#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpg h MET 348 N 0.00 0.00 -0.04 1.43 1.85 -2.03 0.27 114.93 116.41 3hpg h MET 348 Ca 0.00 0.00 -0.16 0.00 -0.61 0.00 0.00 59.70 58.93 3hpg h MET 348 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 3hpg h MET 348 CO 0.00 0.03 -0.70 0.22 -0.40 0.00 0.00 176.91 176.06 3hpg h ASP 349 N 0.00 0.23 0.79 1.39 3.58 -2.01 -2.99 116.42 117.41 3hpg h ASP 349 Ca -0.00 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.30 3hpg h ASP 349 Cb 0.22 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.20 3hpg h ASP 349 CO 0.00 0.86 -0.97 -1.54 -2.88 0.00 0.00 179.24 174.71 3hpg n SER 350 N -3.78 0.71 0.05 2.28 3.41 -0.69 -3.53 113.62 112.07 3hpg n SER 350 Ca -0.03 0.14 -0.13 0.00 -0.26 0.00 0.00 58.87 58.60 3hpg n SER 350 Cb 0.69 0.54 -0.09 0.00 -0.26 0.00 0.00 64.21 65.08 3hpg n SER 350 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3hpg h ARG 351 N 0.00 -0.14 -0.53 4.33 2.43 -0.48 -2.65 114.38 117.35 3hpg h ARG 351 Ca 0.00 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 3hpg h ARG 351 Cb 0.88 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.44 3hpg h ARG 351 CO 0.00 0.24 0.07 -0.07 -1.51 0.00 0.00 179.97 178.70 3hpg h LEU 352 N -0.55 0.79 -2.40 3.80 3.38 -1.70 -0.95 115.31 117.69 3hpg h LEU 352 Ca -0.01 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 3hpg h LEU 352 Cb 0.44 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hpg h LEU 352 CO 0.02 0.82 -0.01 -0.61 0.09 0.00 0.00 178.44 178.75 3hpg h GLN 353 N 0.80 0.00 0.00 1.13 4.15 -1.60 -1.52 115.11 118.07 3hpg h GLN 353 Ca 0.16 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.42 3hpg h GLN 353 Cb 0.38 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.04 3hpg h GLN 353 CO 0.01 0.01 -2.10 -2.13 -1.93 0.00 0.00 178.83 172.69 3hpg n ARG 354 N -3.90 0.78 0.21 1.69 0.63 -0.92 -3.24 116.66 111.91 3hpg n ARG 354 Ca -0.03 -0.10 0.09 0.00 -0.92 0.00 0.00 57.85 56.89 3hpg n ARG 354 Cb 0.09 -1.48 0.38 0.00 0.45 0.00 0.00 32.46 31.90 3hpg n ARG 354 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 3hpg h ILE 355 N 0.00 0.60 -0.01 5.15 2.04 -0.89 -2.41 117.51 121.99 3hpg h ILE 355 Ca -0.25 -1.30 -0.03 0.00 1.00 0.00 0.00 64.86 64.28 3hpg h ILE 355 Cb 1.53 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 3hpg h ILE 355 CO 0.01 0.26 -0.13 -0.74 0.00 0.00 0.00 178.15 177.55 3hpg h HIS 356 N 0.00 0.15 -0.71 1.37 2.76 -1.41 -2.98 115.15 114.34 3hpg h HIS 356 Ca -0.00 -0.07 0.07 0.00 -2.20 0.00 0.00 60.37 58.16 3hpg h HIS 356 Cb 0.86 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.75 3hpg h HIS 356 CO 0.00 0.83 0.47 0.00 -1.30 0.00 0.00 177.93 177.93 3hpg h ALA 357 N 0.28 1.72 -0.48 5.26 0.00 -1.53 -1.70 119.26 122.82 3hpg h ALA 357 Ca -0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 3hpg h ALA 357 Cb 0.86 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3hpg h ALA 357 CO 0.03 0.16 -0.17 0.93 0.00 0.00 0.00 179.25 180.20 3hpg h GLU 358 N 0.73 0.96 -0.70 0.00 5.08 -1.49 -0.81 114.58 118.34 3hpg h GLU 358 Ca 0.31 -0.39 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 3hpg h GLU 358 Cb 0.27 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 3hpg h GLU 358 CO -0.10 1.06 0.23 0.82 -1.00 0.00 0.00 179.01 180.02 3hpg h ILE 359 N 0.81 1.25 0.42 3.13 2.04 -1.17 -2.67 117.51 121.32 3hpg h ILE 359 Ca 0.11 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 3hpg h ILE 359 Cb 0.74 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3hpg h ILE 359 CO 0.06 0.34 -0.20 0.11 0.00 0.00 0.00 178.15 178.45 3hpg h LYS 360 N 1.04 -0.55 -0.27 2.37 1.57 -1.27 -3.30 116.57 116.16 3hpg h LYS 360 Ca 0.23 0.04 0.08 0.00 -1.87 0.00 0.00 60.65 59.12 3hpg h LYS 360 Cb 0.28 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 3hpg h LYS 360 CO -0.01 -0.35 0.51 -0.91 -0.57 0.00 0.00 179.45 178.13 3hpg h ASN 361 N -1.14 0.00 0.12 0.86 4.21 -1.18 0.20 115.58 118.65 3hpg h ASN 361 Ca -0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.45 3hpg h ASN 361 Cb 0.46 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.66 3hpg h ASN 361 CO 0.10 0.00 -0.13 -1.54 -1.29 0.00 0.00 177.43 174.57 3hpg n SER 362 N -3.24 1.24 -0.08 5.81 3.41 -1.01 -3.73 113.62 116.02 3hpg n SER 362 Ca 0.04 -1.18 0.01 0.00 -0.26 0.00 0.00 58.87 57.48 3hpg n SER 362 Cb 0.64 0.06 0.02 0.00 -0.26 0.00 0.00 64.21 64.67 3hpg n SER 362 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hpg n LEU 363 N -0.25 1.89 -4.68 1.04 4.77 0.71 -1.54 117.00 118.94 3hpg n LEU 363 Ca 0.16 -1.76 -0.34 0.00 -0.03 0.00 0.00 56.01 54.04 3hpg n LEU 363 Cb 0.35 -0.02 0.12 0.00 -2.33 0.00 0.00 43.42 41.54 3hpg n LEU 363 CO 0.21 0.47 0.73 0.29 -1.33 0.00 0.00 177.39 177.76 3hpg n LYS 364 N -0.25 0.22 0.14 3.23 4.76 -1.21 -4.84 118.16 120.20 3hpg n LYS 364 Ca 0.01 0.15 -0.25 0.00 -2.87 0.00 0.00 58.31 55.36 3hpg n LYS 364 Cb 0.22 -2.41 -0.16 0.00 -1.84 0.00 0.00 35.03 30.84 3hpg n LYS 364 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3hpg h ILE 365 N -0.83 1.23 0.00 -0.18 2.04 -1.95 -2.11 117.51 115.71 3hpg h ILE 365 Ca -0.46 -2.67 0.00 0.00 1.00 0.00 0.00 64.86 62.72 3hpg h ILE 365 Cb 1.30 3.00 0.00 0.00 -0.74 0.00 0.00 36.82 40.39 3hpg h ILE 365 CO 0.46 0.82 0.00 -0.90 0.00 0.00 0.00 178.15 178.53 3hpg n ASP 366 N -3.70 0.50 -1.95 1.72 5.75 -1.26 -3.66 116.55 113.95 3hpg n ASP 366 Ca -0.18 -1.33 -0.01 0.00 -0.01 0.00 0.00 54.79 53.26 3hpg n ASP 366 Cb 1.10 -0.25 0.05 0.00 -1.03 0.00 0.00 41.12 41.00 3hpg n ASP 366 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3hpg n ASN 367 N 0.01 -0.63 -4.56 -1.12 5.15 -1.16 -5.09 115.26 107.85 3hpg n ASN 367 Ca 0.00 -1.50 -0.29 0.00 -0.60 0.00 0.00 54.58 52.19 3hpg n ASN 367 Cb 0.13 0.29 -0.05 0.00 -0.53 0.00 0.00 39.78 39.62 3hpg n ASN 367 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3hpg s LEU 368 N -1.72 3.18 -1.11 1.20 1.43 -0.80 -4.49 118.68 116.37 3hpg s LEU 368 Ca 0.04 -0.27 -0.10 0.00 -1.03 0.00 0.00 54.13 52.77 3hpg s LEU 368 Cb 0.19 -2.55 0.27 0.00 0.03 0.00 0.00 46.19 44.13 3hpg s LEU 368 CO -0.05 -2.77 1.11 -0.62 0.23 0.00 0.00 176.35 174.25 3hpg s ASP 369 N 8.50 7.29 0.04 2.29 3.68 -0.59 -4.88 116.67 133.00 3hpg s ASP 369 Ca 0.73 -3.53 0.10 0.00 2.13 0.00 0.00 52.55 51.97 3hpg s ASP 369 Cb -0.09 -2.22 0.42 0.00 -1.45 0.00 0.00 42.92 39.58 3hpg s ASP 369 CO 0.07 -0.32 1.30 1.33 0.13 0.00 0.00 175.17 177.68 3hpg n VAL 370 N 2.85 1.40 -0.02 1.11 0.24 -1.26 -1.60 118.33 121.05 3hpg n VAL 370 Ca 0.24 0.38 -0.05 0.00 -2.04 0.00 0.00 64.34 62.87 3hpg n VAL 370 Cb 0.40 -1.26 -0.13 0.00 -1.47 0.00 0.00 33.84 31.38 3hpg n VAL 370 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3hpg n ASN 371 N -1.60 0.68 0.03 -1.34 4.13 -1.26 -3.09 115.26 112.81 3hpg n ASN 371 Ca 0.02 0.31 0.13 0.00 1.68 0.00 0.00 54.58 56.72 3hpg n ASN 371 Cb 0.10 0.28 0.44 0.00 -1.54 0.00 0.00 39.78 39.05 3hpg n ASN 371 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 3hpg n ARG 372 N -2.91 0.10 -0.03 3.52 0.63 -0.63 -2.25 116.66 115.09 3hpg n ARG 372 Ca -0.17 0.06 -0.21 0.00 -0.92 0.00 0.00 57.85 56.61 3hpg n ARG 372 Cb 0.98 -1.59 -0.13 0.00 0.45 0.00 0.00 32.46 32.17 3hpg n ARG 372 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3hpg h ILE 374 N -0.50 1.14 0.00 0.00 2.04 -1.59 0.66 117.51 119.27 3hpg h ILE 374 Ca -0.32 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 3hpg h ILE 374 Cb 1.62 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 38.80 3hpg h ILE 374 CO -0.02 0.19 -0.02 -0.08 0.00 0.00 0.00 178.15 178.22 3hpg h GLU 375 N 0.23 0.00 0.00 2.37 4.81 -1.56 -1.91 114.58 118.51 3hpg h GLU 375 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3hpg h GLU 375 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3hpg h GLU 375 CO 0.01 0.02 -1.62 0.00 -0.73 0.00 0.00 179.01 176.69 3hpg n ALA 376 N -2.10 3.22 0.82 2.92 0.00 -0.76 -3.48 120.51 121.12 3hpg n ALA 376 Ca 0.01 -0.49 0.13 0.00 0.00 0.00 0.00 53.44 53.09 3hpg n ALA 376 Cb 0.33 -0.68 0.44 0.00 0.00 0.00 0.00 19.45 19.54 3hpg n ALA 376 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hpg n LEU 377 N -1.98 0.44 -0.01 0.00 4.77 0.15 -3.54 117.00 116.83 3hpg n LEU 377 Ca -0.02 0.42 -0.22 0.00 -0.03 0.00 0.00 56.01 56.17 3hpg n LEU 377 Cb 0.45 -0.36 -0.14 0.00 -2.33 0.00 0.00 43.42 41.04 3hpg n LEU 377 CO 0.41 -0.05 -0.73 0.44 -1.33 0.00 0.00 177.39 176.12 3hpg h ASP 378 N 0.00 0.36 0.00 -1.43 3.32 -1.49 -3.28 116.42 113.90 3hpg h ASP 378 Ca 0.00 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.17 3hpg h ASP 378 Cb 0.61 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3hpg h ASP 378 CO 0.00 1.79 0.00 1.21 -1.72 0.00 0.00 179.24 180.52 3hpg n GLU 379 N -3.67 0.46 -1.09 3.56 2.13 -1.23 0.75 120.64 121.55 3hpg n GLU 379 Ca -0.31 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.54 3hpg n GLU 379 Cb 0.98 -1.20 0.03 0.00 0.27 0.00 0.00 31.44 31.52 3hpg n GLU 379 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3hpg n LEU 380 N 0.18 0.79 -0.01 4.31 7.94 -1.24 -4.34 117.00 124.64 3hpg n LEU 380 Ca 0.00 -1.79 -0.01 0.00 -1.11 0.00 0.00 56.01 53.10 3hpg n LEU 380 Cb 0.10 -0.04 -0.01 0.00 0.53 0.00 0.00 43.42 44.01 3hpg n LEU 380 CO 0.00 0.47 -0.56 0.00 -1.11 0.00 0.00 177.39 176.19 3hpg n ALA 381 N 0.21 1.96 0.19 1.96 0.00 0.23 -4.67 120.51 120.38 3hpg n ALA 381 Ca 0.05 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.52 3hpg n ALA 381 Cb 0.97 0.40 0.08 0.00 0.00 0.00 0.00 19.45 20.90 3hpg n ALA 381 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hpg h SER 382 N 0.00 0.00 -2.62 0.00 4.64 -1.69 -3.47 113.55 110.42 3hpg h SER 382 Ca -0.04 -0.01 -0.52 0.00 -0.47 0.00 0.00 61.79 60.74 3hpg h SER 382 Cb 1.07 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.21 3hpg h SER 382 CO -0.00 0.01 1.05 -0.76 -0.87 0.00 0.00 176.83 176.25 3hpg s LEU 383 N -5.60 4.38 -0.43 5.97 1.43 -1.26 -4.95 118.68 118.22 3hpg s LEU 383 Ca 0.03 2.79 -0.28 0.00 -1.03 0.00 0.00 54.13 55.63 3hpg s LEU 383 Cb 0.08 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.71 3hpg s LEU 383 CO 0.74 -0.97 1.65 -1.58 0.23 0.00 0.00 176.35 176.42 3hpg s GLN 384 N 1.95 3.27 -0.07 1.70 2.00 -1.26 -4.99 119.66 122.26 3hpg s GLN 384 Ca 0.77 1.02 -0.11 0.00 -2.00 0.00 0.00 55.36 55.04 3hpg s GLN 384 Cb -0.47 -4.18 0.02 0.00 0.80 0.00 0.00 33.01 29.19 3hpg s GLN 384 CO 0.34 -1.95 0.28 0.08 -0.50 0.00 0.00 175.29 173.54 3hpg s VAL 385 N 6.79 0.03 0.34 1.34 1.01 -1.26 -5.18 120.40 123.46 3hpg s VAL 385 Ca 0.69 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.53 3hpg s VAL 385 Cb -0.17 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 3hpg s VAL 385 CO 0.30 -0.12 0.22 0.42 0.00 0.00 0.00 175.10 175.91 3hpg s THR 386 N -0.46 3.25 -2.00 3.92 -4.23 -1.26 -4.99 115.64 109.87 3hpg s THR 386 Ca -0.06 -1.54 0.16 0.00 -1.18 0.00 0.00 61.69 59.07 3hpg s THR 386 Cb -0.04 -3.08 0.44 0.00 1.34 0.00 0.00 72.50 71.17 3hpg s THR 386 CO 0.02 -0.17 1.34 0.23 -0.54 0.00 0.00 174.62 175.49 3hpg n MET 387 N -1.26 0.52 -0.08 3.99 2.81 -1.26 -2.08 117.12 119.75 3hpg n MET 387 Ca -0.02 0.00 -0.15 0.00 -1.81 0.00 0.00 57.70 55.72 3hpg n MET 387 Cb 0.61 -1.47 -0.10 0.00 -0.71 0.00 0.00 33.22 31.55 3hpg n MET 387 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 3hpg h GLN 388 N 0.00 0.00 0.00 0.03 -0.00 -2.03 -3.32 115.11 109.79 3hpg h GLN 388 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3hpg h GLN 388 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 3hpg h GLN 388 CO 0.00 0.77 0.00 1.04 0.00 0.00 0.00 178.83 180.64 3hpg n GLN 389 N -4.55 0.31 0.00 1.69 6.02 -1.17 -3.37 117.38 116.31 3hpg n GLN 389 Ca -0.18 0.08 0.14 0.00 -0.01 0.00 0.00 57.00 57.03 3hpg n GLN 389 Cb 0.49 -1.50 0.57 0.00 1.02 0.00 0.00 30.24 30.82 3hpg n GLN 389 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hpg n ALA 390 N -1.29 2.80 0.11 -1.58 0.00 -0.88 -3.40 120.51 116.26 3hpg n ALA 390 Ca 0.10 -0.31 0.11 0.00 0.00 0.00 0.00 53.44 53.34 3hpg n ALA 390 Cb 0.18 -1.28 -0.11 0.00 0.00 0.00 0.00 19.45 18.24 3hpg n ALA 390 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3hpg n GLN 391 N -0.75 0.59 0.04 0.00 7.27 -1.22 -4.16 117.38 119.15 3hpg n GLN 391 Ca 0.15 -0.09 -0.09 0.00 0.07 0.00 0.00 57.00 57.04 3hpg n GLN 391 Cb 0.29 -1.61 0.05 0.00 2.41 0.00 0.00 30.24 31.39 3hpg n GLN 391 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 3hpg h LYS 392 N 0.00 0.43 -2.21 3.69 1.79 -1.76 -3.35 116.57 115.16 3hpg h LYS 392 Ca 0.00 -0.31 -0.71 0.00 -2.18 0.00 0.00 60.65 57.45 3hpg h LYS 392 Cb 0.96 0.05 -0.34 0.00 -1.58 0.00 0.00 32.23 31.32 3hpg h LYS 392 CO 0.00 0.93 0.30 0.72 -1.08 0.00 0.00 179.45 180.32 3hpg n HIS 393 N -3.89 3.32 0.09 -1.35 8.25 -1.25 -4.76 115.22 115.63 3hpg n HIS 393 Ca -0.04 -3.13 -0.00 0.00 -0.26 0.00 0.00 57.72 54.29 3hpg n HIS 393 Cb 0.65 -0.86 -0.03 0.00 1.12 0.00 0.00 29.99 30.86 3hpg n HIS 393 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 3hpg h THR 394 N 2.51 0.95 -0.23 1.59 1.35 -1.74 -3.11 112.91 114.23 3hpg h THR 394 Ca 0.37 -2.43 -0.01 0.00 -0.55 0.00 0.00 66.41 63.80 3hpg h THR 394 Cb 0.40 2.42 -0.01 0.00 -1.73 0.00 0.00 68.15 69.23 3hpg h THR 394 CO 1.04 0.54 0.11 -0.33 -0.25 0.00 0.00 175.52 176.64 3hpg h GLU 395 N 0.00 0.31 0.00 4.72 3.07 -1.93 -0.74 114.58 120.01 3hpg h GLU 395 Ca -0.05 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.74 3hpg h GLU 395 Cb 1.53 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.37 3hpg h GLU 395 CO 0.07 0.24 -0.21 1.98 -1.40 0.00 0.00 179.01 179.69 3hpg h MET 396 N 0.32 0.00 0.00 2.33 4.05 -1.94 -2.37 114.93 117.32 3hpg h MET 396 Ca 0.08 0.00 -0.23 0.00 -0.28 0.00 0.00 59.70 59.28 3hpg h MET 396 Cb 0.03 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.79 3hpg h MET 396 CO -0.01 0.21 -1.27 0.82 0.23 0.00 0.00 176.91 176.89 3hpg h ILE 397 N 0.00 1.17 -0.44 1.77 2.04 -1.26 -1.77 117.51 119.03 3hpg h ILE 397 Ca -0.00 -2.88 0.04 0.00 1.00 0.00 0.00 64.86 63.01 3hpg h ILE 397 Cb 0.50 2.56 -0.04 0.00 -0.74 0.00 0.00 36.82 39.10 3hpg h ILE 397 CO 0.03 0.67 0.22 0.74 0.00 0.00 0.00 178.15 179.81 3hpg h THR 398 N 0.00 0.97 -0.28 -0.27 2.02 -0.94 -0.62 112.91 113.78 3hpg h THR 398 Ca -0.13 -0.15 -0.11 0.00 0.77 0.00 0.00 66.41 66.78 3hpg h THR 398 Cb 1.81 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 3hpg h THR 398 CO 0.10 0.08 -0.29 0.74 0.37 0.00 0.00 175.52 176.52 3hpg h THR 399 N 0.44 1.28 0.00 3.16 2.02 -1.47 -1.47 112.91 116.87 3hpg h THR 399 Ca 0.19 -1.38 -0.07 0.00 0.77 0.00 0.00 66.41 65.92 3hpg h THR 399 Cb 0.10 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 3hpg h THR 399 CO -0.14 0.44 -0.33 -0.07 0.37 0.00 0.00 175.52 175.80 3hpg h LEU 400 N 0.50 0.00 0.00 2.58 3.38 -0.79 -2.89 115.31 118.10 3hpg h LEU 400 Ca 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hpg h LEU 400 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 3hpg h LEU 400 CO 0.06 0.33 -0.00 0.50 0.09 0.00 0.00 178.44 179.42 3hpg h LYS 401 N 0.00 -0.00 -0.63 1.13 3.64 -1.01 -3.34 116.57 116.36 3hpg h LYS 401 Ca -0.00 0.00 0.18 0.00 -1.27 0.00 0.00 60.65 59.56 3hpg h LYS 401 Cb 0.75 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 3hpg h LYS 401 CO 0.04 0.57 0.77 -0.22 -2.27 0.00 0.00 179.45 178.35 3hpg h LYS 402 N -1.00 0.00 -0.59 1.90 3.64 -1.22 -0.24 116.57 119.07 3hpg h LYS 402 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hpg h LYS 402 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3hpg h LYS 402 CO 0.00 0.00 0.00 0.44 -2.27 0.00 0.00 179.45 177.62 3hpg n ILE 403 N -3.42 1.30 0.09 2.00 -5.35 -1.10 -4.16 119.36 108.71 3hpg n ILE 403 Ca 0.13 -1.10 -0.13 0.00 -0.27 0.00 0.00 62.75 61.37 3hpg n ILE 403 Cb 0.99 0.36 -0.08 0.00 -1.74 0.00 0.00 39.64 39.17 3hpg n ILE 403 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 3hpg h ARG 404 N 3.51 0.30 -1.53 6.28 3.08 -1.16 -3.28 114.38 121.58 3hpg h ARG 404 Ca 0.00 -0.39 -0.32 0.00 0.07 0.00 0.00 59.98 59.34 3hpg h ARG 404 Cb 1.07 0.13 -0.14 0.00 0.08 0.00 0.00 29.97 31.11 3hpg h ARG 404 CO 0.07 1.12 0.41 0.54 -1.07 0.00 0.00 179.97 181.04 3hpg n ARG 405 N -3.63 1.79 -3.30 0.04 1.74 -1.26 -4.74 116.66 107.30 3hpg n ARG 405 Ca -0.07 -1.54 -0.47 0.00 -0.77 0.00 0.00 57.85 55.01 3hpg n ARG 405 Cb 0.91 -1.61 -0.02 0.00 -1.02 0.00 0.00 32.46 30.72 3hpg n ARG 405 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3hpg s PHE 406 N -1.80 3.77 0.57 -1.55 5.36 -1.24 -4.91 117.98 118.18 3hpg s PHE 406 Ca 0.30 -2.02 0.32 0.00 -0.96 0.00 0.00 56.93 54.58 3hpg s PHE 406 Cb 0.24 -3.85 1.87 0.00 -0.34 0.00 0.00 43.02 40.93 3hpg s PHE 406 CO -0.00 -1.02 2.25 0.87 -1.46 0.00 0.00 175.22 175.85 3hpg h LYS 407 N 7.74 0.00 0.39 10.12 1.79 -1.93 -3.22 116.57 131.46 3hpg h LYS 407 Ca 0.12 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 3hpg h LYS 407 Cb 1.02 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.66 3hpg h LYS 407 CO 0.80 0.02 -0.29 0.28 -1.08 0.00 0.00 179.45 179.17 3hpg h VAL 408 N 0.00 0.39 -3.31 0.50 2.07 -1.99 -3.41 116.25 110.50 3hpg h VAL 408 Ca -0.00 0.00 -0.64 0.00 0.82 0.00 0.00 66.70 66.88 3hpg h VAL 408 Cb 0.06 0.39 -0.22 0.00 -1.52 0.00 0.00 31.29 30.01 3hpg h VAL 408 CO 0.00 0.00 -0.67 -0.55 0.02 0.00 0.00 177.57 176.37 3hpg s SER 409 N -4.62 4.77 0.04 0.57 0.15 -1.22 -4.99 113.70 108.40 3hpg s SER 409 Ca -0.16 -0.13 0.05 0.00 0.70 0.00 0.00 55.95 56.41 3hpg s SER 409 Cb 0.05 -1.77 -0.24 0.00 -1.71 0.00 0.00 66.02 62.36 3hpg s SER 409 CO 0.63 0.17 0.99 1.56 1.20 0.00 0.00 173.24 177.80 3hpg h GLN 410 N 6.66 0.08 0.00 5.44 1.08 -1.83 -3.06 115.11 123.49 3hpg h GLN 410 Ca -0.31 -0.13 -0.04 0.00 -1.45 0.00 0.00 58.65 56.71 3hpg h GLN 410 Cb 1.19 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 3hpg h GLN 410 CO 0.62 0.90 -0.21 0.28 -0.95 0.00 0.00 178.83 179.47 3hpg h VAL 411 N 0.02 0.44 0.03 -0.54 2.07 -1.95 -2.53 116.25 113.78 3hpg h VAL 411 Ca -0.15 -1.27 -0.23 0.00 0.82 0.00 0.00 66.70 65.86 3hpg h VAL 411 Cb 1.91 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 33.60 3hpg h VAL 411 CO 0.13 0.21 -1.09 0.40 0.02 0.00 0.00 177.57 177.24 3hpg h ILE 412 N 0.00 1.63 -0.33 4.57 2.04 -1.93 -3.07 117.51 120.42 3hpg h ILE 412 Ca -0.00 -3.31 -0.09 0.00 1.00 0.00 0.00 64.86 62.46 3hpg h ILE 412 Cb 0.92 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.84 3hpg h ILE 412 CO 0.03 0.94 -0.18 0.24 0.00 0.00 0.00 178.15 179.18 3hpg h MET 413 N 0.02 0.61 0.30 2.37 2.86 -1.40 -2.29 114.93 117.41 3hpg h MET 413 Ca -0.05 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 3hpg h MET 413 Cb 1.83 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 33.45 3hpg h MET 413 CO 0.15 0.76 -0.15 1.49 1.06 0.00 0.00 176.91 180.22 3hpg h GLU 414 N 0.55 -0.39 0.00 1.72 4.81 -1.53 -2.86 114.58 116.88 3hpg h GLU 414 Ca 0.09 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3hpg h GLU 414 Cb 0.62 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.09 3hpg h GLU 414 CO 0.04 -0.15 0.00 0.87 -0.73 0.00 0.00 179.01 179.04 3hpg h LYS 415 N -1.05 0.00 0.21 1.92 1.57 -1.63 -1.69 116.57 115.90 3hpg h LYS 415 Ca -0.04 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.41 3hpg h LYS 415 Cb 0.42 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.76 3hpg h LYS 415 CO 0.07 0.00 -1.48 0.66 -0.57 0.00 0.00 179.45 178.13 3hpg h SER 416 N 0.00 0.68 0.38 0.86 4.64 -1.48 -2.96 113.55 115.67 3hpg h SER 416 Ca 0.00 -0.78 -0.19 0.00 -0.47 0.00 0.00 61.79 60.35 3hpg h SER 416 Cb 0.39 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 3hpg h SER 416 CO 0.00 1.62 -0.77 0.74 -0.87 0.00 0.00 176.83 177.55 3hpg h THR 417 N 0.12 1.42 0.15 2.95 2.02 -1.26 -2.69 112.91 115.61 3hpg h THR 417 Ca -0.24 -2.28 -0.01 0.00 0.77 0.00 0.00 66.41 64.65 3hpg h THR 417 Cb 2.11 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 70.75 3hpg h THR 417 CO 0.24 0.68 -0.07 -0.03 0.37 0.00 0.00 175.52 176.70 3hpg h MET 418 N 0.20 -0.20 0.00 6.66 -1.53 -1.40 -1.25 114.93 117.41 3hpg h MET 418 Ca -0.04 0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.22 3hpg h MET 418 Cb 1.36 0.05 -0.00 0.00 -0.55 0.00 0.00 31.60 32.45 3hpg h MET 418 CO 0.13 -0.06 -0.06 -0.07 0.14 0.00 0.00 176.91 176.99 3hpg h LEU 419 N -0.30 0.00 -0.34 3.39 4.07 -1.59 -2.15 115.31 118.40 3hpg h LEU 419 Ca -0.02 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.76 3hpg h LEU 419 Cb 0.23 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.97 3hpg h LEU 419 CO 0.03 0.06 -0.51 0.22 -1.08 0.00 0.00 178.44 177.16 3hpg h TYR 420 N 0.00 1.07 0.00 1.13 5.03 -1.05 -3.07 116.97 120.08 3hpg h TYR 420 Ca -0.00 -0.37 -0.02 0.00 2.58 0.00 0.00 58.73 60.92 3hpg h TYR 420 Cb 0.16 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.23 3hpg h TYR 420 CO 0.00 1.19 -0.11 -0.91 -1.32 0.00 0.00 178.16 177.01 3hpg h ASN 421 N 0.67 0.00 0.54 -2.11 2.35 -0.62 -2.20 115.58 114.22 3hpg h ASN 421 Ca 0.02 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.68 3hpg h ASN 421 Cb 1.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.47 3hpg h ASN 421 CO 0.12 0.11 -0.47 0.50 -1.65 0.00 0.00 177.43 176.04 3hpg h LYS 422 N 0.00 0.00 -0.03 0.81 3.64 -1.35 -3.52 116.57 116.12 3hpg h LYS 422 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hpg h LYS 422 Cb 0.57 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 3hpg h LYS 422 CO 0.01 0.47 0.00 1.19 -2.27 0.00 0.00 179.45 178.85