hkx n ASP 342 Cb 0.00 -0.35 0.64 0.00 -1.03 0.00 0.00 41.12 40.38 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 0.55 0.00 2.12 1.35 -1.89 2.24 112.91 117.29 1hkx h THR 343 Ca 0.00 -0.06 -0.01 0.00 -0.55 0.00 0.00 66.41 65.79 1hkx h THR 343 Cb 0.24 0.37 -0.00 0.00 -1.73 0.00 0.00 68.15 67.03 1hkx h THR 343 CO 0.00 0.03 -0.04 0.11 -0.25 0.00 0.00 175.52 175.38 1hkx h LYS 344 N 0.17 0.00 -0.09 4.72 1.57 -1.86 0.57 116.57 121.64 1hkx h LYS 344 Ca 0.49 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 59.06 1hkx h LYS 344 Cb 1.64 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.95 1hkx h LYS 344 CO -0.10 0.04 -0.81 0.28 -0.57 0.00 0.00 179.45 178.28 1hkx h VAL 345 N 0.00 1.33 -0.12 0.50 2.07 0.35 0.22 116.25 120.60 1hkx h VAL 345 Ca -0.00 -2.11 -0.06 0.00 0.82 0.00 0.00 66.70 65.35 1hkx h VAL 345 Cb 0.08 2.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1hkx h VAL 345 CO 0.00 0.65 -0.14 -0.09 0.02 0.00 0.00 177.57 178.01 1hkx h ARG 346 N 0.40 0.31 -0.25 1.57 2.43 -0.72 -0.76 114.38 117.37 1hkx h ARG 346 Ca -0.06 -0.17 0.03 0.00 -0.81 0.00 0.00 59.98 58.97 1hkx h ARG 346 Cb 1.42 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.96 1hkx h ARG 346 CO 0.15 0.73 0.08 0.87 -1.51 0.00 0.00 179.97 180.30 1hkx h LYS 347 N -0.09 0.19 0.00 0.20 1.57 0.06 -0.82 116.57 117.68 1hkx h LYS 347 Ca 0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1hkx h LYS 347 Cb 0.68 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.95 1hkx h LYS 347 CO 0.03 0.13 -0.05 0.37 -0.57 0.00 0.00 179.45 179.36 1hkx h GLN 348 N 0.20 0.00 -0.19 3.15 5.75 -0.47 -0.24 115.11 123.31 1hkx h GLN 348 Ca 0.11 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.47 1hkx h GLN 348 Cb 0.08 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1hkx h GLN 348 CO -0.11 0.05 -0.47 1.49 -2.65 0.00 0.00 178.83 177.14 1hkx h GLU 349 N 0.00 0.48 -0.22 1.69 4.81 0.31 -0.23 114.58 121.42 1hkx h GLU 349 Ca -0.00 -0.27 -0.20 0.00 -0.13 0.00 0.00 59.36 58.76 1hkx h GLU 349 Cb 0.12 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.52 1hkx h GLU 349 CO 0.01 0.85 -0.63 0.82 -0.73 0.00 0.00 179.01 179.33 1hkx h ILE 350 N 0.39 1.28 0.00 2.32 2.04 -0.53 -1.54 117.51 121.47 1hkx h ILE 350 Ca 0.02 -1.82 -0.03 0.00 1.00 0.00 0.00 64.86 64.03 1hkx h ILE 350 Cb 0.97 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1hkx h ILE 350 CO 0.09 0.59 -0.13 0.40 0.00 0.00 0.00 178.15 179.09 1hkx h ILE 351 N 0.57 1.02 0.08 -0.67 2.04 -0.91 0.11 117.51 119.75 1hkx h ILE 351 Ca -0.02 -0.44 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 1hkx h ILE 351 Cb 1.25 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1hkx h ILE 351 CO 0.14 0.12 -0.04 0.50 0.00 0.00 0.00 178.15 178.87 1hkx h LYS 352 N 0.00 -0.10 -0.63 2.37 3.64 -0.58 -2.25 116.57 119.02 1hkx h LYS 352 Ca -0.00 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1hkx h LYS 352 Cb 0.23 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1hkx h LYS 352 CO 0.02 0.38 0.18 -0.39 -2.27 0.00 0.00 179.45 177.37 1hkx h VAL 353 N -0.64 1.25 -0.67 2.00 -1.51 -0.98 0.55 116.25 116.24 1hkx h VAL 353 Ca -0.01 -0.87 0.03 0.00 -1.23 0.00 0.00 66.70 64.62 1hkx h VAL 353 Cb 0.53 0.61 -0.04 0.00 -2.13 0.00 0.00 31.29 30.26 1hkx h VAL 353 CO 0.02 0.33 0.41 0.74 -1.23 0.00 0.00 177.57 177.84 1hkx h THR 354 N 0.92 1.07 -0.39 7.19 2.02 -0.86 0.59 112.91 123.46 1hkx h THR 354 Ca 0.20 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 67.02 1hkx h THR 354 Cb 0.31 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 1hkx h THR 354 CO -0.00 0.15 -0.10 -0.33 0.37 0.00 0.00 175.52 175.60 1hkx h GLU 355 N 0.80 0.68 -0.49 6.66 5.08 -0.98 0.26 114.58 126.59 1hkx h GLU 355 Ca 0.28 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1hkx h GLU 355 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1hkx h GLU 355 CO -0.12 0.77 -0.10 1.96 -1.00 0.00 0.00 179.01 180.52 1hkx h GLN 356 N 0.62 0.94 0.23 2.33 4.20 0.71 -0.94 115.11 123.20 1hkx h GLN 356 Ca 0.11 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 1hkx h GLN 356 Cb 0.54 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1hkx h GLN 356 CO 0.03 1.01 -0.11 1.25 -0.67 0.00 0.00 178.83 180.34 1hkx h LEU 357 N 0.79 -0.26 -0.70 1.46 5.85 0.48 0.42 115.31 123.35 1hkx h LEU 357 Ca 0.13 -0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1hkx h LEU 357 Cb 0.65 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.68 1hkx h LEU 357 CO 0.04 -0.08 0.36 0.40 -0.34 0.00 0.00 178.44 178.82 1hkx h ILE 358 N -0.42 0.87 -0.88 4.05 1.08 -0.87 -0.63 117.51 120.72 1hkx h ILE 358 Ca -0.03 -0.21 -0.03 0.00 -0.39 0.00 0.00 64.86 64.20 1hkx h ILE 358 Cb 0.32 0.20 -0.04 0.00 -3.07 0.00 0.00 36.82 34.23 1hkx h ILE 358 CO 0.05 0.11 0.44 -0.08 -0.69 0.00 0.00 178.15 177.99 1hkx h GLU 359 N 0.62 1.25 -0.57 2.37 4.81 -0.90 -1.30 114.58 120.86 1hkx h GLU 359 Ca 0.34 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1hkx h GLU 359 Cb 0.33 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1hkx h GLU 359 CO -0.25 0.94 0.03 0.00 -0.73 0.00 0.00 179.01 179.00 1hkx h ALA 360 N 1.24 0.99 0.88 2.92 0.00 0.24 -0.41 119.26 125.13 1hkx h ALA 360 Ca 0.30 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1hkx h ALA 360 Cb 0.08 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1hkx h ALA 360 CO -0.04 0.63 -0.42 0.82 0.00 0.00 0.00 179.25 180.23 1hkx h ILE 361 N 0.89 0.07 -0.83 0.00 2.04 -0.60 0.46 117.51 119.54 1hkx h ILE 361 Ca 0.17 -0.08 0.17 0.00 1.00 0.00 0.00 64.86 66.12 1hkx h ILE 361 Cb 0.47 0.08 -0.11 0.00 -0.74 0.00 0.00 36.82 36.53 1hkx h ILE 361 CO 0.02 0.00 0.37 0.28 0.00 0.00 0.00 178.15 178.82 1hkx h SER 362 N -1.26 0.36 -0.48 1.72 0.02 -1.10 0.79 113.55 113.60 1hkx h SER 362 Ca -0.12 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1hkx h SER 362 Cb 0.91 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1hkx h SER 362 CO 0.20 0.10 0.25 0.78 -1.14 0.00 0.00 176.83 177.02 1hkx h ASN 363 N 0.47 0.61 0.00 3.07 2.35 -1.00 -3.46 115.58 117.62 1hkx h ASN 363 Ca 0.48 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 1hkx h ASN 363 Cb 0.79 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1hkx h ASN 363 CO -0.44 0.54 0.00 0.61 -1.65 0.00 0.00 177.43 176.49 1hkx n GLY 364 N -0.98 1.31 3.40 2.83 0.00 0.27 -4.89 105.19 107.14 1hkx n GLY 364 Ca 0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 7.14 0.31 1.61 3.68 0.01 -4.86 116.67 122.56 1hkx s ASP 365 Ca 0.00 -3.18 0.00 0.00 2.13 0.00 0.00 52.55 51.50 1hkx s ASP 365 Cb 0.00 -2.31 0.50 0.00 -1.45 0.00 0.00 42.92 39.66 1hkx s ASP 365 CO 0.00 -0.56 1.92 0.15 0.13 0.00 0.00 175.17 176.80 1hkx h PHE 366 N 7.08 0.85 -0.07 -5.34 3.57 -1.91 -2.09 116.94 119.04 1hkx h PHE 366 Ca 0.24 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.75 1hkx h PHE 366 Cb 0.89 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.31 1hkx h PHE 366 CO 0.96 0.63 -0.29 1.49 -2.23 0.00 0.00 178.31 178.87 1hkx h GLU 367 N 0.86 -0.38 -0.55 1.11 4.57 -1.97 0.24 114.58 118.47 1hkx h GLU 367 Ca 0.21 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.40 1hkx h GLU 367 Cb 0.09 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1hkx h GLU 367 CO -0.03 -0.25 0.24 0.77 -1.18 0.00 0.00 179.01 178.56 1hkx h SER 368 N -0.39 0.73 -0.99 1.04 0.02 -1.95 -1.83 113.55 110.18 1hkx h SER 368 Ca 0.08 -0.15 0.16 0.00 -0.84 0.00 0.00 61.79 61.05 1hkx h SER 368 Cb 0.51 -0.19 -0.10 0.00 0.14 0.00 0.00 62.40 62.77 1hkx h SER 368 CO -0.29 0.68 0.60 0.22 -1.14 0.00 0.00 176.83 176.89 1hkx h TYR 369 N 0.74 1.06 -0.44 3.45 3.20 -0.62 -0.05 116.97 124.31 1hkx h TYR 369 Ca 0.19 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.03 1hkx h TYR 369 Cb 0.15 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 1hkx h TYR 369 CO 0.00 0.30 0.06 1.15 -1.64 0.00 0.00 178.16 178.02 1hkx h THR 370 N 0.82 1.25 0.00 1.81 2.02 0.26 -1.66 112.91 117.41 1hkx h THR 370 Ca 0.54 -0.93 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 1hkx h THR 370 Cb 0.75 0.99 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1hkx h THR 370 CO -0.35 0.32 -0.15 0.11 0.37 0.00 0.00 175.52 175.82 1hkx h LYS 371 N 0.60 0.00 0.00 6.66 1.57 -0.55 -2.20 116.57 122.65 1hkx h LYS 371 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1hkx h LYS 371 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1hkx h LYS 371 CO 0.01 0.15 -0.57 -1.33 -0.57 0.00 0.00 179.45 177.14 1hkx n MET 372 N -3.86 0.19 -4.36 3.15 2.81 -0.34 -4.86 117.12 109.85 1hkx n MET 372 Ca -0.02 0.05 -0.34 0.00 -1.81 0.00 0.00 57.70 55.59 1hkx n MET 372 Cb 0.25 -1.62 -0.11 0.00 -0.71 0.00 0.00 33.22 31.03 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 0.06 6.64 0.54 0.00 -1.08 -0.95 -4.88 116.67 117.01 1hkx s ASP 374 Ca 0.01 2.78 0.22 0.00 -0.52 0.00 0.00 52.55 55.04 1hkx s ASP 374 Cb -0.13 -2.65 1.43 0.00 -1.46 0.00 0.00 42.92 40.10 1hkx s ASP 374 CO 0.02 -0.65 2.11 -0.65 0.52 0.00 0.00 175.17 176.52 1hkx h PRO 375 N 3.50 0.00 -0.92 4.34 0.11 -1.91 -0.71 132.00 136.41 1hkx h PRO 375 Ca -0.49 0.00 -0.44 0.00 0.11 0.00 0.00 66.00 65.18 1hkx h PRO 375 Cb 1.23 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.07 1hkx h PRO 375 CO 0.67 0.00 0.55 0.41 -0.21 0.00 0.00 178.00 179.41 1hkx n GLY 376 N -1.53 4.34 3.76 -0.55 0.00 -1.26 -3.92 105.19 106.03 1hkx n GLY 376 Ca 0.01 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 1hkx n GLY 376 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1hkx s MET 377 N -3.24 4.46 -0.04 1.61 0.23 -0.28 -4.64 119.30 117.41 1hkx s MET 377 Ca 0.56 2.03 -0.00 0.00 -1.03 0.00 0.00 55.69 57.25 1hkx s MET 377 Cb 0.47 -3.15 -0.03 0.00 -1.53 0.00 0.00 34.83 30.59 1hkx s MET 377 CO 0.11 -0.08 0.01 -0.08 -2.03 0.00 0.00 175.02 172.95 1hkx s THR 378 N -0.76 4.30 0.01 3.16 -1.32 -0.37 -0.80 115.64 119.86 1hkx s THR 378 Ca 0.50 -0.41 -0.00 0.00 -1.21 0.00 0.00 61.69 60.56 1hkx s THR 378 Cb -0.36 -2.88 -0.01 0.00 -1.51 0.00 0.00 72.50 67.74 1hkx s THR 378 CO 0.45 0.48 -0.01 0.00 -2.21 0.00 0.00 174.62 173.32 1hkx s ALA 379 N -1.01 0.05 -0.19 11.08 0.00 0.13 -1.80 121.76 130.03 1hkx s ALA 379 Ca 0.17 -0.29 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1hkx s ALA 379 Cb -0.11 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.11 1hkx s ALA 379 CO 0.07 -0.08 -0.13 -0.06 0.00 0.00 0.00 175.76 175.56 1hkx s PHE 380 N -0.73 2.56 0.01 0.00 2.99 -0.58 -0.20 117.98 122.03 1hkx s PHE 380 Ca -0.08 -1.63 -0.20 0.00 0.00 0.00 0.00 56.93 55.02 1hkx s PHE 380 Cb -0.05 -1.73 0.04 0.00 0.00 0.00 0.00 43.02 41.28 1hkx s PHE 380 CO -0.00 -0.76 0.43 -1.83 -0.00 0.00 0.00 175.22 173.06 1hkx s GLU 381 N 1.35 0.87 0.45 0.44 -1.05 -1.26 -0.07 118.70 119.43 1hkx s GLU 381 Ca 0.00 -0.18 0.21 0.00 -0.15 0.00 0.00 54.97 54.86 1hkx s GLU 381 Cb -0.15 0.39 1.19 0.00 -0.44 0.00 0.00 34.13 35.12 1hkx s GLU 381 CO -0.09 -0.28 1.87 -1.35 0.95 0.00 0.00 175.26 176.36 1hkx h PRO 382 N 3.29 0.28 0.00 -4.83 0.11 -1.90 0.19 132.00 129.15 1hkx h PRO 382 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1hkx h PRO 382 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1hkx h PRO 382 CO 0.41 0.19 0.00 0.39 -0.21 0.00 0.00 178.00 178.78 1hkx n GLU 383 N -4.45 0.61 0.00 1.05 4.71 -1.26 -2.07 120.64 119.23 1hkx n GLU 383 Ca 0.19 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.39 1hkx n GLU 383 Cb 0.76 -1.41 0.01 0.00 -1.01 0.00 0.00 31.44 29.79 1hkx n GLU 383 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1hkx n ALA 384 N -0.91 2.75 -3.72 0.62 0.00 0.67 -5.04 120.51 114.89 1hkx n ALA 384 Ca 0.12 -0.49 -0.24 0.00 0.00 0.00 0.00 53.44 52.82 1hkx n ALA 384 Cb 0.05 -0.38 0.03 0.00 0.00 0.00 0.00 19.45 19.15 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 0.04 -3.04 0.00 0.00 4.77 -0.88 -2.33 117.00 115.56 1hkx n LEU 385 Ca 0.05 -0.90 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 1hkx n LEU 385 Cb 0.24 -2.54 0.00 0.00 -2.33 0.00 0.00 43.42 38.79 1hkx n LEU 385 CO 0.11 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1hkx n GLY 386 N -1.66 2.63 3.84 -0.72 0.00 -1.26 -5.03 105.19 102.99 1hkx n GLY 386 Ca -0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.21 6.82 -0.31 1.61 0.01 -0.98 -5.05 114.94 114.83 1hkx s ASN 387 Ca 0.00 1.05 -0.26 0.00 -0.71 0.00 0.00 52.86 52.94 1hkx s ASN 387 Cb 0.00 -2.28 0.01 0.00 0.41 0.00 0.00 41.25 39.39 1hkx s ASN 387 CO 0.00 0.15 0.91 -0.22 -1.51 0.00 0.00 177.10 176.43 1hkx s LEU 388 N -1.79 4.03 0.17 0.60 2.96 -1.26 -4.64 118.68 118.75 1hkx s LEU 388 Ca 0.35 0.84 -0.01 0.00 -0.22 0.00 0.00 54.13 55.10 1hkx s LEU 388 Cb -0.15 -3.28 -0.04 0.00 0.50 0.00 0.00 46.19 43.21 1hkx s LEU 388 CO 0.18 -0.72 0.35 -0.69 -1.32 0.00 0.00 176.35 174.16 1hkx s VAL 389 N 3.24 5.24 0.04 1.68 1.01 0.72 -4.88 120.40 127.45 1hkx s VAL 389 Ca 0.38 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1hkx s VAL 389 Cb -0.13 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1hkx s VAL 389 CO 0.13 -0.10 -0.11 -0.70 0.00 0.00 0.00 175.10 174.33 1hkx s GLU 390 N -3.12 0.69 0.04 2.72 2.12 -1.26 0.22 118.70 120.10 1hkx s GLU 390 Ca 0.38 -0.73 0.00 0.00 0.36 0.00 0.00 54.97 54.98 1hkx s GLU 390 Cb -0.11 -0.60 0.00 0.00 0.26 0.00 0.00 34.13 33.68 1hkx s GLU 390 CO 0.28 0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.55 1hkx n GLY 391 N 1.73 -2.51 0.88 -1.50 0.00 0.02 -4.54 105.19 99.28 1hkx n GLY 391 Ca -0.20 -1.60 0.09 0.00 0.00 0.00 0.00 46.02 44.31 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 0.00 2.96 -0.20 0.99 4.32 -1.26 -4.57 117.00 119.24 1hkx n LEU 392 Ca 0.00 -1.38 -0.08 0.00 -0.02 0.00 0.00 56.01 54.53 1hkx n LEU 392 Cb 0.00 -0.15 0.02 0.00 -1.62 0.00 0.00 43.42 41.67 1hkx n LEU 392 CO 0.00 0.62 0.90 -0.78 -1.22 0.00 0.00 177.39 176.91 1hkx h ASP 393 N 3.63 0.86 0.25 -1.43 1.82 -1.95 -3.11 116.42 116.48 1hkx h ASP 393 Ca 0.00 -0.24 -0.04 0.00 -0.39 0.00 0.00 57.03 56.36 1hkx h ASP 393 Cb 0.83 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.61 1hkx h ASP 393 CO 0.00 0.88 -0.19 0.15 -1.61 0.00 0.00 179.24 178.46 1hkx h PHE 394 N 0.81 0.00 0.00 0.28 3.04 -1.83 -2.83 116.94 116.40 1hkx h PHE 394 Ca 0.18 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.13 1hkx h PHE 394 Cb 0.36 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.87 1hkx h PHE 394 CO 0.03 0.19 -0.34 0.45 -2.02 0.00 0.00 178.31 176.61 1hkx h HIS 395 N 0.00 0.00 -0.31 0.41 -0.00 -1.86 -3.35 115.15 110.04 1hkx h HIS 395 Ca -0.00 0.00 0.07 0.00 -0.00 0.00 0.00 60.37 60.44 1hkx h HIS 395 Cb 0.37 0.00 -0.08 0.00 -0.00 0.00 0.00 27.41 27.70 1hkx h HIS 395 CO 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 177.93 177.65 1hkx h ARG 396 N 0.00 -0.25 -1.26 2.45 3.08 -1.49 -1.48 114.38 115.44 1hkx h ARG 396 Ca 0.00 0.02 0.43 0.00 0.07 0.00 0.00 59.98 60.49 1hkx h ARG 396 Cb 0.88 0.06 -0.14 0.00 0.08 0.00 0.00 29.97 30.85 1hkx h ARG 396 CO 0.00 -0.16 0.80 0.35 -1.07 0.00 0.00 179.97 179.88 1hkx h PHE 397 N -0.26 0.59 0.00 3.04 3.57 -1.75 0.45 116.94 122.58 1hkx h PHE 397 Ca 0.15 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1hkx h PHE 397 Cb 0.50 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.10 1hkx h PHE 397 CO -0.46 -0.24 0.00 1.88 -2.23 0.00 0.00 178.31 177.26 1hkx h TYR 398 N 0.09 0.00 -0.19 0.41 -1.99 -1.53 -2.66 116.97 111.11 1hkx h TYR 398 Ca 0.82 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.55 1hkx h TYR 398 Cb 2.48 0.00 0.00 0.00 2.00 0.00 0.00 36.73 41.21 1hkx h TYR 398 CO -0.01 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.34 1hkx n PHE 399 N -3.02 0.24 0.00 4.88 3.01 0.16 -3.59 117.46 119.14 1hkx n PHE 399 Ca 0.04 -0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1hkx n PHE 399 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1hkx n PHE 399 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1hkx n GLU 400 N 0.35 0.00 0.25 -1.08 1.02 -1.08 -4.85 120.64 115.24 1hkx n GLU 400 Ca 0.16 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.43 1hkx n GLU 400 Cb 0.33 -0.06 0.57 0.00 -0.02 0.00 0.00 31.44 32.25 1hkx n GLU 400 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1hkx h ASN 401 N 0.00 0.00 -2.14 1.62 2.35 -1.71 -3.39 115.58 112.31 1hkx h ASN 401 Ca 0.00 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 55.10 1hkx h ASN 401 Cb 0.00 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.22 1hkx h ASN 401 CO 0.00 0.10 0.95 -0.22 -1.65 0.00 0.00 177.43 176.61 1hkx s LEU 402 N -6.46 4.43 -0.44 1.61 0.20 -1.24 -4.84 118.68 111.94 1hkx s LEU 402 Ca 0.01 -1.59 0.08 0.00 0.69 0.00 0.00 54.13 53.32 1hkx s LEU 402 Cb 0.09 -2.45 0.40 0.00 -0.43 0.00 0.00 46.19 43.80 1hkx s LEU 402 CO 0.59 -1.29 1.00 0.79 -0.29 0.00 0.00 176.35 177.15 1hkx n TRP 403 N 7.52 2.79 1.03 5.38 5.03 -1.26 -4.71 117.44 133.22 1hkx n TRP 403 Ca 0.19 -3.34 0.11 0.00 3.03 0.00 0.00 57.50 57.50 1hkx n TRP 403 Cb 0.49 -0.27 0.03 0.00 -1.03 0.00 0.00 31.31 30.52 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 -0.26 1.68 -0.04 -0.99 7.64 -1.26 -3.55 113.62 116.84 1hkx n SER 404 Ca 0.30 -1.31 0.03 0.00 1.01 0.00 0.00 58.87 58.89 1hkx n SER 404 Cb 0.63 0.53 -0.15 0.00 -1.01 0.00 0.00 64.21 64.20 1hkx n SER 404 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1hkx n ARG 405 N -0.41 0.73 -0.03 1.43 1.74 -1.25 -2.43 116.66 116.44 1hkx n ARG 405 Ca 0.09 -0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1hkx n ARG 405 Cb 0.43 -1.48 0.01 0.00 -1.02 0.00 0.00 32.46 30.40 1hkx n ARG 405 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1hkx n ASN 406 N -2.39 0.70 -0.16 0.55 5.15 -1.23 -3.55 115.26 114.33 1hkx n ASN 406 Ca -0.14 -2.02 0.00 0.00 -0.60 0.00 0.00 54.58 51.82 1hkx n ASN 406 Cb 0.74 -0.28 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 1hkx n ASN 406 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1hkx n SER 407 N -0.18 0.00 -3.15 1.20 3.41 -1.26 -5.07 113.62 108.57 1hkx n SER 407 Ca 0.01 -0.35 0.05 0.00 -0.26 0.00 0.00 58.87 58.32 1hkx n SER 407 Cb 0.16 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.11 1hkx n SER 407 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1hkx s LYS 408 N 0.00 0.25 0.43 4.33 2.36 -1.02 -5.03 119.74 121.06 1hkx s LYS 408 Ca 0.00 0.32 -0.23 0.00 -2.55 0.00 0.00 55.97 53.50 1hkx s LYS 408 Cb 0.00 0.16 -0.11 0.00 -1.05 0.00 0.00 37.83 36.83 1hkx s LYS 408 CO 0.00 -0.39 0.88 -2.30 1.55 0.00 0.00 175.35 175.10 1hkx n PRO 409 N 5.29 1.10 -3.85 4.03 -0.02 -1.26 -3.96 135.00 136.32 1hkx n PRO 409 Ca 0.03 0.40 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1hkx n PRO 409 Cb 0.55 -1.90 -0.14 0.00 -0.02 0.00 0.00 33.50 32.00 1hkx n PRO 409 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1hkx s VAL 410 N -1.33 -0.01 -0.08 -1.45 -7.23 -1.26 -4.39 120.40 104.64 1hkx s VAL 410 Ca 0.64 0.03 -0.00 0.00 -1.81 0.00 0.00 61.98 60.84 1hkx s VAL 410 Cb -0.57 -0.04 -0.03 0.00 0.56 0.00 0.00 36.38 36.31 1hkx s VAL 410 CO 0.56 0.01 -0.06 -2.28 -0.31 0.00 0.00 175.10 173.02 1hkx s HIS 411 N 0.15 2.96 -0.01 2.82 2.46 -0.72 -4.97 115.29 117.97 1hkx s HIS 411 Ca -0.01 -0.04 0.07 0.00 0.47 0.00 0.00 55.06 55.56 1hkx s HIS 411 Cb -0.02 -1.75 -0.02 0.00 -0.13 0.00 0.00 32.58 30.65 1hkx s HIS 411 CO -0.00 0.27 -0.23 0.99 -2.47 0.00 0.00 174.74 173.29 1hkx s THR 412 N -0.61 2.32 0.00 0.89 2.01 -1.26 -0.85 115.64 118.15 1hkx s THR 412 Ca 0.09 -1.09 0.06 0.00 0.31 0.00 0.00 61.69 61.06 1hkx s THR 412 Cb -0.12 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.52 1hkx s THR 412 CO 0.02 0.53 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.41 1hkx s THR 413 N -0.69 1.40 -0.14 -0.82 2.01 -0.60 -5.02 115.64 111.79 1hkx s THR 413 Ca 0.11 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.22 1hkx s THR 413 Cb -0.10 -1.19 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 1hkx s THR 413 CO 0.00 0.31 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.53 1hkx s ILE 414 N -0.54 3.53 0.11 1.82 1.01 -1.26 -1.74 121.20 124.14 1hkx s ILE 414 Ca 0.06 -0.49 0.10 0.00 0.00 0.00 0.00 60.65 60.32 1hkx s ILE 414 Cb -0.07 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1hkx s ILE 414 CO 0.00 0.52 -0.25 -0.76 0.00 0.00 0.00 174.94 174.44 1hkx s LEU 415 N 0.25 2.30 -1.48 2.97 1.43 -0.51 -4.81 118.68 118.83 1hkx s LEU 415 Ca -0.05 -0.72 -0.03 0.00 -1.03 0.00 0.00 54.13 52.30 1hkx s LEU 415 Cb -0.15 -1.14 0.00 0.00 0.03 0.00 0.00 46.19 44.94 1hkx s LEU 415 CO 0.04 0.16 0.17 -3.20 0.23 0.00 0.00 176.35 173.75 1hkx n ASN 416 N 1.05 0.13 -4.76 2.29 5.15 -1.26 -2.48 115.26 115.37 1hkx n ASN 416 Ca -0.18 -1.21 -0.39 0.00 -0.60 0.00 0.00 54.58 52.20 1hkx n ASN 416 Cb 0.53 -2.01 0.02 0.00 -0.53 0.00 0.00 39.78 37.80 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 -7.15 3.46 -0.03 1.20 0.02 -1.26 -4.67 135.00 126.56 1hkx s PRO 417 Ca 0.05 2.23 0.01 0.00 0.02 0.00 0.00 61.00 63.31 1hkx s PRO 417 Cb -0.02 -2.44 0.02 0.00 0.02 0.00 0.00 34.50 32.07 1hkx s PRO 417 CO 0.97 -0.93 -0.03 -1.01 -0.33 0.00 0.00 177.00 175.66 1hkx s HIS 418 N -1.30 0.59 0.10 6.54 3.76 -0.57 -5.00 115.29 119.42 1hkx s HIS 418 Ca 0.66 -0.13 0.10 0.00 -0.15 0.00 0.00 55.06 55.53 1hkx s HIS 418 Cb -0.40 -0.55 -0.04 0.00 1.11 0.00 0.00 32.58 32.71 1hkx s HIS 418 CO 0.49 -0.15 -0.25 0.42 -0.85 0.00 0.00 174.74 174.40 1hkx s ILE 419 N 0.82 2.09 -0.15 0.60 1.01 -1.26 -1.77 121.20 122.53 1hkx s ILE 419 Ca -0.10 -1.59 -0.00 0.00 0.00 0.00 0.00 60.65 58.96 1hkx s ILE 419 Cb -0.13 -1.84 0.03 0.00 0.01 0.00 0.00 42.46 40.53 1hkx s ILE 419 CO -0.00 0.14 -0.09 -1.00 0.00 0.00 0.00 174.94 173.99 1hkx s HIS 420 N -0.99 1.87 -0.29 3.97 3.76 0.12 -4.99 115.29 118.74 1hkx s HIS 420 Ca 0.12 -1.08 -0.18 0.00 -0.15 0.00 0.00 55.06 53.77 1hkx s HIS 420 Cb -0.10 -1.42 -0.02 0.00 1.11 0.00 0.00 32.58 32.15 1hkx s HIS 420 CO 0.04 -0.62 0.50 -0.51 -0.85 0.00 0.00 174.74 173.31 1hkx s LEU 421 N 1.58 4.12 0.00 0.89 2.01 -1.26 -1.19 118.68 124.83 1hkx s LEU 421 Ca 0.03 0.35 0.21 0.00 0.01 0.00 0.00 54.13 54.73 1hkx s LEU 421 Cb -0.14 -2.62 -0.19 0.00 0.01 0.00 0.00 46.19 43.25 1hkx s LEU 421 CO -0.09 -0.33 0.93 0.23 1.01 0.00 0.00 176.35 178.10 1hkx n MET 422 N 5.58 0.23 0.00 1.70 2.81 -0.49 -5.03 117.12 121.92 1hkx n MET 422 Ca -0.05 -0.17 0.00 0.00 -1.81 0.00 0.00 57.70 55.68 1hkx n MET 422 Cb 0.50 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 1hkx n MET 422 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hkx n GLY 423 N 1.48 1.04 0.25 3.03 0.00 -1.14 -4.87 105.19 104.99 1hkx n GLY 423 Ca 0.05 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.87 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 0.00 1.30 -0.00 1.61 8.00 -1.26 -4.42 116.55 121.78 1hkx n ASP 424 Ca 0.00 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.35 1hkx n ASP 424 Cb 0.00 0.55 -0.00 0.00 -0.02 0.00 0.00 41.12 41.65 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 -0.35 6.35 -4.30 -1.24 -0.58 -1.26 -4.93 120.64 114.32 1hkx n GLU 425 Ca 0.05 -0.03 -0.21 0.00 -0.42 0.00 0.00 57.16 56.55 1hkx n GLU 425 Cb 0.26 -0.55 -0.16 0.00 -0.57 0.00 0.00 31.44 30.42 1hkx n GLU 425 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1hkx s SER 426 N -0.98 1.14 0.03 1.62 1.04 -1.26 -0.92 113.70 114.37 1hkx s SER 426 Ca 0.00 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1hkx s SER 426 Cb 0.00 -0.48 -0.02 0.00 0.10 0.00 0.00 66.02 65.62 1hkx s SER 426 CO 0.02 -0.01 -0.04 0.00 0.98 0.00 0.00 173.24 174.19 1hkx s ALA 427 N 0.66 0.28 -0.07 5.32 0.00 0.70 -1.40 121.76 127.26 1hkx s ALA 427 Ca -0.10 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.17 1hkx s ALA 427 Cb -0.13 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.14 1hkx s ALA 427 CO 0.01 -0.15 -0.09 0.00 0.00 0.00 0.00 175.76 175.54 1hkx s ILE 429 N 0.95 1.40 -0.08 0.00 2.07 0.53 -0.70 121.20 125.37 1hkx s ILE 429 Ca -0.10 -0.65 0.04 0.00 -1.41 0.00 0.00 60.65 58.54 1hkx s ILE 429 Cb -0.15 -1.25 0.00 0.00 0.13 0.00 0.00 42.46 41.20 1hkx s ILE 429 CO 0.00 0.41 -0.21 0.00 -1.91 0.00 0.00 174.94 173.24 1hkx s ALA 430 N 0.50 1.94 0.15 1.50 0.00 -0.73 -0.47 121.76 124.65 1hkx s ALA 430 Ca -0.14 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 50.77 1hkx s ALA 430 Cb -0.16 -0.72 0.05 0.00 0.00 0.00 0.00 23.12 22.29 1hkx s ALA 430 CO 0.05 0.27 0.53 1.52 0.00 0.00 0.00 175.76 178.13 1hkx s TYR 431 N 0.33 -0.39 0.04 0.00 -0.85 -0.74 -1.51 117.35 114.23 1hkx s TYR 431 Ca -0.15 0.13 -0.20 0.00 -0.52 0.00 0.00 57.07 56.33 1hkx s TYR 431 Cb -0.17 0.45 -0.06 0.00 0.38 0.00 0.00 41.96 42.56 1hkx s TYR 431 CO 0.07 -0.81 0.59 0.42 -1.52 0.00 0.00 175.55 174.30 1hkx s ILE 432 N -3.78 4.82 -0.29 -3.49 -1.09 -1.04 -0.98 121.20 115.36 1hkx s ILE 432 Ca 0.02 1.24 0.03 0.00 -2.23 0.00 0.00 60.65 59.72 1hkx s ILE 432 Cb -0.00 -3.92 0.07 0.00 -1.58 0.00 0.00 42.46 37.03 1hkx s ILE 432 CO -0.12 0.48 -0.06 -0.60 -1.23 0.00 0.00 174.94 173.42 1hkx s ARG 433 N -0.63 1.99 -0.01 2.79 3.52 0.31 -1.43 118.95 125.49 1hkx s ARG 433 Ca 0.30 -1.51 -0.15 0.00 -0.13 0.00 0.00 55.73 54.24 1hkx s ARG 433 Cb -0.19 -2.99 -0.06 0.00 -1.56 0.00 0.00 34.95 30.16 1hkx s ARG 433 CO 0.18 -0.69 0.41 0.42 -0.81 0.00 0.00 175.30 174.81 1hkx s ILE 434 N 1.04 5.05 -0.06 4.11 -1.09 -0.71 -2.58 121.20 126.97 1hkx s ILE 434 Ca -0.03 0.83 0.01 0.00 -2.23 0.00 0.00 60.65 59.24 1hkx s ILE 434 Cb -0.20 -3.71 0.02 0.00 -1.58 0.00 0.00 42.46 36.99 1hkx s ILE 434 CO -0.06 0.56 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.24 1hkx s THR 435 N -0.91 0.80 -0.38 2.92 2.01 -0.04 -1.56 115.64 118.49 1hkx s THR 435 Ca 0.24 -0.28 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 1hkx s THR 435 Cb -0.16 -0.78 0.07 0.00 0.01 0.00 0.00 72.50 71.63 1hkx s THR 435 CO 0.13 0.29 0.18 -1.10 -0.69 0.00 0.00 174.62 173.42 1hkx s GLN 436 N 0.85 2.52 0.40 4.92 -0.21 -0.03 -1.09 119.66 127.03 1hkx s GLN 436 Ca -0.12 -1.39 0.07 0.00 0.02 0.00 0.00 55.36 53.94 1hkx s GLN 436 Cb -0.15 -3.61 -0.06 0.00 1.00 0.00 0.00 33.01 30.20 1hkx s GLN 436 CO 0.01 -0.85 0.15 1.52 -2.12 0.00 0.00 175.29 174.00 1hkx s TYR 437 N 1.37 2.60 0.00 0.91 -0.85 -0.97 -1.75 117.35 118.65 1hkx s TYR 437 Ca 0.02 -0.58 0.00 0.00 -0.52 0.00 0.00 57.07 55.99 1hkx s TYR 437 Cb -0.21 -1.89 0.00 0.00 0.38 0.00 0.00 41.96 40.23 1hkx s TYR 437 CO 0.01 0.24 0.00 -0.11 -1.52 0.00 0.00 175.55 174.18 1hkx n LEU 438 N -1.18 1.00 0.00 -3.49 -0.00 -1.26 -1.45 117.00 110.62 1hkx n LEU 438 Ca -0.02 0.08 0.00 0.00 -0.00 0.00 0.00 56.01 56.07 1hkx n LEU 438 Cb 0.65 -0.16 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 1hkx n LEU 438 CO 0.46 -0.16 0.00 0.47 -0.00 0.00 0.00 177.39 178.16 1hkx n ASP 439 N -1.41 0.00 0.00 1.96 8.00 -1.26 -3.31 116.55 120.54 1hkx n ASP 439 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1hkx n ASP 439 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 -3.00 0.00 0.00 2.24 0.00 -1.26 -0.83 120.51 117.66 1hkx n ALA 440 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1hkx n ALA 440 Cb 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 -2.00 0.07 0.00 0.00 0.00 -1.26 -4.99 105.19 97.00 1hkx n GLY 441 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.94 3.75 -0.02 0.00 -0.01 -5.10 105.19 104.75 1hkx n GLY 442 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.29 4.68 -0.08 -0.61 1.01 -1.22 -4.36 121.20 119.34 1hkx s ILE 443 Ca 0.00 1.61 -0.38 0.00 0.00 0.00 0.00 60.65 61.89 1hkx s ILE 443 Cb 0.00 -4.10 -0.16 0.00 0.01 0.00 0.00 42.46 38.21 1hkx s ILE 443 CO 0.00 0.40 1.57 -2.65 0.00 0.00 0.00 174.94 174.26 1hkx n PRO 444 N 2.57 1.30 -4.38 2.79 -0.02 -1.21 -4.48 135.00 131.58 1hkx n PRO 444 Ca -0.03 0.47 -0.19 0.00 -2.02 0.00 0.00 63.50 61.72 1hkx n PRO 444 Cb 0.50 -2.16 -0.10 0.00 -0.02 0.00 0.00 33.50 31.72 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 2.08 1.41 -0.05 -0.52 0.52 -0.53 -5.02 118.95 116.85 1hkx s ARG 445 Ca 0.91 -1.66 0.04 0.00 -0.52 0.00 0.00 55.73 54.50 1hkx s ARG 445 Cb -0.96 -1.15 -0.00 0.00 0.52 0.00 0.00 34.95 33.35 1hkx s ARG 445 CO 0.55 0.14 -0.17 0.99 0.02 0.00 0.00 175.30 176.83 1hkx s THR 446 N -2.97 1.44 0.04 0.02 2.01 -1.26 -2.29 115.64 112.63 1hkx s THR 446 Ca 0.25 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.63 1hkx s THR 446 Cb 0.01 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1hkx s THR 446 CO 0.09 0.42 -0.26 0.00 -0.69 0.00 0.00 174.62 174.17 1hkx s ALA 447 N 0.08 2.22 0.34 7.40 0.00 -0.25 -4.96 121.76 126.59 1hkx s ALA 447 Ca -0.05 -1.26 0.10 0.00 0.00 0.00 0.00 51.96 50.75 1hkx s ALA 447 Cb -0.12 -0.47 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 1hkx s ALA 447 CO 0.02 0.53 -0.09 -1.14 0.00 0.00 0.00 175.76 175.08 1hkx s GLN 448 N -1.22 1.84 0.00 0.00 0.74 -1.26 -0.86 119.66 118.90 1hkx s GLN 448 Ca 0.11 -1.90 0.00 0.00 0.05 0.00 0.00 55.36 53.62 1hkx s GLN 448 Cb -0.10 -1.74 0.00 0.00 1.10 0.00 0.00 33.01 32.27 1hkx s GLN 448 CO 0.02 0.16 0.00 -1.13 -0.55 0.00 0.00 175.29 173.79 1hkx n SER 449 N -0.80 0.00 -4.81 6.67 3.41 -1.06 -4.13 113.62 112.90 1hkx n SER 449 Ca -0.05 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.21 1hkx n SER 449 Cb 0.63 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.51 1hkx n SER 449 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1hkx s GLU 450 N -1.53 3.25 0.05 4.33 1.03 -0.45 0.11 118.70 125.50 1hkx s GLU 450 Ca 0.00 -0.28 0.05 0.00 0.03 0.00 0.00 54.97 54.77 1hkx s GLU 450 Cb 0.00 -3.02 -0.03 0.00 -0.80 0.00 0.00 34.13 30.28 1hkx s GLU 450 CO 0.00 0.73 -0.14 -1.21 -1.33 0.00 0.00 175.26 173.31 1hkx s GLU 451 N -1.17 0.88 -0.04 -4.83 2.02 -0.15 -1.36 118.70 114.04 1hkx s GLU 451 Ca 0.17 -0.85 0.06 0.00 0.02 0.00 0.00 54.97 54.37 1hkx s GLU 451 Cb -0.12 -0.89 -0.01 0.00 0.10 0.00 0.00 34.13 33.21 1hkx s GLU 451 CO 0.06 0.21 -0.22 0.99 0.02 0.00 0.00 175.26 176.32 1hkx s THR 452 N -1.05 1.81 -0.08 3.63 2.01 -0.35 -1.79 115.64 119.82 1hkx s THR 452 Ca -0.00 -0.95 -0.01 0.00 0.31 0.00 0.00 61.69 61.04 1hkx s THR 452 Cb -0.09 -1.52 0.03 0.00 0.01 0.00 0.00 72.50 70.92 1hkx s THR 452 CO 0.02 0.51 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.30 1hkx s ARG 453 N -0.25 0.95 -0.28 4.92 1.81 0.38 -1.99 118.95 124.50 1hkx s ARG 453 Ca 0.01 -0.04 -0.08 0.00 -1.72 0.00 0.00 55.73 53.90 1hkx s ARG 453 Cb -0.11 -1.16 -0.01 0.00 -0.45 0.00 0.00 34.95 33.21 1hkx s ARG 453 CO 0.02 -0.26 0.09 0.08 -0.68 0.00 0.00 175.30 174.54 1hkx s VAL 454 N 1.75 4.25 -0.12 3.52 1.01 0.16 -0.35 120.40 130.61 1hkx s VAL 454 Ca 0.03 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1hkx s VAL 454 Cb -0.13 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1hkx s VAL 454 CO -0.05 0.20 0.07 0.26 0.00 0.00 0.00 175.10 175.57 1hkx s TRP 455 N 1.58 3.34 -0.02 5.22 0.52 0.37 -0.76 118.94 129.18 1hkx s TRP 455 Ca 0.05 0.28 0.01 0.00 0.02 0.00 0.00 56.10 56.46 1hkx s TRP 455 Cb -0.16 -1.92 0.01 0.00 -1.15 0.00 0.00 33.47 30.25 1hkx s TRP 455 CO 0.04 0.48 -0.05 -1.58 0.02 0.00 0.00 176.95 175.86 1hkx s HIS 456 N -0.60 0.59 -0.13 -1.98 2.46 0.21 -0.21 115.29 115.62 1hkx s HIS 456 Ca 0.11 -0.13 -0.03 0.00 0.47 0.00 0.00 55.06 55.49 1hkx s HIS 456 Cb -0.12 -0.48 -0.03 0.00 -0.13 0.00 0.00 32.58 31.82 1hkx s HIS 456 CO 0.02 -0.10 -0.03 0.50 -2.47 0.00 0.00 174.74 172.67 1hkx s ARG 457 N 0.43 3.39 0.00 2.88 3.52 -0.10 -0.00 118.95 129.07 1hkx s ARG 457 Ca -0.05 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 55.06 1hkx s ARG 457 Cb -0.09 -2.85 0.00 0.00 -1.56 0.00 0.00 34.95 30.46 1hkx s ARG 457 CO -0.00 0.41 0.00 0.54 -0.81 0.00 0.00 175.30 175.44 1hkx n ARG 458 N 3.02 0.00 -1.73 5.12 1.74 -0.81 -4.85 116.66 119.15 1hkx n ARG 458 Ca -0.18 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.49 1hkx n ARG 458 Cb 0.53 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.96 1hkx n ARG 458 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1hkx n ASP 459 N 0.00 4.63 0.00 0.55 5.75 -1.26 -4.48 116.55 121.74 1hkx n ASP 459 Ca 0.00 -2.83 0.00 0.00 -0.01 0.00 0.00 54.79 51.95 1hkx n ASP 459 Cb 0.00 -1.63 0.00 0.00 -1.03 0.00 0.00 41.12 38.46 1hkx n ASP 459 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hkx n GLY 460 N 3.90 2.81 3.67 6.12 0.00 -1.26 -5.01 105.19 115.41 1hkx n GLY 460 Ca 0.54 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.22 1hkx n GLY 460 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hkx s LYS 461 N -0.10 2.89 0.03 1.61 2.20 -1.26 -5.10 119.74 120.00 1hkx s LYS 461 Ca 0.00 -0.49 -0.21 0.00 -0.36 0.00 0.00 55.97 54.91 1hkx s LYS 461 Cb 0.00 -2.72 -0.06 0.00 -1.51 0.00 0.00 37.83 33.54 1hkx s LYS 461 CO 0.00 0.67 0.63 -1.58 -0.36 0.00 0.00 175.35 174.71 1hkx s TRP 462 N -0.94 3.73 0.04 4.03 0.52 -1.26 -1.93 118.94 123.12 1hkx s TRP 462 Ca 0.15 1.28 0.01 0.00 0.02 0.00 0.00 56.10 57.56 1hkx s TRP 462 Cb -0.11 -2.63 -0.02 0.00 -1.15 0.00 0.00 33.47 29.56 1hkx s TRP 462 CO 0.05 0.40 -0.06 -0.65 0.02 0.00 0.00 176.95 176.70 1hkx s GLN 463 N -0.40 0.46 -0.03 4.98 -0.21 1.00 -4.76 119.66 120.70 1hkx s GLN 463 Ca 0.32 -0.73 -0.22 0.00 0.02 0.00 0.00 55.36 54.76 1hkx s GLN 463 Cb -0.19 -0.14 -0.05 0.00 1.00 0.00 0.00 33.01 33.63 1hkx s GLN 463 CO 0.19 0.01 0.63 0.96 -2.12 0.00 0.00 175.29 174.96 1hkx s ILE 464 N -1.51 4.95 -0.07 1.08 -4.36 -0.09 0.64 121.20 121.84 1hkx s ILE 464 Ca -0.11 1.31 0.21 0.00 -0.26 0.00 0.00 60.65 61.79 1hkx s ILE 464 Cb -0.09 -3.97 -0.31 0.00 1.25 0.00 0.00 42.46 39.33 1hkx s ILE 464 CO -0.00 0.36 0.47 1.33 0.24 0.00 0.00 174.94 177.33 1hkx n VAL 465 N 3.11 0.00 -3.59 8.37 0.24 0.07 -2.24 118.33 124.28 1hkx n VAL 465 Ca -0.05 -0.45 -0.13 0.00 -2.04 0.00 0.00 64.34 61.67 1hkx n VAL 465 Cb 0.51 0.07 -0.06 0.00 -1.47 0.00 0.00 33.84 32.89 1hkx n VAL 465 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1hkx s HIS 466 N -3.40 -0.60 -0.03 6.34 5.65 -1.22 -1.23 115.29 120.80 1hkx s HIS 466 Ca -0.07 1.27 -0.09 0.00 0.25 0.00 0.00 55.06 56.43 1hkx s HIS 466 Cb 0.13 0.37 0.01 0.00 -1.18 0.00 0.00 32.58 31.91 1hkx s HIS 466 CO 0.85 -0.40 0.19 -0.59 -0.65 0.00 0.00 174.74 174.14 1hkx s PHE 467 N -0.39 -0.09 -0.09 3.88 -0.12 -0.74 -0.67 117.98 119.76 1hkx s PHE 467 Ca -0.03 0.16 -0.00 0.00 -0.05 0.00 0.00 56.93 57.01 1hkx s PHE 467 Cb -0.03 0.02 0.02 0.00 -0.63 0.00 0.00 43.02 42.40 1hkx s PHE 467 CO 0.02 -0.25 -0.07 -1.58 -0.05 0.00 0.00 175.22 173.29 1hkx s HIS 468 N -0.89 1.30 0.08 3.49 2.46 -0.84 -1.52 115.29 119.37 1hkx s HIS 468 Ca -0.10 -0.58 0.07 0.00 0.47 0.00 0.00 55.06 54.92 1hkx s HIS 468 Cb -0.05 -1.10 -0.04 0.00 -0.13 0.00 0.00 32.58 31.26 1hkx s HIS 468 CO 0.02 -0.42 -0.15 0.50 -2.47 0.00 0.00 174.74 172.22 1hkx s ARG 469 N 1.51 2.03 -0.05 2.88 3.52 0.90 -1.21 118.95 128.53 1hkx s ARG 469 Ca 0.01 -1.04 0.01 0.00 -0.13 0.00 0.00 55.73 54.58 1hkx s ARG 469 Cb -0.13 -2.23 0.02 0.00 -1.56 0.00 0.00 34.95 31.05 1hkx s ARG 469 CO -0.05 0.52 -0.06 -1.12 -0.81 0.00 0.00 175.30 173.77 1hkx s SER 470 N -1.90 1.12 0.00 -2.12 0.01 -0.47 -4.31 113.70 106.03 1hkx s SER 470 Ca 0.18 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.27 1hkx s SER 470 Cb -0.11 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.59 1hkx s SER 470 CO 0.10 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1hkx n GLY 471 N 4.00 1.31 0.00 3.44 0.00 -1.26 -1.34 105.19 111.34 1hkx n GLY 471 Ca -0.24 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 -1.00 4.61 0.00 -1.26 -4.88 120.51 116.98 1hkx n ALA 472 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1hkx n ALA 472 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 -3.90 0.00 -0.02 -1.26 -5.04 135.00 124.78 1hkx n PRO 473 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.39 1hkx n PRO 473 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.43 1hkx n PRO 473 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1hkx s SER 474 N -1.12 -0.09 0.00 2.55 0.15 -1.26 -5.05 113.70 108.88 1hkx s SER 474 Ca 0.00 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.89 1hkx s SER 474 Cb 0.00 0.52 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 1hkx s SER 474 CO 0.00 -1.02 0.00 0.55 1.20 0.00 0.00 173.24 173.97