#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f9k h MET 348 N 0.00 0.31 -0.96 -1.46 1.85 -2.04 -2.75 114.93 109.88 3f9k h MET 348 Ca 0.00 -0.52 0.03 0.00 -0.61 0.00 0.00 59.70 58.60 3f9k h MET 348 Cb 0.00 0.20 -0.05 0.00 0.43 0.00 0.00 31.60 32.17 3f9k h MET 348 CO 0.00 1.21 0.63 -0.44 -0.40 0.00 0.00 176.91 177.91 3f9k h ASP 349 N 0.08 1.05 0.83 1.39 5.19 -1.99 -0.19 116.42 122.79 3f9k h ASP 349 Ca -0.22 -0.01 -0.24 0.00 -0.62 0.00 0.00 57.03 55.94 3f9k h ASP 349 Cb 2.03 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 41.27 3f9k h ASP 349 CO 0.19 0.73 -1.17 0.77 -3.12 0.00 0.00 179.24 176.64 3f9k h SER 350 N 1.22 0.10 -0.45 6.45 4.64 -2.00 -2.46 113.55 121.05 3f9k h SER 350 Ca 0.38 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 3f9k h SER 350 Cb -0.01 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3f9k h SER 350 CO -0.11 1.09 0.18 -0.09 -0.87 0.00 0.00 176.83 177.03 3f9k h ARG 351 N 0.02 0.73 0.05 4.77 1.12 -1.14 -1.40 114.38 118.53 3f9k h ARG 351 Ca -0.08 -0.11 -0.22 0.00 -1.11 0.00 0.00 59.98 58.46 3f9k h ARG 351 Cb 1.85 -0.13 0.02 0.00 -0.01 0.00 0.00 29.97 31.70 3f9k h ARG 351 CO 0.14 0.62 -0.88 -0.07 -3.11 0.00 0.00 179.97 176.67 3f9k h LEU 352 N 0.72 0.68 -1.04 3.80 3.38 -1.05 -2.80 115.31 119.00 3f9k h LEU 352 Ca 0.17 -0.80 0.08 0.00 0.09 0.00 0.00 57.88 57.42 3f9k h LEU 352 Cb 0.18 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 3f9k h LEU 352 CO -0.01 1.40 0.63 1.56 0.09 0.00 0.00 178.44 182.12 3f9k h GLN 353 N 0.04 1.07 -0.43 1.13 4.20 -1.33 0.14 115.11 119.93 3f9k h GLN 353 Ca -0.12 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 3f9k h GLN 353 Cb 1.59 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 29.10 3f9k h GLN 353 CO 0.17 0.71 0.27 -0.09 -0.67 0.00 0.00 178.83 179.22 3f9k h ARG 354 N 1.10 0.58 -0.13 1.46 2.43 -1.26 -0.75 114.38 117.82 3f9k h ARG 354 Ca 0.44 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 3f9k h ARG 354 Cb 0.25 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3f9k h ARG 354 CO -0.19 0.42 0.03 0.82 -1.51 0.00 0.00 179.97 179.54 3f9k h ILE 355 N 0.57 1.21 -0.29 1.20 2.04 -1.09 -0.74 117.51 120.42 3f9k h ILE 355 Ca 0.16 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.41 3f9k h ILE 355 Cb -0.02 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 3f9k h ILE 355 CO -0.03 0.19 0.02 -0.74 0.00 0.00 0.00 178.15 177.59 3f9k h HIS 356 N 0.01 0.02 -0.71 1.37 2.76 -0.87 -0.54 115.15 117.19 3f9k h HIS 356 Ca 0.04 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.28 3f9k h HIS 356 Cb 0.27 0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.21 3f9k h HIS 356 CO 0.01 -0.02 0.41 0.00 -1.30 0.00 0.00 177.93 177.03 3f9k h ALA 357 N 1.24 0.95 -0.40 5.26 0.00 -1.09 -1.29 119.26 123.93 3f9k h ALA 357 Ca 0.14 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.12 3f9k h ALA 357 Cb 0.17 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 3f9k h ALA 357 CO -0.21 0.12 -0.01 0.93 0.00 0.00 0.00 179.25 180.08 3f9k h GLU 358 N 0.77 0.09 0.39 0.00 4.39 -0.16 -0.05 114.58 120.01 3f9k h GLU 358 Ca 0.31 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.98 3f9k h GLU 358 Cb 0.15 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3f9k h GLU 358 CO -0.16 0.06 -0.19 0.82 -1.16 0.00 0.00 179.01 178.38 3f9k h ILE 359 N 0.09 0.61 -0.47 3.13 2.04 -0.53 -2.52 117.51 119.86 3f9k h ILE 359 Ca 0.19 -0.01 0.08 0.00 1.00 0.00 0.00 64.86 66.13 3f9k h ILE 359 Cb 0.28 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 3f9k h ILE 359 CO -0.34 0.00 0.05 0.11 0.00 0.00 0.00 178.15 177.98 3f9k h LYS 360 N -0.54 0.17 0.00 2.37 6.56 -1.03 -2.66 116.57 121.44 3f9k h LYS 360 Ca -0.05 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.49 3f9k h LYS 360 Cb 0.41 -0.04 -0.00 0.00 -0.57 0.00 0.00 32.23 32.03 3f9k h LYS 360 CO 0.09 0.11 -0.15 -0.91 -2.06 0.00 0.00 179.45 176.53 3f9k h ASN 361 N 0.18 0.00 0.06 0.86 2.35 -0.85 -1.46 115.58 116.71 3f9k h ASN 361 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3f9k h ASN 361 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 3f9k h ASN 361 CO -0.35 0.15 -0.05 -1.54 -1.65 0.00 0.00 177.43 173.99 3f9k n SER 362 N -3.77 1.18 -0.01 5.81 3.41 -0.96 -3.83 113.62 115.45 3f9k n SER 362 Ca -0.02 -1.27 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 3f9k n SER 362 Cb 0.26 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 3f9k n SER 362 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3f9k n LEU 363 N -0.18 1.85 -4.74 1.04 4.77 -0.57 -0.96 117.00 118.21 3f9k n LEU 363 Ca 0.18 -1.84 -0.42 0.00 -0.03 0.00 0.00 56.01 53.90 3f9k n LEU 363 Cb 0.32 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.40 3f9k n LEU 363 CO 0.19 0.46 1.11 0.29 -1.33 0.00 0.00 177.39 178.11 3f9k n LYS 364 N -0.41 2.53 0.26 3.23 4.76 -1.05 -4.88 118.16 122.59 3f9k n LYS 364 Ca 0.00 0.89 0.08 0.00 -2.87 0.00 0.00 58.31 56.41 3f9k n LYS 364 Cb 0.21 -2.60 0.64 0.00 -1.84 0.00 0.00 35.03 31.45 3f9k n LYS 364 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3f9k h ILE 365 N 2.98 0.99 -0.72 -0.18 2.04 -1.95 -0.84 117.51 119.83 3f9k h ILE 365 Ca -0.48 -0.05 -0.36 0.00 1.00 0.00 0.00 64.86 64.97 3f9k h ILE 365 Cb 1.25 1.03 -0.22 0.00 -0.74 0.00 0.00 36.82 38.14 3f9k h ILE 365 CO 0.69 0.01 0.34 -0.90 0.00 0.00 0.00 178.15 178.29 3f9k n ASP 366 N -4.49 3.32 -2.68 1.72 5.75 -1.26 -4.59 116.55 114.32 3f9k n ASP 366 Ca -0.03 -3.65 -0.05 0.00 -0.01 0.00 0.00 54.79 51.06 3f9k n ASP 366 Cb 0.10 -0.75 0.09 0.00 -1.03 0.00 0.00 41.12 39.53 3f9k n ASP 366 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3f9k n ASN 367 N -1.07 -1.52 -4.65 -1.12 2.85 -0.33 -5.13 115.26 104.29 3f9k n ASN 367 Ca 0.48 -2.14 -0.43 0.00 -0.11 0.00 0.00 54.58 52.38 3f9k n ASN 367 Cb 1.40 1.11 -0.02 0.00 1.24 0.00 0.00 39.78 43.51 3f9k n ASN 367 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 3f9k s LEU 368 N -0.80 4.04 -0.58 1.20 2.96 -1.16 -4.03 118.68 120.31 3f9k s LEU 368 Ca 0.24 1.26 0.04 0.00 -0.22 0.00 0.00 54.13 55.45 3f9k s LEU 368 Cb 0.25 -3.53 0.16 0.00 0.50 0.00 0.00 46.19 43.57 3f9k s LEU 368 CO -0.14 -0.74 0.40 -0.62 -1.32 0.00 0.00 176.35 173.93 3f9k s ASP 369 N 1.36 3.79 0.21 3.68 3.68 -0.13 -4.99 116.67 124.27 3f9k s ASP 369 Ca 0.44 -3.44 -0.10 0.00 2.13 0.00 0.00 52.55 51.59 3f9k s ASP 369 Cb -0.14 -1.26 0.29 0.00 -1.45 0.00 0.00 42.92 40.36 3f9k s ASP 369 CO 0.09 -0.14 1.70 0.58 0.13 0.00 0.00 175.17 177.54 3f9k h VAL 370 N 4.65 0.64 -0.43 1.11 2.07 -1.94 -1.64 116.25 120.71 3f9k h VAL 370 Ca 0.14 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 3f9k h VAL 370 Cb 0.83 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3f9k h VAL 370 CO 0.60 0.05 0.15 0.78 0.02 0.00 0.00 177.57 179.17 3f9k h ASN 371 N 0.26 0.61 -0.94 0.57 -0.26 -1.95 -0.08 115.58 113.79 3f9k h ASN 371 Ca 0.31 -0.19 0.14 0.00 -0.56 0.00 0.00 56.30 56.00 3f9k h ASN 371 Cb 0.46 -0.16 -0.09 0.00 -1.06 0.00 0.00 38.32 37.47 3f9k h ASN 371 CO -0.40 0.64 0.55 -0.09 -1.06 0.00 0.00 177.43 177.07 3f9k h ARG 372 N 0.56 0.79 -0.15 0.81 2.43 -1.81 0.47 114.38 117.48 3f9k h ARG 372 Ca 0.14 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3f9k h ARG 372 Cb 0.23 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3f9k h ARG 372 CO -0.01 0.52 -0.03 0.00 -1.51 0.00 0.00 179.97 178.94 3f9k h ILE 374 N -0.02 1.15 -0.63 0.00 2.04 -0.40 -1.04 117.51 118.62 3f9k h ILE 374 Ca 0.04 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.58 3f9k h ILE 374 Cb 0.46 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 37.21 3f9k h ILE 374 CO 0.01 0.16 0.26 -0.33 0.00 0.00 0.00 178.15 178.25 3f9k h GLU 375 N 0.47 0.44 -0.84 2.37 5.08 -0.96 0.19 114.58 121.34 3f9k h GLU 375 Ca 0.13 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3f9k h GLU 375 Cb 0.08 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 3f9k h GLU 375 CO -0.02 0.29 0.48 0.00 -1.00 0.00 0.00 179.01 178.76 3f9k h ALA 376 N 1.42 1.07 -0.59 3.43 0.00 -1.05 -0.78 119.26 122.76 3f9k h ALA 376 Ca 0.32 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3f9k h ALA 376 Cb 0.37 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3f9k h ALA 376 CO -0.29 0.56 0.12 -0.07 0.00 0.00 0.00 179.25 179.57 3f9k h LEU 377 N 1.16 0.90 -0.65 0.00 3.38 -0.11 -2.26 115.31 117.73 3f9k h LEU 377 Ca 0.30 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3f9k h LEU 377 Cb 0.00 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3f9k h LEU 377 CO -0.05 0.92 0.19 0.44 0.09 0.00 0.00 178.44 180.02 3f9k h ASP 378 N 0.85 0.96 0.15 -0.43 3.32 -0.30 0.43 116.42 121.41 3f9k h ASP 378 Ca 0.18 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 3f9k h ASP 378 Cb 0.38 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 3f9k h ASP 378 CO 0.01 0.93 -0.11 -0.08 -1.72 0.00 0.00 179.24 178.27 3f9k h GLU 379 N 0.95 -0.25 -0.97 3.56 4.81 -1.06 -1.88 114.58 119.74 3f9k h GLU 379 Ca 0.21 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.52 3f9k h GLU 379 Cb 0.32 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.69 3f9k h GLU 379 CO -0.00 -0.17 0.63 1.25 -0.73 0.00 0.00 179.01 179.98 3f9k h LEU 380 N -0.26 0.99 -2.34 1.64 5.85 -1.22 -0.46 115.31 119.50 3f9k h LEU 380 Ca -0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3f9k h LEU 380 Cb 0.23 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 3f9k h LEU 380 CO -0.00 0.63 -0.04 0.00 -0.34 0.00 0.00 178.44 178.69 3f9k h ALA 381 N 1.48 1.31 -0.66 1.25 0.00 -0.52 -2.46 119.26 119.66 3f9k h ALA 381 Ca 0.42 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 3f9k h ALA 381 Cb 0.18 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.88 3f9k h ALA 381 CO -0.16 0.05 0.18 -1.13 0.00 0.00 0.00 179.25 178.19 3f9k n SER 382 N -3.59 5.00 -4.48 0.00 3.41 -0.19 -4.94 113.62 108.84 3f9k n SER 382 Ca -0.02 -3.07 -0.33 0.00 -0.26 0.00 0.00 58.87 55.18 3f9k n SER 382 Cb 0.14 -0.72 -0.13 0.00 -0.26 0.00 0.00 64.21 63.24 3f9k n SER 382 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3f9k s LEU 383 N -2.77 2.80 -1.14 1.04 1.43 -0.93 -5.05 118.68 114.07 3f9k s LEU 383 Ca 0.53 -0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 53.23 3f9k s LEU 383 Cb 0.41 -1.58 0.04 0.00 0.03 0.00 0.00 46.19 45.09 3f9k s LEU 383 CO 0.14 0.32 1.66 -1.58 0.23 0.00 0.00 176.35 177.12 3f9k s GLN 384 N -0.59 3.55 -0.41 1.70 2.00 -1.26 -4.95 119.66 119.70 3f9k s GLN 384 Ca 0.08 -1.40 -0.16 0.00 -2.00 0.00 0.00 55.36 51.89 3f9k s GLN 384 Cb -0.11 -5.39 0.02 0.00 0.80 0.00 0.00 33.01 28.32 3f9k s GLN 384 CO 0.01 -2.51 0.34 0.08 -0.50 0.00 0.00 175.29 172.72 3f9k s VAL 385 N 5.74 5.21 0.51 1.34 1.01 -1.26 -5.06 120.40 127.88 3f9k s VAL 385 Ca 0.54 -0.54 -0.20 0.00 0.00 0.00 0.00 61.98 61.77 3f9k s VAL 385 Cb 0.01 -3.96 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 3f9k s VAL 385 CO 0.00 -0.33 1.08 0.42 0.00 0.00 0.00 175.10 176.27 3f9k s THR 386 N 1.83 3.48 0.43 3.92 -4.23 -1.26 -4.85 115.64 114.96 3f9k s THR 386 Ca 0.07 0.93 0.17 0.00 -1.18 0.00 0.00 61.69 61.68 3f9k s THR 386 Cb -0.18 -3.38 0.36 0.00 1.34 0.00 0.00 72.50 70.64 3f9k s THR 386 CO 0.11 -0.19 1.91 -0.03 -0.54 0.00 0.00 174.62 175.88 3f9k h MET 387 N 1.42 0.38 -0.27 3.99 1.85 -1.97 0.59 114.93 120.92 3f9k h MET 387 Ca -0.50 -0.02 -0.13 0.00 -0.61 0.00 0.00 59.70 58.44 3f9k h MET 387 Cb 1.24 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 33.17 3f9k h MET 387 CO 0.58 0.25 -0.39 -0.56 -0.40 0.00 0.00 176.91 176.39 3f9k h GLN 388 N 0.39 0.62 -0.15 0.39 -0.00 -2.00 -0.42 115.11 113.94 3f9k h GLN 388 Ca 0.38 -0.31 -0.02 0.00 -0.00 0.00 0.00 58.65 58.69 3f9k h GLN 388 Cb 0.91 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.39 3f9k h GLN 388 CO -0.12 0.91 0.01 1.96 -0.00 0.00 0.00 178.83 181.58 3f9k h GLN 389 N 0.51 0.26 -0.99 0.06 4.20 -1.55 -3.27 115.11 114.33 3f9k h GLN 389 Ca 0.05 -0.08 0.06 0.00 0.06 0.00 0.00 58.65 58.74 3f9k h GLN 389 Cb 0.90 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.59 3f9k h GLN 389 CO 0.08 0.47 0.64 0.00 -0.67 0.00 0.00 178.83 179.35 3f9k h ALA 390 N 0.77 1.36 -0.99 3.87 0.00 -0.73 -3.20 119.26 120.35 3f9k h ALA 390 Ca 0.04 -0.03 0.22 0.00 0.00 0.00 0.00 54.91 55.14 3f9k h ALA 390 Cb 0.36 -0.31 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 3f9k h ALA 390 CO 0.01 0.44 0.62 1.96 0.00 0.00 0.00 179.25 182.28 3f9k h GLN 391 N 1.17 0.54 -0.08 0.00 4.20 -1.13 -1.43 115.11 118.38 3f9k h GLN 391 Ca 0.42 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 59.07 3f9k h GLN 391 Cb 0.14 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 3f9k h GLN 391 CO -0.17 0.36 -0.08 -0.22 -0.67 0.00 0.00 178.83 178.06 3f9k h LYS 392 N 0.56 0.19 -2.26 1.46 3.11 -1.73 -3.32 116.57 114.58 3f9k h LYS 392 Ca 0.56 -0.10 -0.25 0.00 -2.81 0.00 0.00 60.65 58.05 3f9k h LYS 392 Cb 1.16 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.34 3f9k h LYS 392 CO -0.31 0.62 0.35 0.72 -2.81 0.00 0.00 179.45 178.02 3f9k n HIS 393 N -4.69 0.37 0.23 1.91 -0.00 -0.54 -4.47 115.22 108.02 3f9k n HIS 393 Ca -0.07 -1.61 0.10 0.00 -0.00 0.00 0.00 57.72 56.13 3f9k n HIS 393 Cb 0.31 -1.63 0.53 0.00 -0.00 0.00 0.00 29.99 29.20 3f9k n HIS 393 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3f9k h THR 394 N 2.26 0.66 -0.20 1.59 1.03 -1.67 -2.85 112.91 113.73 3f9k h THR 394 Ca 0.28 -0.99 -0.19 0.00 -0.01 0.00 0.00 66.41 65.50 3f9k h THR 394 Cb 1.19 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.91 3f9k h THR 394 CO 0.50 0.22 -0.64 -0.33 -0.01 0.00 0.00 175.52 175.26 3f9k h GLU 395 N 0.00 0.71 -0.45 0.00 5.08 -1.93 -2.52 114.58 115.47 3f9k h GLU 395 Ca -0.00 -0.50 -0.08 0.00 -1.00 0.00 0.00 59.36 57.78 3f9k h GLU 395 Cb 0.62 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3f9k h GLU 395 CO 0.03 1.12 -0.03 1.98 -1.00 0.00 0.00 179.01 181.11 3f9k h MET 396 N 0.52 0.82 -0.63 2.33 4.05 -1.88 -1.31 114.93 118.83 3f9k h MET 396 Ca -0.01 -0.27 0.08 0.00 -0.28 0.00 0.00 59.70 59.21 3f9k h MET 396 Cb 1.23 -0.07 -0.06 0.00 -0.80 0.00 0.00 31.60 31.91 3f9k h MET 396 CO 0.13 0.89 0.31 0.82 0.23 0.00 0.00 176.91 179.28 3f9k h ILE 397 N 0.66 0.88 -0.10 1.77 2.04 -1.48 -0.33 117.51 120.94 3f9k h ILE 397 Ca 0.12 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.83 3f9k h ILE 397 Cb 0.54 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 3f9k h ILE 397 CO 0.03 0.10 -0.14 0.74 0.00 0.00 0.00 178.15 178.88 3f9k h THR 398 N 0.55 0.64 -0.80 -0.27 2.02 -1.15 -0.22 112.91 113.68 3f9k h THR 398 Ca 0.30 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.60 3f9k h THR 398 Cb 0.28 0.64 -0.08 0.00 -1.74 0.00 0.00 68.15 67.25 3f9k h THR 398 CO -0.24 0.00 0.41 0.74 0.37 0.00 0.00 175.52 176.80 3f9k h THR 399 N -0.18 0.79 0.02 3.16 2.02 -0.52 0.31 112.91 118.51 3f9k h THR 399 Ca 0.08 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 67.05 3f9k h THR 399 Cb 0.29 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3f9k h THR 399 CO -0.21 0.12 -0.07 -0.07 0.37 0.00 0.00 175.52 175.65 3f9k h LEU 400 N 0.63 -0.21 -0.79 2.58 3.38 -0.59 -1.23 115.31 119.08 3f9k h LEU 400 Ca 0.42 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.50 3f9k h LEU 400 Cb 0.52 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 3f9k h LEU 400 CO -0.32 -0.11 0.44 0.50 0.09 0.00 0.00 178.44 179.04 3f9k h LYS 401 N -0.14 0.73 0.10 1.13 3.64 0.10 -2.74 116.57 119.39 3f9k h LYS 401 Ca 0.02 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3f9k h LYS 401 Cb 0.16 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3f9k h LYS 401 CO -0.06 0.48 -0.05 -0.22 -2.27 0.00 0.00 179.45 177.34 3f9k h LYS 402 N 0.75 -0.13 0.00 1.90 3.64 -0.00 -3.09 116.57 119.65 3f9k h LYS 402 Ca 0.38 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 3f9k h LYS 402 Cb 0.34 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3f9k h LYS 402 CO -0.24 -0.04 0.00 0.44 -2.27 0.00 0.00 179.45 177.33 3f9k n ILE 403 N -5.13 0.00 0.32 2.00 -5.35 -0.51 -2.58 119.36 108.12 3f9k n ILE 403 Ca -0.08 0.00 0.19 0.00 -0.27 0.00 0.00 62.75 62.59 3f9k n ILE 403 Cb 0.10 -0.55 1.03 0.00 -1.74 0.00 0.00 39.64 38.48 3f9k n ILE 403 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 3f9k h ARG 404 N 0.00 0.00 -0.27 6.28 3.08 -1.42 -2.02 114.38 120.02 3f9k h ARG 404 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3f9k h ARG 404 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3f9k h ARG 404 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.44 3f9k n ARG 405 N -3.12 2.84 -2.24 0.04 1.74 -1.06 -4.75 116.66 110.10 3f9k n ARG 405 Ca -0.02 -2.27 -0.33 0.00 -0.77 0.00 0.00 57.85 54.46 3f9k n ARG 405 Cb 0.21 -1.43 -0.04 0.00 -1.02 0.00 0.00 32.46 30.17 3f9k n ARG 405 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3f9k s PHE 406 N -1.65 2.23 0.30 -1.55 5.36 -0.76 -4.75 117.98 117.16 3f9k s PHE 406 Ca 0.27 -0.23 0.34 0.00 -0.96 0.00 0.00 56.93 56.35 3f9k s PHE 406 Cb 0.18 -4.26 1.86 0.00 -0.34 0.00 0.00 43.02 40.47 3f9k s PHE 406 CO 0.12 -1.41 2.04 -0.22 -1.46 0.00 0.00 175.22 174.29 3f9k h LYS 407 N 9.04 0.00 -0.75 10.12 1.63 -1.89 -1.95 116.57 132.76 3f9k h LYS 407 Ca 0.29 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.08 3f9k h LYS 407 Cb 0.92 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.51 3f9k h LYS 407 CO 1.30 0.00 0.43 0.28 -3.45 0.00 0.00 179.45 178.02 3f9k h VAL 408 N 0.00 1.21 -3.50 2.00 2.07 -1.99 -3.39 116.25 112.65 3f9k h VAL 408 Ca 0.00 -0.50 -0.58 0.00 0.82 0.00 0.00 66.70 66.44 3f9k h VAL 408 Cb 0.04 0.18 -0.38 0.00 -1.52 0.00 0.00 31.29 29.61 3f9k h VAL 408 CO 0.00 0.23 -0.79 -0.55 0.02 0.00 0.00 177.57 176.49 3f9k s SER 409 N -6.37 3.48 0.25 0.57 0.15 -0.73 -5.00 113.70 106.04 3f9k s SER 409 Ca -0.11 -1.00 -0.04 0.00 0.70 0.00 0.00 55.95 55.50 3f9k s SER 409 Cb 0.17 -1.04 0.40 0.00 -1.71 0.00 0.00 66.02 63.84 3f9k s SER 409 CO 0.80 -0.23 1.83 1.56 1.20 0.00 0.00 173.24 178.39 3f9k h GLN 410 N 8.03 0.85 -0.26 5.44 1.08 -1.78 -1.76 115.11 126.72 3f9k h GLN 410 Ca -0.19 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 56.93 3f9k h GLN 410 Cb 1.09 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 3f9k h GLN 410 CO 0.40 0.56 0.08 0.28 -0.95 0.00 0.00 178.83 179.21 3f9k h VAL 411 N 0.88 1.19 -0.86 -0.54 2.07 -1.94 -0.12 116.25 116.93 3f9k h VAL 411 Ca 0.40 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 67.35 3f9k h VAL 411 Cb 0.32 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 3f9k h VAL 411 CO -0.23 0.20 0.55 0.40 0.02 0.00 0.00 177.57 178.51 3f9k h ILE 412 N 0.25 1.11 0.16 4.57 2.04 -1.84 0.23 117.51 124.03 3f9k h ILE 412 Ca 0.08 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 3f9k h ILE 412 Cb 0.23 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 3f9k h ILE 412 CO -0.00 0.19 -0.08 0.24 0.00 0.00 0.00 178.15 178.50 3f9k h MET 413 N 1.05 -0.20 0.00 2.37 2.86 -1.06 -1.19 114.93 118.75 3f9k h MET 413 Ca 0.35 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 58.03 3f9k h MET 413 Cb 0.05 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 3f9k h MET 413 CO -0.13 -0.12 -0.16 1.49 1.06 0.00 0.00 176.91 179.04 3f9k h GLU 414 N -0.23 -0.26 -0.06 1.72 4.81 -0.47 -0.60 114.58 119.49 3f9k h GLU 414 Ca -0.02 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3f9k h GLU 414 Cb 0.18 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 3f9k h GLU 414 CO 0.04 -0.17 -0.00 0.87 -0.73 0.00 0.00 179.01 179.01 3f9k h LYS 415 N -0.27 0.10 -0.43 1.92 1.57 -0.98 -2.42 116.57 116.05 3f9k h LYS 415 Ca 0.05 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 3f9k h LYS 415 Cb 0.34 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3f9k h LYS 415 CO -0.16 0.38 0.08 0.66 -0.57 0.00 0.00 179.45 179.84 3f9k h SER 416 N -0.19 0.60 0.61 0.86 4.64 -1.16 0.12 113.55 119.03 3f9k h SER 416 Ca 0.02 -0.10 -0.03 0.00 -0.47 0.00 0.00 61.79 61.20 3f9k h SER 416 Cb 0.33 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3f9k h SER 416 CO 0.00 0.62 -0.30 0.74 -0.87 0.00 0.00 176.83 177.03 3f9k h THR 417 N 0.63 0.38 -0.45 2.95 2.02 -1.10 0.59 112.91 117.93 3f9k h THR 417 Ca 0.14 -0.09 0.09 0.00 0.77 0.00 0.00 66.41 67.32 3f9k h THR 417 Cb 0.28 0.41 -0.09 0.00 -1.74 0.00 0.00 68.15 67.02 3f9k h THR 417 CO 0.00 0.01 -0.12 -0.03 0.37 0.00 0.00 175.52 175.76 3f9k h MET 418 N -0.89 -0.00 -0.36 6.66 -1.53 -1.11 -0.99 114.93 116.71 3f9k h MET 418 Ca -0.08 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.15 3f9k h MET 418 Cb 0.65 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.69 3f9k h MET 418 CO 0.14 -0.00 0.13 1.25 0.14 0.00 0.00 176.91 178.57 3f9k h LEU 419 N -0.00 0.51 -0.75 3.39 5.85 -0.67 -1.70 115.31 121.94 3f9k h LEU 419 Ca 0.22 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3f9k h LEU 419 Cb 0.33 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 3f9k h LEU 419 CO -0.47 0.55 0.49 0.22 -0.34 0.00 0.00 178.44 178.89 3f9k h TYR 420 N 0.43 0.92 -0.67 1.25 5.03 -0.52 -2.17 116.97 121.24 3f9k h TYR 420 Ca 0.12 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.45 3f9k h TYR 420 Cb 0.21 -0.31 -0.03 0.00 1.55 0.00 0.00 36.73 38.15 3f9k h TYR 420 CO 0.00 0.55 0.43 -0.91 -1.32 0.00 0.00 178.16 176.91 3f9k h ASN 421 N 0.97 0.79 -0.51 -2.11 2.35 -0.80 0.26 115.58 116.53 3f9k h ASN 421 Ca 0.29 -0.03 0.04 0.00 -0.55 0.00 0.00 56.30 56.04 3f9k h ASN 421 Cb -0.06 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.08 3f9k h ASN 421 CO -0.08 0.59 0.28 0.50 -1.65 0.00 0.00 177.43 177.06 3f9k h LYS 422 N 0.92 0.53 0.16 0.81 3.64 -0.68 -0.00 116.57 121.94 3f9k h LYS 422 Ca 0.25 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3f9k h LYS 422 Cb -0.08 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 3f9k h LYS 422 CO -0.05 0.35 -0.08 0.74 -2.27 0.00 0.00 179.45 178.14 3f9k h PHE 423 N 0.54 -0.20 -0.92 1.91 0.04 -1.05 -3.09 116.94 114.16 3f9k h PHE 423 Ca 0.22 -0.00 0.20 0.00 2.80 0.00 0.00 57.97 61.19 3f9k h PHE 423 Cb 0.10 0.07 -0.12 0.00 2.20 0.00 0.00 35.95 38.20 3f9k h PHE 423 CO -0.09 0.24 0.48 -0.22 -0.60 0.00 0.00 178.31 178.12 3f9k h LYS 424 N -0.78 0.53 -0.07 1.51 3.64 -0.45 -1.96 116.57 118.98 3f9k h LYS 424 Ca -0.02 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.16 3f9k h LYS 424 Cb 0.53 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3f9k h LYS 424 CO 0.04 0.35 -0.68 -0.97 -2.27 0.00 0.00 179.45 175.91 3f9k h ASN 425 N 0.54 0.36 1.52 4.20 -1.24 -1.07 -2.60 115.58 117.28 3f9k h ASN 425 Ca 0.56 -0.22 0.00 0.00 0.71 0.00 0.00 56.30 57.34 3f9k h ASN 425 Cb 0.98 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.93 3f9k h ASN 425 CO -0.46 0.93 0.00 0.00 -1.29 0.00 0.00 177.43 176.61 3f9k h MET 426 N 0.21 0.00 0.00 6.67 -0.00 -1.27 -1.42 114.93 119.12 3f9k h MET 426 Ca -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 59.70 59.61 3f9k h MET 426 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.82 3f9k h MET 426 CO 0.11 0.00 -0.49 0.74 -0.00 0.00 0.00 176.91 177.28 3f9k h PHE 427 N 0.00 0.00 0.00 -0.10 0.04 -1.49 -2.92 116.94 112.46 3f9k h PHE 427 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3f9k h PHE 427 Cb 0.76 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.91 3f9k h PHE 427 CO 0.00 0.29 0.00 1.25 -0.60 0.00 0.00 178.31 179.25 3f9k h LEU 428 N 0.00 0.00 0.00 1.54 5.85 -0.87 -3.28 115.31 118.54 3f9k h LEU 428 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3f9k h LEU 428 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 3f9k h LEU 428 CO 0.03 0.00 -0.39 1.33 -0.34 0.00 0.00 178.44 179.07 3f9k n VAL 429 N -2.61 0.00 -1.70 1.05 0.24 -0.91 -5.03 118.33 109.37 3f9k n VAL 429 Ca 0.04 -0.34 -0.38 0.00 -2.04 0.00 0.00 64.34 61.63 3f9k n VAL 429 Cb 0.42 0.92 0.06 0.00 -1.47 0.00 0.00 33.84 33.77 3f9k n VAL 429 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3f9k n GLY 430 N 1.26 0.39 0.38 7.63 0.00 -1.10 -4.96 105.19 108.79 3f9k n GLY 430 Ca 0.01 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 45.97 3f9k n GLY 430 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3f9k n GLU 431 N -1.50 1.08 0.00 1.61 1.02 -1.26 -5.01 120.64 116.57 3f9k n GLU 431 Ca 0.14 -0.99 0.00 0.00 -0.02 0.00 0.00 57.16 56.30 3f9k n GLU 431 Cb 0.47 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 3f9k n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3f9k n GLY 432 N 0.73 0.83 2.63 0.62 0.00 -1.26 -5.05 105.19 103.69 3f9k n GLY 432 Ca 0.06 -1.62 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 3f9k n GLY 432 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3f9k n ASP 433 N 0.00 2.30 -4.86 1.61 8.00 -1.26 -4.78 116.55 117.56 3f9k n ASP 433 Ca 0.00 -2.75 -0.32 0.00 0.71 0.00 0.00 54.79 52.43 3f9k n ASP 433 Cb 0.00 -0.49 -0.05 0.00 -0.02 0.00 0.00 41.12 40.56 3f9k n ASP 433 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3f9k s SER 434 N -3.44 6.68 0.19 -2.24 1.04 -1.26 -4.86 113.70 109.81 3f9k s SER 434 Ca 0.32 1.12 -0.14 0.00 0.48 0.00 0.00 55.95 57.73 3f9k s SER 434 Cb 0.40 -2.31 0.20 0.00 0.10 0.00 0.00 66.02 64.42 3f9k s SER 434 CO -0.02 -0.18 1.25 1.33 0.98 0.00 0.00 173.24 176.60 3f9k n VAL 435 N -0.40 -0.42 -0.08 5.02 0.24 -1.26 0.13 118.33 121.56 3f9k n VAL 435 Ca 0.02 1.88 -0.12 0.00 -2.04 0.00 0.00 64.34 64.08 3f9k n VAL 435 Cb 0.53 -2.49 -0.05 0.00 -1.47 0.00 0.00 33.84 30.36 3f9k n VAL 435 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3f9k h LEU 436 N 0.00 0.44 -0.57 1.34 4.07 -1.97 -0.32 115.31 118.30 3f9k h LEU 436 Ca 0.28 -0.37 0.06 0.00 0.08 0.00 0.00 57.88 57.93 3f9k h LEU 436 Cb 0.48 -0.12 -0.06 0.00 1.08 0.00 0.00 40.66 42.05 3f9k h LEU 436 CO -0.80 0.71 0.26 -0.33 -1.08 0.00 0.00 178.44 177.20 3f9k h GLU 437 N 0.16 0.48 -0.22 1.13 5.08 -1.41 -1.61 114.58 118.18 3f9k h GLU 437 Ca 0.05 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3f9k h GLU 437 Cb 0.52 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3f9k h GLU 437 CO 0.02 0.32 -0.13 0.28 -1.00 0.00 0.00 179.01 178.50 3f9k h VAL 438 N 0.49 1.21 0.00 3.13 2.07 0.00 -2.88 116.25 120.27 3f9k h VAL 438 Ca 0.27 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3f9k h VAL 438 Cb 0.23 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 3f9k h VAL 438 CO -0.22 0.30 -0.52 0.17 0.02 0.00 0.00 177.57 177.32 3f9k h LEU 439 N 0.35 0.00 -1.91 2.57 8.10 -0.72 -3.51 115.31 120.19 3f9k h LEU 439 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 57.88 58.05 3f9k h LEU 439 Cb 0.44 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.66 3f9k h LEU 439 CO 0.03 0.01 0.00 0.49 -4.11 0.00 0.00 178.44 174.85