#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2put s TYR 350 N 0.00 3.20 0.30 0.54 2.02 -1.26 -4.96 117.35 117.20 2put s TYR 350 Ca 0.00 1.57 0.06 0.00 -0.37 0.00 0.00 57.07 58.33 2put s TYR 350 Cb 0.00 -3.40 0.49 0.00 -0.40 0.00 0.00 41.96 38.66 2put s TYR 350 CO 0.00 -1.18 1.74 0.87 -1.57 0.00 0.00 175.55 175.41 2put h LYS 351 N 3.02 0.30 -3.76 -0.62 1.57 -2.03 -3.46 116.57 111.59 2put h LYS 351 Ca -0.48 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.07 2put h LYS 351 Cb 1.23 -0.01 -0.16 0.00 0.08 0.00 0.00 32.23 33.36 2put h LYS 351 CO 0.64 0.60 -0.44 -1.01 -0.57 0.00 0.00 179.45 178.67 2put s HIS 352 N -4.31 0.16 0.24 -1.35 3.76 -1.26 -5.05 115.29 107.48 2put s HIS 352 Ca -0.05 -0.50 -0.06 0.00 -0.15 0.00 0.00 55.06 54.30 2put s HIS 352 Cb 0.14 -0.10 0.31 0.00 1.11 0.00 0.00 32.58 34.04 2put s HIS 352 CO 0.77 -0.45 1.85 0.74 -0.85 0.00 0.00 174.74 176.80 2put h PHE 353 N 3.23 0.97 -1.00 1.40 0.04 -1.97 -1.11 116.94 118.49 2put h PHE 353 Ca -0.33 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.49 2put h PHE 353 Cb 1.19 -0.32 -0.05 0.00 2.20 0.00 0.00 35.95 38.97 2put h PHE 353 CO 0.49 0.51 0.66 1.98 -0.60 0.00 0.00 178.31 181.35 2put h MET 354 N 0.97 1.29 -0.42 1.51 4.05 -1.94 0.10 114.93 120.49 2put h MET 354 Ca 0.36 -0.08 -0.07 0.00 -0.28 0.00 0.00 59.70 59.63 2put h MET 354 Cb 0.13 -0.29 -0.01 0.00 -0.80 0.00 0.00 31.60 30.62 2put h MET 354 CO -0.16 0.85 -0.01 0.37 0.23 0.00 0.00 176.91 178.19 2put h GLN 355 N 1.33 0.75 -0.59 0.39 4.15 -1.82 -1.30 115.11 118.01 2put h GLN 355 Ca 0.38 -0.24 0.04 0.00 0.77 0.00 0.00 58.65 59.60 2put h GLN 355 Cb -0.10 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.48 2put h GLN 355 CO -0.10 0.83 0.34 -0.22 -1.93 0.00 0.00 178.83 177.75 2put h LYS 356 N 0.58 0.63 -0.06 1.69 3.64 -0.39 -2.16 116.57 120.50 2put h LYS 356 Ca 0.12 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.31 2put h LYS 356 Cb 0.50 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2put h LYS 356 CO 0.02 0.42 -0.62 0.93 -2.27 0.00 0.00 179.45 177.94 2put h GLU 357 N 0.65 0.22 -0.10 1.90 5.08 -0.60 0.14 114.58 121.87 2put h GLU 357 Ca 0.25 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2put h GLU 357 Cb 0.09 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2put h GLU 357 CO -0.13 0.76 0.03 0.82 -1.00 0.00 0.00 179.01 179.49 2put h ILE 358 N 0.16 0.97 0.00 3.13 2.04 -1.17 -3.02 117.51 119.62 2put h ILE 358 Ca -0.01 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2put h ILE 358 Cb 1.12 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2put h ILE 358 CO 0.09 0.01 0.00 -0.26 0.00 0.00 0.00 178.15 178.00 2put h PHE 359 N 0.08 0.00 0.00 1.37 -1.00 -0.98 -2.61 116.94 113.79 2put h PHE 359 Ca 0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.82 2put h PHE 359 Cb 0.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.59 2put h PHE 359 CO -0.10 0.00 0.00 -1.91 -1.61 0.00 0.00 178.31 174.69 2put n GLU 360 N -2.92 0.10 0.25 1.51 2.13 0.47 -4.31 120.64 117.86 2put n GLU 360 Ca 0.02 0.29 0.08 0.00 0.66 0.00 0.00 57.16 58.20 2put n GLU 360 Cb 0.34 -1.68 0.62 0.00 0.27 0.00 0.00 31.44 30.99 2put n GLU 360 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2put h GLN 361 N 0.00 0.00 -0.82 5.31 4.20 -1.50 0.12 115.11 122.41 2put h GLN 361 Ca 0.00 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.77 2put h GLN 361 Cb 0.37 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 2put h GLN 361 CO 0.00 0.04 0.54 -1.35 -0.67 0.00 0.00 178.83 177.39 2put h PRO 362 N 0.00 0.91 0.11 1.46 0.11 -1.81 0.74 132.00 133.52 2put h PRO 362 Ca -0.00 -0.05 -0.26 0.00 0.11 0.00 0.00 66.00 65.79 2put h PRO 362 Cb 0.06 -0.21 0.03 0.00 0.11 0.00 0.00 31.00 30.99 2put h PRO 362 CO 0.00 0.60 -1.09 -0.44 -0.21 0.00 0.00 178.00 176.87 2put h ASP 363 N 0.94 0.77 0.14 -2.05 3.32 -1.14 -2.46 116.42 115.95 2put h ASP 363 Ca 0.35 -0.83 -0.14 0.00 0.02 0.00 0.00 57.03 56.42 2put h ASP 363 Cb 0.17 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2put h ASP 363 CO -0.12 1.53 -0.52 0.77 -1.72 0.00 0.00 179.24 179.17 2put h SER 364 N 0.12 0.46 -0.49 6.45 4.64 -1.00 -0.00 113.55 123.74 2put h SER 364 Ca -0.17 -0.24 -0.01 0.00 -0.47 0.00 0.00 61.79 60.91 2put h SER 364 Cb 1.79 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.72 2put h SER 364 CO 0.21 0.90 0.28 0.00 -0.87 0.00 0.00 176.83 177.35 2put h ALA 365 N 1.11 0.63 -0.26 5.18 0.00 -0.90 0.02 119.26 125.03 2put h ALA 365 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2put h ALA 365 Cb 1.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2put h ALA 365 CO 0.09 0.14 0.13 0.35 0.00 0.00 0.00 179.25 179.95 2put h PHE 366 N 0.65 0.36 -0.82 0.00 3.04 -1.27 -2.93 116.94 115.97 2put h PHE 366 Ca 0.17 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.10 2put h PHE 366 Cb 0.02 -0.11 -0.04 0.00 2.56 0.00 0.00 35.95 38.38 2put h PHE 366 CO -0.02 0.34 0.47 -0.91 -2.02 0.00 0.00 178.31 176.17 2put h ASN 367 N 0.29 1.01 -0.97 0.41 2.35 -0.78 -1.08 115.58 116.81 2put h ASN 367 Ca 0.09 -0.07 0.05 0.00 -0.55 0.00 0.00 56.30 55.81 2put h ASN 367 Cb 0.11 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.16 2put h ASN 367 CO -0.01 0.79 0.62 0.74 -1.65 0.00 0.00 177.43 177.93 2put h THR 368 N 1.14 1.12 0.00 2.81 2.02 -0.93 -2.94 112.91 116.14 2put h THR 368 Ca 0.29 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2put h THR 368 Cb -0.01 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.25 2put h THR 368 CO -0.05 0.21 -0.21 0.23 0.37 0.00 0.00 175.52 176.07 2put n MET 369 N -4.50 0.28 -1.91 6.66 2.81 -0.71 -4.89 117.12 114.86 2put n MET 369 Ca 0.14 0.18 -0.42 0.00 -1.81 0.00 0.00 57.70 55.78 2put n MET 369 Cb 0.14 -1.77 -0.03 0.00 -0.71 0.00 0.00 33.22 30.84 2put n MET 369 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2put s ARG 370 N -3.12 4.20 0.00 0.03 3.52 -0.49 -1.21 118.95 121.87 2put s ARG 370 Ca 0.09 2.36 0.00 0.00 -0.13 0.00 0.00 55.73 58.05 2put s ARG 370 Cb 0.13 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 30.00 2put s ARG 370 CO 0.64 -0.72 0.00 0.41 -0.81 0.00 0.00 175.30 174.82 2put n GLY 371 N 3.97 0.82 0.00 8.12 0.00 -1.26 -4.83 105.19 112.01 2put n GLY 371 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2put n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2put n ARG 372 N -2.35 1.19 -4.33 1.61 1.74 -0.35 -4.87 116.66 109.30 2put n ARG 372 Ca 0.00 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.81 2put n ARG 372 Cb 0.00 -0.90 -0.17 0.00 -1.02 0.00 0.00 32.46 30.37 2put n ARG 372 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2put s ILE 373 N -1.73 1.26 -0.47 0.55 1.01 -1.11 0.09 121.20 120.81 2put s ILE 373 Ca 0.00 -0.50 -0.20 0.00 0.00 0.00 0.00 60.65 59.95 2put s ILE 373 Cb 0.00 -1.18 0.04 0.00 0.01 0.00 0.00 42.46 41.32 2put s ILE 373 CO 0.00 0.39 0.64 -0.62 0.00 0.00 0.00 174.94 175.35 2put s ASP 374 N 1.10 6.28 0.16 3.58 -1.08 0.10 -4.95 116.67 121.86 2put s ASP 374 Ca -0.06 -0.56 0.09 0.00 -0.52 0.00 0.00 52.55 51.51 2put s ASP 374 Cb -0.14 -2.31 -0.12 0.00 -1.46 0.00 0.00 42.92 38.88 2put s ASP 374 CO -0.02 -0.83 1.33 -0.26 0.52 0.00 0.00 175.17 175.91 2put h PHE 375 N 8.93 0.00 -0.19 -5.34 0.04 -1.95 0.16 116.94 118.59 2put h PHE 375 Ca -0.26 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.39 2put h PHE 375 Cb 1.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.25 2put h PHE 375 CO 0.74 0.88 -0.34 1.05 -0.60 0.00 0.00 178.31 180.03 2put h GLU 376 N 0.00 0.57 -0.00 1.51 9.09 -1.98 -3.28 114.58 120.49 2put h GLU 376 Ca -0.01 -0.36 0.00 0.00 0.05 0.00 0.00 59.36 59.04 2put h GLU 376 Cb 1.66 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.80 2put h GLU 376 CO 0.11 0.97 -0.32 0.09 0.05 0.00 0.00 179.01 179.91 2put n ASN 377 N -4.31 0.72 -3.49 3.06 3.02 -1.23 -4.97 115.26 108.07 2put n ASN 377 Ca -0.06 -0.56 -0.22 0.00 -0.03 0.00 0.00 54.58 53.71 2put n ASN 377 Cb 0.50 0.13 0.06 0.00 -0.61 0.00 0.00 39.78 39.85 2put n ASN 377 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2put s VAL 379 N -3.47 1.68 -0.19 0.00 1.01 -0.52 -4.93 120.40 113.99 2put s VAL 379 Ca 0.34 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.46 2put s VAL 379 Cb -0.08 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2put s VAL 379 CO 0.79 0.47 0.07 -0.69 0.00 0.00 0.00 175.10 175.74 2put s VAL 380 N 0.51 4.80 -0.20 2.92 1.01 -1.26 0.00 120.40 128.18 2put s VAL 380 Ca -0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2put s VAL 380 Cb -0.17 -3.17 0.05 0.00 0.00 0.00 0.00 36.38 33.10 2put s VAL 380 CO 0.06 0.45 -0.02 -0.89 0.00 0.00 0.00 175.10 174.71 2put s THR 381 N 0.42 1.03 -0.40 3.92 2.01 0.11 -4.84 115.64 117.89 2put s THR 381 Ca 0.03 -0.80 -0.09 0.00 0.31 0.00 0.00 61.69 61.15 2put s THR 381 Cb -0.12 -1.36 0.07 0.00 0.01 0.00 0.00 72.50 71.10 2put s THR 381 CO 0.00 -0.07 0.23 -0.76 -0.69 0.00 0.00 174.62 173.33 2put s LEU 382 N 1.64 4.98 0.28 4.42 1.43 -1.26 -4.47 118.68 125.70 2put s LEU 382 Ca -0.02 -1.42 -0.02 0.00 -1.03 0.00 0.00 54.13 51.64 2put s LEU 382 Cb -0.17 -1.97 0.38 0.00 0.03 0.00 0.00 46.19 44.46 2put s LEU 382 CO -0.07 -0.49 1.83 1.23 0.23 0.00 0.00 176.35 179.08 2put h GLY 383 N 8.37 0.94 1.24 -3.19 0.00 -1.95 -1.14 103.07 107.34 2put h GLY 383 Ca -0.23 -0.53 0.10 0.00 0.00 0.00 0.00 47.33 46.68 2put h GLY 383 CO 0.72 0.50 0.28 -1.33 0.00 0.00 0.00 176.54 176.71 2put h GLY 384 N 0.99 0.00 0.00 4.60 0.00 -1.94 -3.12 103.07 103.59 2put h GLY 384 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2put h GLY 384 CO -0.01 0.00 -0.86 1.04 0.00 0.00 0.00 176.54 176.72 2put n LEU 385 N -4.16 0.41 -0.18 3.11 4.77 -0.50 -3.92 117.00 116.53 2put n LEU 385 Ca 0.05 -0.36 -0.05 0.00 -0.03 0.00 0.00 56.01 55.63 2put n LEU 385 Cb 0.45 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 2put n LEU 385 CO 0.33 0.10 0.29 1.17 -1.33 0.00 0.00 177.39 177.95 2put n LYS 386 N -1.47 -0.19 -0.03 3.23 4.81 -0.81 0.05 118.16 123.75 2put n LYS 386 Ca 0.01 0.83 0.10 0.00 -0.87 0.00 0.00 58.31 58.38 2put n LYS 386 Cb 0.23 -1.22 0.49 0.00 0.02 0.00 0.00 35.03 34.55 2put n LYS 386 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2put n SER 387 N -4.14 0.75 -0.00 3.14 7.64 -1.26 -3.58 113.62 116.16 2put n SER 387 Ca 0.01 -1.52 0.03 0.00 1.01 0.00 0.00 58.87 58.40 2put n SER 387 Cb 0.11 -0.04 -0.04 0.00 -1.01 0.00 0.00 64.21 63.23 2put n SER 387 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2put n TRP 388 N -0.30 0.00 -0.24 1.43 7.02 0.11 -4.69 117.44 120.76 2put n TRP 388 Ca 0.15 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.57 2put n TRP 388 Cb 0.19 -0.01 0.04 0.00 -2.42 0.00 0.00 31.31 29.11 2put n TRP 388 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2put h LEU 389 N 0.00 0.88 -1.17 -0.99 3.38 -1.52 -1.06 115.31 114.82 2put h LEU 389 Ca 0.00 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2put h LEU 389 Cb 0.18 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2put h LEU 389 CO 0.00 0.76 0.07 0.77 0.09 0.00 0.00 178.44 180.13 2put h SER 390 N 0.93 0.60 -0.01 -0.43 4.64 -1.84 -0.72 113.55 116.72 2put h SER 390 Ca 0.23 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 2put h SER 390 Cb 0.11 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2put h SER 390 CO -0.03 0.62 -0.01 0.74 -0.87 0.00 0.00 176.83 177.28 2put h THR 391 N 0.63 1.39 -0.98 2.95 2.02 -1.73 -3.21 112.91 113.97 2put h THR 391 Ca 0.14 -1.17 0.17 0.00 0.77 0.00 0.00 66.41 66.32 2put h THR 391 Cb 0.29 2.15 -0.10 0.00 -1.74 0.00 0.00 68.15 68.75 2put h THR 391 CO 0.00 0.31 0.59 0.40 0.37 0.00 0.00 175.52 177.19 2put h ILE 392 N -0.45 0.75 0.00 3.11 2.04 -0.74 -0.02 117.51 122.20 2put h ILE 392 Ca 0.00 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 2put h ILE 392 Cb 0.51 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2put h ILE 392 CO 0.00 0.14 -0.03 0.03 0.00 0.00 0.00 178.15 178.29 2put h ARG 393 N 0.79 0.00 0.00 2.37 3.08 -1.15 -3.16 114.38 116.32 2put h ARG 393 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.60 2put h ARG 393 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 2put h ARG 393 CO -0.36 0.03 0.00 -0.09 -1.07 0.00 0.00 179.97 178.49 2put h ARG 394 N 0.00 0.00 -7.35 0.04 9.65 -0.99 -3.48 114.38 112.25 2put h ARG 394 Ca -0.00 0.00 -0.49 0.00 -1.10 0.00 0.00 59.98 58.39 2put h ARG 394 Cb 0.09 0.00 0.14 0.00 -1.39 0.00 0.00 29.97 28.80 2put h ARG 394 CO 0.00 0.00 0.28 0.00 2.80 0.00 0.00 179.97 183.05 2put h ARG 396 N -1.41 0.69 -2.61 0.00 2.43 -1.16 -3.48 114.38 108.86 2put h ARG 396 Ca -0.48 -0.25 0.09 0.00 -0.81 0.00 0.00 59.98 58.52 2put h ARG 396 Cb 1.27 -0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 30.67 2put h ARG 396 CO 0.55 0.83 0.37 -0.98 -1.51 0.00 0.00 179.97 179.24 2put s ARG 397 N -4.84 1.21 -0.11 0.20 1.70 -1.25 -4.50 118.95 111.37 2put s ARG 397 Ca -0.13 -0.57 -0.01 0.00 -0.47 0.00 0.00 55.73 54.55 2put s ARG 397 Cb 0.10 0.48 -0.03 0.00 -0.57 0.00 0.00 34.95 34.93 2put s ARG 397 CO 0.80 -0.54 -0.05 0.42 -1.08 0.00 0.00 175.30 174.85 2put s ILE 398 N -3.47 3.86 -0.18 4.99 1.01 0.04 -1.81 121.20 125.64 2put s ILE 398 Ca 0.07 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.33 2put s ILE 398 Cb -0.02 -2.63 0.02 0.00 0.01 0.00 0.00 42.46 39.83 2put s ILE 398 CO -0.04 0.55 -0.20 -0.63 0.00 0.00 0.00 174.94 174.63 2put s ILE 399 N -0.30 2.11 -0.15 2.92 1.01 -0.10 -1.42 121.20 125.26 2put s ILE 399 Ca 0.05 -0.93 -0.13 0.00 0.00 0.00 0.00 60.65 59.64 2put s ILE 399 Cb -0.13 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 2put s ILE 399 CO 0.02 0.54 0.26 -0.04 0.00 0.00 0.00 174.94 175.72 2put s MET 400 N 1.25 4.15 -0.05 2.79 -1.94 0.15 -0.16 119.30 125.48 2put s MET 400 Ca 0.04 0.04 0.02 0.00 -1.71 0.00 0.00 55.69 54.07 2put s MET 400 Cb -0.13 -3.39 0.02 0.00 2.01 0.00 0.00 34.83 33.33 2put s MET 400 CO -0.12 0.32 -0.08 0.42 -0.01 0.00 0.00 175.02 175.55 2put s ILE 401 N 0.22 0.83 0.10 2.53 1.01 0.91 -0.45 121.20 126.36 2put s ILE 401 Ca 0.15 -0.30 -0.26 0.00 0.00 0.00 0.00 60.65 60.23 2put s ILE 401 Cb -0.13 -0.79 0.08 0.00 0.01 0.00 0.00 42.46 41.63 2put s ILE 401 CO 0.03 0.29 1.08 0.00 0.00 0.00 0.00 174.94 176.34 2put s ALA 402 N 0.75 -1.84 0.15 9.38 0.00 -1.02 -2.49 121.76 126.69 2put s ALA 402 Ca -0.13 0.24 0.10 0.00 0.00 0.00 0.00 51.96 52.17 2put s ALA 402 Cb -0.15 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.51 2put s ALA 402 CO 0.02 -1.05 -0.23 0.00 0.00 0.00 0.00 175.76 174.50 2put n GLY 404 N 0.60 3.02 0.25 0.00 0.00 -1.26 -1.37 105.19 106.43 2put n GLY 404 Ca -0.15 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.78 2put n GLY 404 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2put h THR 405 N 0.00 1.04 -0.23 2.61 2.02 -1.98 -1.52 112.91 114.85 2put h THR 405 Ca 0.00 -0.18 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 2put h THR 405 Cb 0.00 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2put h THR 405 CO 0.00 0.05 -0.43 0.28 0.37 0.00 0.00 175.52 175.79 2put h SER 406 N 0.02 0.60 -0.97 4.18 0.02 -1.55 -1.49 113.55 114.35 2put h SER 406 Ca 0.00 -0.27 0.03 0.00 -0.84 0.00 0.00 61.79 60.71 2put h SER 406 Cb 0.09 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.41 2put h SER 406 CO 0.01 0.95 0.64 0.22 -1.14 0.00 0.00 176.83 177.51 2put h TYR 407 N 0.45 1.20 -0.66 3.45 3.20 -0.79 -2.67 116.97 121.15 2put h TYR 407 Ca 0.03 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 2put h TYR 407 Cb 0.94 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 2put h TYR 407 CO 0.04 0.70 0.19 0.45 -1.64 0.00 0.00 178.16 177.90 2put h HIS 408 N 1.24 1.05 0.00 -3.82 3.86 -0.68 -1.58 115.15 115.21 2put h HIS 408 Ca 0.38 -0.10 -0.04 0.00 -1.16 0.00 0.00 60.37 59.45 2put h HIS 408 Cb -0.02 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.14 2put h HIS 408 CO -0.00 0.84 -0.18 0.66 0.86 0.00 0.00 177.93 180.11 2put h SER 409 N 0.98 0.00 -0.14 2.45 4.64 -0.97 0.44 113.55 120.94 2put h SER 409 Ca 0.21 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.40 2put h SER 409 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2put h SER 409 CO -0.01 0.18 -0.43 0.00 -0.87 0.00 0.00 176.83 175.71 2put h LEU 411 N 0.16 0.95 -2.37 0.00 3.38 -0.69 0.24 115.31 116.97 2put h LEU 411 Ca -0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2put h LEU 411 Cb 1.05 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 2put h LEU 411 CO 0.09 0.76 -0.04 0.00 0.09 0.00 0.00 178.44 179.35 2put h ALA 412 N 1.39 1.30 0.00 1.53 0.00 -0.90 -3.12 119.26 119.46 2put h ALA 412 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2put h ALA 412 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2put h ALA 412 CO -0.04 0.05 0.00 0.25 0.00 0.00 0.00 179.25 179.50 2put n THR 413 N -3.56 0.14 -0.13 0.00 -2.24 -1.00 -4.76 114.28 102.73 2put n THR 413 Ca -0.02 -0.50 -0.04 0.00 -2.27 0.00 0.00 64.05 61.21 2put n THR 413 Cb 0.14 1.05 0.03 0.00 -2.10 0.00 0.00 70.33 69.44 2put n THR 413 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2put h ARG 414 N 0.00 0.05 -0.55 -0.78 2.43 -0.89 -2.46 114.38 112.17 2put h ARG 414 Ca 0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2put h ARG 414 Cb 0.15 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2put h ARG 414 CO 0.00 0.03 0.33 1.03 -1.51 0.00 0.00 179.97 179.85 2put h SER 415 N 0.05 0.66 -0.44 -3.80 0.87 -1.86 -1.16 113.55 107.88 2put h SER 415 Ca 0.20 -0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.60 2put h SER 415 Cb 0.31 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 2put h SER 415 CO -0.39 0.53 -0.08 -0.29 -0.53 0.00 0.00 176.83 176.08 2put h ILE 416 N 0.74 1.26 -0.24 2.23 6.09 -1.86 0.37 117.51 126.10 2put h ILE 416 Ca 0.20 -1.17 0.04 0.00 -1.37 0.00 0.00 64.86 62.55 2put h ILE 416 Cb -0.01 0.96 -0.03 0.00 0.47 0.00 0.00 36.82 38.21 2put h ILE 416 CO -0.04 0.41 0.02 -0.26 -3.07 0.00 0.00 178.15 175.21 2put h PHE 417 N 0.80 0.03 -0.30 2.19 0.04 -1.14 -0.25 116.94 118.32 2put h PHE 417 Ca 0.14 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 2put h PHE 417 Cb 0.59 0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 2put h PHE 417 CO 0.03 -0.01 0.11 0.93 -0.60 0.00 0.00 178.31 178.77 2put h GLU 418 N 0.10 0.45 -0.21 1.51 5.08 -0.70 -1.80 114.58 119.02 2put h GLU 418 Ca 0.11 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2put h GLU 418 Cb 0.13 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2put h GLU 418 CO -0.17 0.48 0.10 1.49 -1.00 0.00 0.00 179.01 179.91 2put h GLU 419 N 0.33 0.30 0.02 2.33 4.81 -0.12 -1.20 114.58 121.04 2put h GLU 419 Ca 0.10 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.08 2put h GLU 419 Cb 0.20 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2put h GLU 419 CO -0.01 0.32 -0.93 -0.07 -0.73 0.00 0.00 179.01 177.59 2put h LEU 420 N 0.21 0.17 0.00 1.64 3.38 -1.02 -3.36 115.31 116.32 2put h LEU 420 Ca 0.07 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 2put h LEU 420 Cb 0.12 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2put h LEU 420 CO -0.01 1.00 -2.07 0.35 0.09 0.00 0.00 178.44 177.81 2put n THR 421 N -3.57 0.57 -1.97 0.22 -2.24 -0.68 -4.69 114.28 101.92 2put n THR 421 Ca -0.03 -0.60 -0.20 0.00 -2.27 0.00 0.00 64.05 60.95 2put n THR 421 Cb 0.85 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.83 2put n THR 421 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2put n GLU 422 N -2.41 -1.50 -4.03 -0.78 1.02 -0.46 -5.00 120.64 107.49 2put n GLU 422 Ca -0.15 1.10 -0.36 0.00 -0.02 0.00 0.00 57.16 57.72 2put n GLU 422 Cb 0.78 -5.58 -0.08 0.00 -0.02 0.00 0.00 31.44 26.54 2put n GLU 422 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2put s ILE 423 N -2.87 5.02 0.28 -3.67 1.01 -1.26 -5.07 121.20 114.64 2put s ILE 423 Ca 0.00 0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.38 2put s ILE 423 Cb 0.00 -3.19 -0.12 0.00 0.01 0.00 0.00 42.46 39.16 2put s ILE 423 CO 0.00 0.57 1.56 -2.65 0.00 0.00 0.00 174.94 174.42 2put n PRO 424 N 2.48 2.56 -4.33 2.79 -0.02 -1.26 -4.57 135.00 132.65 2put n PRO 424 Ca -0.19 0.91 -0.28 0.00 -2.02 0.00 0.00 63.50 61.93 2put n PRO 424 Cb 0.54 -2.67 -0.17 0.00 -0.02 0.00 0.00 33.50 31.18 2put n PRO 424 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2put s VAL 425 N 0.01 1.35 0.25 -1.45 1.01 -1.26 -0.78 120.40 119.54 2put s VAL 425 Ca 0.65 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 62.19 2put s VAL 425 Cb -0.53 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2put s VAL 425 CO 0.48 0.41 -0.15 -0.94 0.00 0.00 0.00 175.10 174.91 2put s SER 426 N 1.12 3.86 -0.12 3.32 1.04 -0.51 -5.00 113.70 117.41 2put s SER 426 Ca -0.05 -0.87 0.01 0.00 0.48 0.00 0.00 55.95 55.53 2put s SER 426 Cb -0.14 -0.47 0.02 0.00 0.10 0.00 0.00 66.02 65.53 2put s SER 426 CO -0.03 0.05 -0.14 -0.69 0.98 0.00 0.00 173.24 173.41 2put s VAL 427 N -2.25 1.49 -0.02 5.02 1.01 -1.26 -0.68 120.40 123.71 2put s VAL 427 Ca 0.28 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.71 2put s VAL 427 Cb -0.06 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 2put s VAL 427 CO 0.15 0.44 -0.21 -1.61 0.00 0.00 0.00 175.10 173.88 2put s GLU 428 N 1.17 1.79 -0.00 2.72 0.41 0.41 -4.96 118.70 120.22 2put s GLU 428 Ca -0.03 -0.75 -0.30 0.00 -0.41 0.00 0.00 54.97 53.49 2put s GLU 428 Cb -0.14 -1.68 -0.04 0.00 -1.78 0.00 0.00 34.13 30.49 2put s GLU 428 CO -0.05 0.42 1.09 -1.17 -0.49 0.00 0.00 175.26 175.06 2put s LEU 429 N -0.40 4.34 0.26 1.80 2.96 -1.26 -2.44 118.68 123.95 2put s LEU 429 Ca 0.06 1.78 -0.01 0.00 -0.22 0.00 0.00 54.13 55.73 2put s LEU 429 Cb -0.09 -3.57 0.49 0.00 0.50 0.00 0.00 46.19 43.52 2put s LEU 429 CO -0.00 -0.40 1.80 0.00 -1.32 0.00 0.00 176.35 176.43 2put h ALA 430 N 6.95 1.32 -0.31 5.97 0.00 -1.28 0.06 119.26 131.96 2put h ALA 430 Ca -0.39 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 2put h ALA 430 Cb 1.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2put h ALA 430 CO 0.80 0.08 -0.13 0.66 0.00 0.00 0.00 179.25 180.67 2put h SER 431 N 0.80 0.65 -0.25 0.00 4.64 -1.85 -1.82 113.55 115.73 2put h SER 431 Ca 0.45 -0.40 -0.13 0.00 -0.47 0.00 0.00 61.79 61.25 2put h SER 431 Cb 0.49 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2put h SER 431 CO -0.29 0.90 -0.30 -0.78 -0.87 0.00 0.00 176.83 175.49 2put h ASP 432 N 0.40 0.78 -0.47 4.97 3.58 -1.82 0.20 116.42 124.07 2put h ASP 432 Ca 0.07 -0.31 0.07 0.00 0.42 0.00 0.00 57.03 57.28 2put h ASP 432 Cb 0.64 -0.22 -0.06 0.00 1.72 0.00 0.00 39.33 41.42 2put h ASP 432 CO 0.04 1.03 0.14 0.15 -2.88 0.00 0.00 179.24 177.72 2put h PHE 433 N 0.64 0.24 -0.30 0.28 3.57 -0.88 -1.26 116.94 119.24 2put h PHE 433 Ca 0.07 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2put h PHE 433 Cb 0.82 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 2put h PHE 433 CO 0.04 0.06 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.08 2put h LEU 434 N 0.30 0.54 -0.98 0.59 3.38 -1.08 -2.79 115.31 115.27 2put h LEU 434 Ca 0.22 -0.34 0.15 0.00 0.09 0.00 0.00 57.88 58.00 2put h LEU 434 Cb 0.25 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 40.76 2put h LEU 434 CO -0.25 0.75 0.60 0.44 0.09 0.00 0.00 178.44 180.07 2put h ASP 435 N 0.32 0.84 1.20 -0.43 3.32 -0.23 -1.05 116.42 120.39 2put h ASP 435 Ca 0.08 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2put h ASP 435 Cb 0.49 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2put h ASP 435 CO 0.02 0.39 0.00 0.54 -1.72 0.00 0.00 179.24 178.47 2put n ARG 436 N -4.70 0.15 -3.96 3.56 1.74 -0.51 -4.93 116.66 108.01 2put n ARG 436 Ca 0.20 0.15 -0.28 0.00 -0.77 0.00 0.00 57.85 57.15 2put n ARG 436 Cb 0.43 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2put n ARG 436 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2put n ARG 437 N -1.94 -4.16 -1.70 5.56 1.74 -0.40 -4.82 116.66 110.94 2put n ARG 437 Ca 0.06 0.49 -0.43 0.00 -0.77 0.00 0.00 57.85 57.19 2put n ARG 437 Cb 0.37 -5.04 -0.03 0.00 -1.02 0.00 0.00 32.46 26.74 2put n ARG 437 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2put n SER 438 N -2.88 3.87 -4.77 0.55 2.88 -1.09 -4.89 113.62 107.28 2put n SER 438 Ca -0.13 1.02 -0.40 0.00 -1.33 0.00 0.00 58.87 58.04 2put n SER 438 Cb 0.60 -1.53 0.01 0.00 -0.75 0.00 0.00 64.21 62.53 2put n SER 438 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 2put s PRO 439 N 2.07 3.84 0.02 -1.46 0.02 -1.26 -5.02 135.00 133.22 2put s PRO 439 Ca 0.80 2.31 0.03 0.00 0.02 0.00 0.00 61.00 64.16 2put s PRO 439 Cb -0.53 -2.73 -0.02 0.00 0.02 0.00 0.00 34.50 31.25 2put s PRO 439 CO 0.37 -0.65 -0.11 0.08 -0.33 0.00 0.00 177.00 176.36 2put s VAL 440 N -1.22 0.83 0.26 3.83 1.01 -1.26 -5.16 120.40 118.69 2put s VAL 440 Ca 0.58 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.81 2put s VAL 440 Cb -0.41 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2put s VAL 440 CO 0.53 0.00 0.14 -0.36 0.00 0.00 0.00 175.10 175.41 2put s PHE 441 N -0.70 1.48 0.37 5.22 0.08 -1.26 -4.86 117.98 118.31 2put s PHE 441 Ca 0.00 -1.33 0.17 0.00 0.12 0.00 0.00 56.93 55.90 2put s PHE 441 Cb -0.06 -0.79 1.10 0.00 -0.57 0.00 0.00 43.02 42.70 2put s PHE 441 CO 0.00 -0.51 1.72 -0.09 -0.10 0.00 0.00 175.22 176.24 2put h ARG 442 N 2.37 0.36 -0.36 0.44 2.43 -1.71 -1.34 114.38 116.57 2put h ARG 442 Ca -0.35 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2put h ARG 442 Cb 1.25 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2put h ARG 442 CO 0.54 0.24 0.00 -0.40 -1.51 0.00 0.00 179.97 178.84 2put n ASP 443 N -4.78 1.90 -4.87 -3.80 5.75 -1.26 -4.29 116.55 105.20 2put n ASP 443 Ca 0.29 -2.01 -0.36 0.00 -0.01 0.00 0.00 54.79 52.70 2put n ASP 443 Cb 0.96 -0.24 -0.06 0.00 -1.03 0.00 0.00 41.12 40.75 2put n ASP 443 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2put s ASP 444 N -0.99 6.53 -0.24 -1.12 1.01 -0.50 -0.49 116.67 120.87 2put s ASP 444 Ca 0.24 0.62 -0.05 0.00 0.71 0.00 0.00 52.55 54.06 2put s ASP 444 Cb 0.12 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.92 2put s ASP 444 CO 0.16 0.29 0.01 -0.89 0.21 0.00 0.00 175.17 174.95 2put s THR 445 N -1.22 3.77 -0.22 -1.27 2.01 -0.75 -2.09 115.64 115.86 2put s THR 445 Ca 0.25 -0.38 -0.05 0.00 0.31 0.00 0.00 61.69 61.81 2put s THR 445 Cb -0.14 -2.75 -0.02 0.00 0.01 0.00 0.00 72.50 69.60 2put s THR 445 CO 0.13 0.37 0.01 0.00 -0.69 0.00 0.00 174.62 174.44 2put s VAL 447 N 1.35 4.27 -0.22 0.00 1.01 0.77 -0.98 120.40 126.60 2put s VAL 447 Ca 0.04 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 61.78 2put s VAL 447 Cb -0.15 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.22 2put s VAL 447 CO 0.01 0.35 0.01 -0.36 0.00 0.00 0.00 175.10 175.11 2put s PHE 448 N 1.51 3.02 -0.19 5.22 0.40 0.13 -0.06 117.98 128.01 2put s PHE 448 Ca 0.06 -0.61 -0.05 0.00 -0.60 0.00 0.00 56.93 55.73 2put s PHE 448 Cb -0.15 -2.14 -0.02 0.00 0.51 0.00 0.00 43.02 41.22 2put s PHE 448 CO 0.03 -0.38 -0.01 0.08 0.70 0.00 0.00 175.22 175.64 2put s VAL 449 N 1.35 3.94 -0.24 -0.44 1.01 -1.04 -0.50 120.40 124.48 2put s VAL 449 Ca 0.04 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2put s VAL 449 Cb -0.15 -2.77 0.09 0.00 0.00 0.00 0.00 36.38 33.55 2put s VAL 449 CO 0.01 0.44 0.57 -0.55 0.00 0.00 0.00 175.10 175.57 2put s SER 450 N 0.88 -0.78 0.02 3.32 0.15 -0.33 -4.50 113.70 112.45 2put s SER 450 Ca 0.01 1.30 -0.26 0.00 0.70 0.00 0.00 55.95 57.69 2put s SER 450 Cb -0.14 1.40 -0.16 0.00 -1.71 0.00 0.00 66.02 65.41 2put s SER 450 CO 0.02 -0.22 1.23 -0.61 1.20 0.00 0.00 173.24 174.86 2put h GLN 451 N 7.39 -0.57 0.00 5.44 -0.00 -1.95 -2.79 115.11 122.64 2put h GLN 451 Ca -0.27 0.04 -0.13 0.00 -0.00 0.00 0.00 58.65 58.29 2put h GLN 451 Cb 1.18 0.13 -0.02 0.00 0.00 0.00 0.00 27.48 28.77 2put h GLN 451 CO 0.18 -0.27 -0.60 0.66 0.00 0.00 0.00 178.83 178.80 2put h SER 452 N -0.90 0.00 -0.46 -0.69 4.64 -1.96 -1.80 113.55 112.38 2put h SER 452 Ca -0.06 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.06 2put h SER 452 Cb 0.57 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.58 2put h SER 452 CO 0.10 0.60 -0.18 0.61 -0.87 0.00 0.00 176.83 177.09 2put n GLY 453 N 0.27 1.06 0.00 -0.77 0.00 -1.25 -4.44 105.19 100.06 2put n GLY 453 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2put n GLY 453 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2put n GLU 454 N -1.79 0.40 -1.92 1.61 -0.58 -1.26 -1.54 120.64 115.56 2put n GLU 454 Ca -0.10 -0.57 -0.42 0.00 -0.42 0.00 0.00 57.16 55.65 2put n GLU 454 Cb 0.44 -0.73 -0.03 0.00 -0.57 0.00 0.00 31.44 30.55 2put n GLU 454 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2put s THR 455 N -0.21 2.89 0.17 2.62 2.01 -1.26 -4.88 115.64 116.97 2put s THR 455 Ca 0.00 0.45 -0.15 0.00 0.31 0.00 0.00 61.69 62.30 2put s THR 455 Cb 0.00 -3.29 0.06 0.00 0.01 0.00 0.00 72.50 69.28 2put s THR 455 CO 0.00 0.01 1.73 0.00 -0.69 0.00 0.00 174.62 175.67 2put h ALA 456 N 7.91 0.47 0.00 7.40 0.00 -1.99 -0.68 119.26 132.37 2put h ALA 456 Ca -0.43 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 2put h ALA 456 Cb 1.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2put h ALA 456 CO 0.93 -0.29 -0.41 -0.44 0.00 0.00 0.00 179.25 179.03 2put h ASP 457 N 0.25 0.00 0.08 0.00 3.32 -1.97 -1.46 116.42 116.65 2put h ASP 457 Ca 0.20 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.06 2put h ASP 457 Cb 0.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 2put h ASP 457 CO -0.24 0.41 -0.71 0.28 -1.72 0.00 0.00 179.24 177.27 2put h SER 458 N 0.00 0.66 -0.26 6.45 0.02 -1.68 -1.18 113.55 117.56 2put h SER 458 Ca -0.00 -0.42 -0.03 0.00 -0.84 0.00 0.00 61.79 60.50 2put h SER 458 Cb 0.78 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 2put h SER 458 CO 0.05 1.17 0.04 0.40 -1.14 0.00 0.00 176.83 177.36 2put h ILE 459 N 0.39 1.23 -0.53 3.27 1.08 -0.98 -0.85 117.51 121.12 2put h ILE 459 Ca -0.03 -0.77 -0.04 0.00 -0.39 0.00 0.00 64.86 63.63 2put h ILE 459 Cb 1.30 1.23 -0.03 0.00 -3.07 0.00 0.00 36.82 36.26 2put h ILE 459 CO 0.13 0.25 0.18 -0.07 -0.69 0.00 0.00 178.15 177.95 2put h LEU 460 N 0.24 0.72 -0.47 1.44 3.38 -1.23 -0.77 115.31 118.62 2put h LEU 460 Ca 0.08 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 2put h LEU 460 Cb 0.33 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2put h LEU 460 CO 0.00 0.67 -0.25 0.00 0.09 0.00 0.00 178.44 178.96 2put h ALA 461 N 1.43 0.66 -0.53 1.53 0.00 -1.09 -1.32 119.26 119.93 2put h ALA 461 Ca 0.18 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2put h ALA 461 Cb 0.20 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2put h ALA 461 CO -0.01 0.68 0.30 1.25 0.00 0.00 0.00 179.25 181.47 2put h LEU 462 N 0.85 0.65 -0.78 0.00 5.85 -0.61 -1.94 115.31 119.34 2put h LEU 462 Ca 0.10 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 2put h LEU 462 Cb 0.84 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 2put h LEU 462 CO 0.07 0.54 -0.07 1.56 -0.34 0.00 0.00 178.44 180.20 2put h GLN 463 N 0.71 0.85 -0.13 1.25 4.20 -0.97 0.10 115.11 121.13 2put h GLN 463 Ca 0.19 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.65 2put h GLN 463 Cb 0.02 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2put h GLN 463 CO -0.03 0.90 -0.05 -0.92 -0.67 0.00 0.00 178.83 178.06 2put h TYR 464 N 0.78 -0.10 -0.37 2.96 5.03 -1.11 -1.06 116.97 123.09 2put h TYR 464 Ca 0.14 0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.35 2put h TYR 464 Cb 0.57 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.90 2put h TYR 464 CO 0.03 -0.08 -0.21 0.00 -1.32 0.00 0.00 178.16 176.59 2put h LEU 466 N 0.63 0.12 -2.09 0.00 3.38 -0.59 -2.25 115.31 114.51 2put h LEU 466 Ca 0.09 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 57.98 2put h LEU 466 Cb 0.70 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2put h LEU 466 CO 0.05 0.26 0.28 -0.33 0.09 0.00 0.00 178.44 178.79 2put h GLU 467 N -0.03 0.00 -0.02 1.13 5.08 -1.16 -1.47 114.58 118.11 2put h GLU 467 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2put h GLU 467 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2put h GLU 467 CO -0.00 0.00 -0.15 0.54 -1.00 0.00 0.00 179.01 178.39 2put n ARG 468 N -4.05 1.47 -0.55 2.33 1.74 -0.99 -4.94 116.66 111.67 2put n ARG 468 Ca 0.05 -1.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.11 2put n ARG 468 Cb 0.44 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 2put n ARG 468 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2put n GLY 469 N 1.30 0.73 3.76 -0.13 0.00 -0.55 -3.78 105.19 106.51 2put n GLY 469 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2put n GLY 469 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2put s ALA 470 N -2.05 2.33 0.02 4.61 0.00 -0.88 -4.11 121.76 121.67 2put s ALA 470 Ca 0.00 0.43 -0.26 0.00 0.00 0.00 0.00 51.96 52.13 2put s ALA 470 Cb 0.00 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 2put s ALA 470 CO 0.00 -1.57 0.81 -1.17 0.00 0.00 0.00 175.76 173.84 2put s LEU 471 N -5.41 4.41 0.01 0.00 2.96 -0.89 -4.69 118.68 115.07 2put s LEU 471 Ca 0.65 1.47 0.08 0.00 -0.22 0.00 0.00 54.13 56.10 2put s LEU 471 Cb -0.19 -3.30 -0.02 0.00 0.50 0.00 0.00 46.19 43.17 2put s LEU 471 CO 0.49 -0.07 -0.25 0.42 -1.32 0.00 0.00 176.35 175.62 2put s THR 472 N 0.34 1.97 -0.04 3.68 -4.23 -1.26 -0.66 115.64 115.44 2put s THR 472 Ca 0.42 -1.19 0.01 0.00 -1.18 0.00 0.00 61.69 59.75 2put s THR 472 Cb -0.20 -1.66 0.02 0.00 1.34 0.00 0.00 72.50 72.00 2put s THR 472 CO 0.24 0.44 -0.04 -0.69 -0.54 0.00 0.00 174.62 174.02 2put s VAL 473 N -0.68 0.49 -0.08 2.29 1.01 -0.16 -2.14 120.40 121.13 2put s VAL 473 Ca 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 2put s VAL 473 Cb -0.10 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 2put s VAL 473 CO 0.00 0.21 -0.02 -0.83 0.00 0.00 0.00 175.10 174.47 2put s GLY 474 N 0.88 1.81 -0.38 4.51 0.00 -0.11 0.19 107.32 114.21 2put s GLY 474 Ca -0.11 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 43.80 2put s GLY 474 CO 0.00 -0.60 0.11 -0.42 0.00 0.00 0.00 173.10 172.19 2put s ILE 475 N -0.86 2.05 0.01 0.90 -1.09 0.34 -0.50 121.20 122.05 2put s ILE 475 Ca 0.13 -2.39 0.02 0.00 -2.23 0.00 0.00 60.65 56.18 2put s ILE 475 Cb -0.11 -2.50 -0.01 0.00 -1.58 0.00 0.00 42.46 38.26 2put s ILE 475 CO 0.02 -0.67 -0.07 -0.69 -1.23 0.00 0.00 174.94 172.31 2put s VAL 476 N 0.76 0.49 -0.15 2.92 1.01 -0.90 -1.19 120.40 123.35 2put s VAL 476 Ca 0.12 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 2put s VAL 476 Cb -0.20 -0.47 -0.24 0.00 0.00 0.00 0.00 36.38 35.46 2put s VAL 476 CO -0.09 -0.05 0.30 -3.20 0.00 0.00 0.00 175.10 172.05 2put n ASN 477 N 2.40 2.06 -4.60 3.32 5.15 -0.95 -0.67 115.26 121.97 2put n ASN 477 Ca -0.16 0.25 -0.43 0.00 -0.60 0.00 0.00 54.58 53.64 2put n ASN 477 Cb 0.57 -0.87 -0.02 0.00 -0.53 0.00 0.00 39.78 38.92 2put n ASN 477 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2put s SER 478 N -6.99 6.55 0.17 1.20 0.01 -0.72 -4.65 113.70 109.27 2put s SER 478 Ca -0.25 0.50 -0.32 0.00 1.31 0.00 0.00 55.95 57.19 2put s SER 478 Cb 0.07 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.64 2put s SER 478 CO 0.72 -1.32 1.62 -0.69 0.41 0.00 0.00 173.24 173.97 2put s VAL 479 N 4.73 2.46 -0.08 3.43 1.01 -1.26 -2.19 120.40 128.50 2put s VAL 479 Ca 0.50 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.80 2put s VAL 479 Cb -0.08 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2put s VAL 479 CO 0.31 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2put n GLY 480 N 3.83 0.48 3.75 4.51 0.00 -1.26 -5.03 105.19 111.47 2put n GLY 480 Ca 0.15 -0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2put n GLY 480 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2put s SER 481 N -2.27 3.46 0.27 1.61 1.04 -0.93 -4.65 113.70 112.23 2put s SER 481 Ca 0.00 1.20 -0.03 0.00 0.48 0.00 0.00 55.95 57.61 2put s SER 481 Cb 0.00 -1.86 0.57 0.00 0.10 0.00 0.00 66.02 64.82 2put s SER 481 CO 0.00 -2.61 1.64 0.28 0.98 0.00 0.00 173.24 173.53 2put h SER 482 N -1.53 -0.20 0.30 7.02 0.02 -1.86 0.08 113.55 117.38 2put h SER 482 Ca -0.51 0.20 -0.19 0.00 -0.84 0.00 0.00 61.79 60.46 2put h SER 482 Cb 1.31 0.31 -0.01 0.00 0.14 0.00 0.00 62.40 64.16 2put h SER 482 CO 0.59 -0.17 -0.75 0.24 -1.14 0.00 0.00 176.83 175.59 2put h MET 483 N 0.15 0.37 0.29 3.45 2.07 -1.64 -0.16 114.93 119.47 2put h MET 483 Ca 0.48 -0.32 -0.01 0.00 -2.07 0.00 0.00 59.70 57.78 2put h MET 483 Cb 0.91 0.07 0.00 0.00 -1.87 0.00 0.00 31.60 30.71 2put h MET 483 CO -0.67 0.97 -0.14 1.03 1.07 0.00 0.00 176.91 179.17 2put h SER 484 N 0.25 -0.33 -0.38 1.22 0.87 -1.56 -2.57 113.55 111.05 2put h SER 484 Ca -0.03 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2put h SER 484 Cb 1.34 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.36 2put h SER 484 CO 0.13 -0.13 0.25 0.03 -0.53 0.00 0.00 176.83 176.57 2put h ARG 485 N -0.51 0.51 0.00 2.24 3.08 -0.91 -3.29 114.38 115.50 2put h ARG 485 Ca -0.04 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2put h ARG 485 Cb 0.38 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2put h ARG 485 CO 0.06 0.35 -0.57 1.96 -1.07 0.00 0.00 179.97 180.70 2put h GLN 486 N 0.51 0.00 -7.15 0.04 4.20 -1.06 -3.44 115.11 108.22 2put h GLN 486 Ca 0.14 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.35 2put h GLN 486 Cb -0.04 0.00 0.08 0.00 0.30 0.00 0.00 27.48 27.81 2put h GLN 486 CO -0.03 0.00 0.40 0.95 -0.67 0.00 0.00 178.83 179.48 2put s THR 487 N -3.19 3.39 0.21 -0.54 -4.23 -0.97 -4.96 115.64 105.35 2put s THR 487 Ca 0.06 0.74 -0.07 0.00 -1.18 0.00 0.00 61.69 61.24 2put s THR 487 Cb 0.12 -3.26 0.10 0.00 1.34 0.00 0.00 72.50 70.80 2put s THR 487 CO 0.71 -0.31 1.70 0.45 -0.54 0.00 0.00 174.62 176.64 2put h HIS 488 N 0.67 1.12 -3.13 3.99 3.86 -1.73 -3.47 115.15 116.46 2put h HIS 488 Ca -0.48 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 58.56 2put h HIS 488 Cb 1.24 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 29.38 2put h HIS 488 CO 0.55 0.95 0.20 0.00 0.86 0.00 0.00 177.93 180.48 2put n GLY 490 N -0.50 -1.61 2.95 0.00 0.00 -1.25 -0.94 105.19 103.84 2put n GLY 490 Ca -0.06 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 2put n GLY 490 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2put s VAL 491 N -2.70 0.97 -0.14 1.61 1.01 0.35 -4.12 120.40 117.39 2put s VAL 491 Ca 0.00 -0.33 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 2put s VAL 491 Cb 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 2put s VAL 491 CO 0.00 0.33 0.72 -1.00 0.00 0.00 0.00 175.10 175.16 2put s HIS 492 N 1.10 3.47 -0.30 5.22 0.09 -1.26 -2.11 115.29 121.50 2put s HIS 492 Ca -0.07 1.16 0.28 0.00 -0.00 0.00 0.00 55.06 56.42 2put s HIS 492 Cb -0.14 -2.87 0.92 0.00 -0.00 0.00 0.00 32.58 30.49 2put s HIS 492 CO -0.01 -0.10 1.80 -0.84 -0.00 0.00 0.00 174.74 175.59 2put h ILE 493 N 5.02 0.00 -3.68 0.60 3.07 -1.17 -3.47 117.51 117.88 2put h ILE 493 Ca -0.34 -0.58 -0.33 0.00 1.55 0.00 0.00 64.86 65.15 2put h ILE 493 Cb 1.16 1.53 0.05 0.00 -0.27 0.00 0.00 36.82 39.29 2put h ILE 493 CO 0.79 0.00 -0.50 0.59 -1.05 0.00 0.00 178.15 177.98 2put n ASN 494 N -2.79 -5.31 0.01 2.16 3.02 -1.26 -4.07 115.26 107.02 2put n ASN 494 Ca 0.03 -0.23 0.13 0.00 -0.03 0.00 0.00 54.58 54.48 2put n ASN 494 Cb 0.37 -4.16 0.49 0.00 -0.61 0.00 0.00 39.78 35.87 2put n ASN 494 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2put n ALA 495 N -3.18 2.69 0.00 5.41 0.00 -1.26 -3.87 120.51 120.31 2put n ALA 495 Ca -0.10 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2put n ALA 495 Cb 0.60 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2put n ALA 495 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2put n GLY 496 N 1.48 -1.84 3.77 0.00 0.00 -1.26 -4.81 105.19 102.53 2put n GLY 496 Ca 0.06 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 2put n GLY 496 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2put s PRO 497 N -2.24 3.82 -0.34 1.61 0.02 -1.26 -4.99 135.00 131.62 2put s PRO 497 Ca 0.00 2.33 -0.09 0.00 0.02 0.00 0.00 61.00 63.26 2put s PRO 497 Cb 0.00 -2.71 0.02 0.00 0.02 0.00 0.00 34.50 31.83 2put s PRO 497 CO 0.00 -0.68 0.16 -2.00 -0.33 0.00 0.00 177.00 174.15 2put s GLU 498 N -2.35 2.90 -0.13 5.54 2.12 -1.26 -4.95 118.70 120.57 2put s GLU 498 Ca 0.59 -1.01 0.07 0.00 0.36 0.00 0.00 54.97 54.98 2put s GLU 498 Cb -0.42 -3.59 -0.23 0.00 0.26 0.00 0.00 34.13 30.15 2put s GLU 498 CO 0.54 -0.61 0.33 -0.89 -0.54 0.00 0.00 175.26 174.09 2put n ILE 499 N 4.93 1.59 -1.30 -3.70 2.08 -1.26 -4.95 119.36 116.75 2put n ILE 499 Ca -0.13 -0.74 -0.36 0.00 0.56 0.00 0.00 62.75 62.08 2put n ILE 499 Cb 0.46 -1.14 0.08 0.00 -0.75 0.00 0.00 39.64 38.29 2put n ILE 499 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2put n GLY 500 N 1.81 -1.01 0.12 7.39 0.00 -1.26 -4.93 105.19 107.32 2put n GLY 500 Ca -0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 2put n GLY 500 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2put h VAL 501 N -0.33 1.25 -3.22 1.61 2.07 -1.87 -3.45 116.25 112.31 2put h VAL 501 Ca -0.46 -2.46 -0.64 0.00 0.82 0.00 0.00 66.70 63.95 2put h VAL 501 Cb 1.34 2.42 -0.16 0.00 -1.52 0.00 0.00 31.29 33.37 2put h VAL 501 CO 0.45 0.65 -0.77 0.00 0.02 0.00 0.00 177.57 177.92 2put s ALA 502 N -3.12 2.79 -0.05 1.67 0.00 -1.26 -5.09 121.76 116.70 2put s ALA 502 Ca 0.01 -1.48 -0.30 0.00 0.00 0.00 0.00 51.96 50.19 2put s ALA 502 Cb 0.10 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 2put s ALA 502 CO 0.76 0.49 1.18 0.45 0.00 0.00 0.00 175.76 178.64 2put s SER 503 N -2.63 7.07 0.00 0.00 0.15 -1.26 -4.87 113.70 112.17 2put s SER 503 Ca 0.22 1.80 0.00 0.00 0.70 0.00 0.00 55.95 58.67 2put s SER 503 Cb -0.09 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2put s SER 503 CO 0.13 -0.56 0.00 0.35 1.20 0.00 0.00 173.24 174.36 2put n THR 504 N 4.55 0.00 0.26 6.45 -2.24 -1.26 -4.68 114.28 117.37 2put n THR 504 Ca 0.11 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.99 2put n THR 504 Cb 0.46 -0.60 0.70 0.00 -2.10 0.00 0.00 70.33 68.79 2put n THR 504 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2put h LYS 505 N 0.00 0.00 -0.46 -0.78 2.10 -1.90 -2.01 116.57 113.52 2put h LYS 505 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.54 2put h LYS 505 Cb 0.00 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.31 2put h LYS 505 CO 0.00 0.11 -0.16 0.00 -2.00 0.00 0.00 179.45 177.40 2put h ALA 506 N 1.89 0.85 0.02 0.07 0.00 -1.94 -0.42 119.26 119.73 2put h ALA 506 Ca -0.00 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.56 2put h ALA 506 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2put h ALA 506 CO 0.01 0.64 -0.08 -0.92 0.00 0.00 0.00 179.25 178.91 2put h TYR 507 N 0.78 -0.19 -0.06 0.00 3.20 -1.64 0.16 116.97 119.22 2put h TYR 507 Ca 0.12 0.01 -0.18 0.00 3.14 0.00 0.00 58.73 61.82 2put h TYR 507 Cb 0.69 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2put h TYR 507 CO 0.04 -0.12 -0.72 1.79 -1.64 0.00 0.00 178.16 177.51 2put h THR 508 N -0.14 1.40 -0.19 1.81 1.35 -1.43 -1.31 112.91 114.40 2put h THR 508 Ca 0.03 -2.17 -0.19 0.00 -0.55 0.00 0.00 66.41 63.52 2put h THR 508 Cb 0.17 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2put h THR 508 CO -0.07 0.65 -0.66 0.28 -0.25 0.00 0.00 175.52 175.47 2put h SER 509 N 0.22 0.82 -0.54 5.36 0.02 -0.99 -1.00 113.55 117.44 2put h SER 509 Ca -0.03 -0.49 0.04 0.00 -0.84 0.00 0.00 61.79 60.48 2put h SER 509 Cb 1.28 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 63.54 2put h SER 509 CO 0.12 1.26 0.28 1.56 -1.14 0.00 0.00 176.83 178.91 2put h GLN 510 N 0.52 0.53 -0.03 3.45 4.20 -0.54 -0.93 115.11 122.31 2put h GLN 510 Ca -0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2put h GLN 510 Cb 1.25 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.91 2put h GLN 510 CO 0.13 0.35 0.01 -0.92 -0.67 0.00 0.00 178.83 177.74 2put h TYR 511 N 0.55 0.05 -0.88 2.96 5.03 -1.12 0.17 116.97 123.72 2put h TYR 511 Ca 0.24 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.57 2put h TYR 511 Cb 0.13 -0.01 -0.05 0.00 1.55 0.00 0.00 36.73 38.35 2put h TYR 511 CO -0.09 0.19 0.57 0.82 -1.32 0.00 0.00 178.16 178.33 2put h ILE 512 N -0.10 1.16 -0.74 1.81 2.04 -1.03 -0.88 117.51 119.77 2put h ILE 512 Ca 0.01 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2put h ILE 512 Cb 0.16 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 2put h ILE 512 CO -0.00 0.21 0.38 0.00 0.00 0.00 0.00 178.15 178.74 2put h ALA 513 N 1.36 0.96 -0.53 1.87 0.00 -0.85 -0.09 119.26 121.97 2put h ALA 513 Ca 0.35 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2put h ALA 513 Cb -0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2put h ALA 513 CO -0.11 0.50 -0.07 -0.07 0.00 0.00 0.00 179.25 179.49 2put h LEU 514 N 1.04 0.98 -0.46 0.00 3.38 -0.18 -0.31 115.31 119.77 2put h LEU 514 Ca 0.26 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2put h LEU 514 Cb 0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2put h LEU 514 CO -0.04 1.09 0.27 0.58 0.09 0.00 0.00 178.44 180.43 2put h VAL 515 N 0.86 1.15 -0.83 1.22 2.07 -0.82 -0.79 116.25 119.10 2put h VAL 515 Ca 0.14 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.33 2put h VAL 515 Cb 0.63 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2put h VAL 515 CO 0.04 0.15 0.55 0.24 0.02 0.00 0.00 177.57 178.57 2put h MET 516 N 0.61 1.08 -0.23 1.57 2.86 -0.67 -0.54 114.93 119.60 2put h MET 516 Ca 0.16 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2put h MET 516 Cb 0.00 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.41 2put h MET 516 CO -0.03 0.72 0.10 0.35 1.06 0.00 0.00 176.91 179.10 2put h PHE 517 N 1.11 0.35 -0.48 -0.22 3.57 -0.66 -0.94 116.94 119.66 2put h PHE 517 Ca 0.31 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.82 2put h PHE 517 Cb -0.10 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.50 2put h PHE 517 CO -0.00 0.36 0.27 0.00 -2.23 0.00 0.00 178.31 176.71 2put h ALA 518 N 0.95 0.62 -0.43 2.41 0.00 -0.75 -0.86 119.26 121.19 2put h ALA 518 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2put h ALA 518 Cb 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2put h ALA 518 CO -0.01 -0.05 0.21 -0.07 0.00 0.00 0.00 179.25 179.33 2put h LEU 519 N 0.54 0.31 -0.51 0.00 3.38 -0.99 -2.52 115.31 115.52 2put h LEU 519 Ca 0.20 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.22 2put h LEU 519 Cb 0.06 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2put h LEU 519 CO -0.11 0.22 0.30 0.28 0.09 0.00 0.00 178.44 179.22 2put h SER 520 N 0.43 0.50 0.09 -0.43 0.02 -0.84 -1.68 113.55 111.63 2put h SER 520 Ca 0.19 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 2put h SER 520 Cb 0.10 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 2put h SER 520 CO -0.14 0.35 -0.07 -0.07 -1.14 0.00 0.00 176.83 175.77 2put h LEU 521 N 0.61 0.00 -3.25 5.07 3.38 -1.01 -2.92 115.31 117.19 2put h LEU 521 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2put h LEU 521 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2put h LEU 521 CO -0.09 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 176.97 2put n SER 522 N -4.28 4.19 0.00 -0.43 3.41 -0.83 -4.62 113.62 111.06 2put n SER 522 Ca -0.03 -2.80 0.10 0.00 -0.26 0.00 0.00 58.87 55.88 2put n SER 522 Cb 0.15 -0.53 0.60 0.00 -0.26 0.00 0.00 64.21 64.17 2put n SER 522 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2put n ASN 523 N 0.02 0.00 -0.79 4.04 0.23 -0.70 -2.87 115.26 115.19 2put n ASN 523 Ca 0.22 -0.72 0.08 0.00 -0.53 0.00 0.00 54.58 53.63 2put n ASN 523 Cb 0.88 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.72 2put n ASN 523 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2put n ASP 524 N -0.97 2.82 -4.62 0.53 2.03 -1.26 -4.96 116.55 110.12 2put n ASP 524 Ca 0.15 -1.83 -0.39 0.00 0.52 0.00 0.00 54.79 53.25 2put n ASP 524 Cb 0.07 -0.16 -0.09 0.00 -0.72 0.00 0.00 41.12 40.23 2put n ASP 524 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2put s SER 525 N -1.20 6.27 0.11 1.67 0.15 -1.14 -4.96 113.70 114.60 2put s SER 525 Ca 0.26 0.31 -0.15 0.00 0.70 0.00 0.00 55.95 57.08 2put s SER 525 Cb 0.16 -2.20 -0.07 0.00 -1.71 0.00 0.00 66.02 62.20 2put s SER 525 CO 0.22 -0.13 1.46 0.40 1.20 0.00 0.00 173.24 176.38 2put h ILE 526 N 5.28 1.29 0.00 6.45 1.08 -1.92 -2.93 117.51 126.75 2put h ILE 526 Ca -0.33 -1.35 -0.01 0.00 -0.39 0.00 0.00 64.86 62.78 2put h ILE 526 Cb 1.16 1.47 -0.00 0.00 -3.07 0.00 0.00 36.82 36.38 2put h ILE 526 CO 0.66 0.44 -0.06 0.77 -0.69 0.00 0.00 178.15 179.26 2put h SER 527 N 0.47 0.00 -0.08 1.72 4.64 -1.98 -2.61 113.55 115.71 2put h SER 527 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2put h SER 527 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2put h SER 527 CO 0.06 0.06 0.00 0.54 -0.87 0.00 0.00 176.83 176.62 2put n ARG 528 N -3.34 2.29 -0.20 4.77 1.74 -1.15 -4.46 116.66 116.32 2put n ARG 528 Ca -0.01 -1.95 -0.02 0.00 -0.77 0.00 0.00 57.85 55.09 2put n ARG 528 Cb 0.22 -1.46 0.08 0.00 -1.02 0.00 0.00 32.46 30.29 2put n ARG 528 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2put h LYS 529 N 4.58 0.53 -0.43 5.56 1.63 -1.29 0.11 116.57 127.27 2put h LYS 529 Ca 0.00 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 59.80 2put h LYS 529 Cb 0.98 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.45 2put h LYS 529 CO 0.00 0.35 0.23 0.78 -3.45 0.00 0.00 179.45 177.37 2put h GLY 530 N 0.55 0.60 0.98 5.01 0.00 -1.80 -1.54 103.07 106.86 2put h GLY 530 Ca 0.27 -0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 2put h GLY 530 CO -0.20 0.13 -0.14 -0.09 0.00 0.00 0.00 176.54 176.24 2put h ARG 531 N 0.47 0.75 -0.35 4.80 9.65 -1.73 -1.44 114.38 126.53 2put h ARG 531 Ca 0.18 -0.31 0.07 0.00 -1.10 0.00 0.00 59.98 58.82 2put h ARG 531 Cb 0.06 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 28.54 2put h ARG 531 CO -0.11 0.92 -0.10 0.45 2.80 0.00 0.00 179.97 183.93 2put h HIS 532 N 0.55 -0.22 -0.50 2.20 3.86 -0.60 -1.62 115.15 118.82 2put h HIS 532 Ca 0.09 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 2put h HIS 532 Cb 0.67 0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.27 2put h HIS 532 CO 0.05 -0.17 0.26 0.93 0.86 0.00 0.00 177.93 179.87 2put h GLU 533 N -0.02 0.71 -0.58 2.45 5.08 -1.17 -0.61 114.58 120.44 2put h GLU 533 Ca 0.17 -0.09 0.08 0.00 -1.00 0.00 0.00 59.36 58.51 2put h GLU 533 Cb 0.27 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 2put h GLU 533 CO -0.37 0.57 0.25 1.49 -1.00 0.00 0.00 179.01 179.96 2put h GLU 534 N 0.67 0.45 -0.21 2.33 4.81 -0.92 -0.85 114.58 120.85 2put h GLU 534 Ca 0.17 -0.03 -0.20 0.00 -0.13 0.00 0.00 59.36 59.18 2put h GLU 534 Cb 0.08 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2put h GLU 534 CO -0.03 0.30 -0.65 0.82 -0.73 0.00 0.00 179.01 178.72 2put h ILE 535 N 0.47 1.28 -0.58 2.32 2.04 -1.04 -1.06 117.51 120.93 2put h ILE 535 Ca 0.28 -1.86 -0.05 0.00 1.00 0.00 0.00 64.86 64.24 2put h ILE 535 Cb 0.29 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 2put h ILE 535 CO -0.25 0.59 0.17 0.40 0.00 0.00 0.00 178.15 179.07 2put h ILE 536 N 0.58 1.24 -0.52 -0.67 2.04 -0.92 0.14 117.51 119.40 2put h ILE 536 Ca -0.02 -0.83 -0.11 0.00 1.00 0.00 0.00 64.86 64.90 2put h ILE 536 Cb 1.26 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 2put h ILE 536 CO 0.14 0.31 -0.11 0.11 0.00 0.00 0.00 178.15 178.60 2put h LYS 537 N 0.83 0.99 -0.19 2.37 1.79 -1.12 -1.93 116.57 119.31 2put h LYS 537 Ca 0.19 -0.37 0.04 0.00 -2.18 0.00 0.00 60.65 58.32 2put h LYS 537 Cb 0.30 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.85 2put h LYS 537 CO -0.00 1.05 -0.05 0.78 -1.08 0.00 0.00 179.45 180.15 2put h GLY 538 N 0.86 0.14 1.10 3.86 0.00 -0.87 -2.61 103.07 105.55 2put h GLY 538 Ca 0.13 0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.57 2put h GLY 538 CO 0.05 -0.07 0.50 1.41 0.00 0.00 0.00 176.54 178.42 2put h LEU 539 N 0.00 0.77 -1.37 3.11 3.38 -0.44 -1.53 115.31 119.22 2put h LEU 539 Ca 0.09 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.10 2put h LEU 539 Cb 0.14 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2put h LEU 539 CO -0.20 0.52 0.46 -0.61 0.09 0.00 0.00 178.44 178.70 2put h GLN 540 N 0.88 0.77 0.00 1.13 4.15 -0.96 -2.44 115.11 118.65 2put h GLN 540 Ca 0.31 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.68 2put h GLN 540 Cb 0.11 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2put h GLN 540 CO -0.09 0.51 -0.49 1.63 -1.93 0.00 0.00 178.83 178.46 2put n LYS 541 N -4.47 0.16 -0.12 1.69 5.02 -0.62 -4.35 118.16 115.47 2put n LYS 541 Ca 0.09 0.06 -0.05 0.00 -2.02 0.00 0.00 58.31 56.39 2put n LYS 541 Cb 0.16 -1.61 0.01 0.00 -0.02 0.00 0.00 35.03 33.57 2put n LYS 541 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2put h ILE 542 N 0.00 0.59 -0.42 -0.18 1.08 -0.93 -1.10 117.51 116.56 2put h ILE 542 Ca 0.00 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 2put h ILE 542 Cb 0.64 0.59 -0.05 0.00 -3.07 0.00 0.00 36.82 34.93 2put h ILE 542 CO 0.00 0.00 0.10 -0.65 -0.69 0.00 0.00 178.15 176.91 2put h PRO 543 N -0.01 0.24 -0.49 2.37 0.11 -1.77 0.52 132.00 132.97 2put h PRO 543 Ca 0.19 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.22 2put h PRO 543 Cb 0.30 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 2put h PRO 543 CO -0.42 0.16 0.02 0.93 -0.21 0.00 0.00 178.00 178.48 2put h GLU 544 N 0.24 0.80 -0.72 1.05 4.39 -1.83 -2.11 114.58 116.40 2put h GLU 544 Ca 0.20 -0.21 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 2put h GLU 544 Cb 0.23 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 2put h GLU 544 CO -0.24 0.79 0.24 1.96 -1.16 0.00 0.00 179.01 180.60 2put h GLN 545 N 0.75 1.10 -0.43 2.33 4.20 -0.80 -2.17 115.11 120.08 2put h GLN 545 Ca 0.15 -0.22 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2put h GLN 545 Cb 0.43 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 2put h GLN 545 CO 0.02 0.92 0.27 0.82 -0.67 0.00 0.00 178.83 180.18 2put h ILE 546 N 1.06 1.07 -0.70 2.54 2.04 -0.67 -0.26 117.51 122.59 2put h ILE 546 Ca 0.23 -0.18 0.15 0.00 1.00 0.00 0.00 64.86 66.06 2put h ILE 546 Cb 0.27 0.48 -0.11 0.00 -0.74 0.00 0.00 36.82 36.72 2put h ILE 546 CO -0.01 0.10 0.09 0.11 0.00 0.00 0.00 178.15 178.44 2put h LYS 547 N 0.54 0.18 -0.45 2.37 1.57 -1.23 -0.94 116.57 118.60 2put h LYS 547 Ca 0.17 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.86 2put h LYS 547 Cb -0.02 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2put h LYS 547 CO -0.06 0.12 -0.00 1.96 -0.57 0.00 0.00 179.45 180.90 2put h GLN 548 N 0.19 0.80 -0.32 3.15 1.08 -0.83 -3.05 115.11 116.14 2put h GLN 548 Ca 0.38 -0.26 -0.05 0.00 -1.45 0.00 0.00 58.65 57.28 2put h GLN 548 Cb 0.65 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.99 2put h GLN 548 CO -0.54 0.86 -0.01 0.28 -0.95 0.00 0.00 178.83 178.47 2put h VAL 549 N 0.65 1.19 -0.05 -0.54 2.07 -0.42 -2.46 116.25 116.70 2put h VAL 549 Ca 0.13 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.89 2put h VAL 549 Cb 0.50 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2put h VAL 549 CO 0.02 0.26 0.05 -0.07 0.02 0.00 0.00 177.57 177.86 2put h LEU 550 N 0.47 0.00 0.00 2.57 3.38 -1.08 0.57 115.31 121.22 2put h LEU 550 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2put h LEU 550 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2put h LEU 550 CO 0.01 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.83 2put n LYS 551 N -3.91 0.01 0.00 1.13 5.02 -0.92 -1.76 118.16 117.73 2put n LYS 551 Ca -0.02 0.27 0.06 0.00 -2.02 0.00 0.00 58.31 56.60 2put n LYS 551 Cb 0.14 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 33.97 2put n LYS 551 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2put n LEU 552 N -1.49 0.00 -0.16 -0.35 4.77 0.19 -4.17 117.00 115.80 2put n LEU 552 Ca 0.03 0.28 -0.02 0.00 -0.03 0.00 0.00 56.01 56.27 2put n LEU 552 Cb 0.15 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2put n LEU 552 CO 0.12 -0.16 0.86 -0.08 -1.33 0.00 0.00 177.39 176.80 2put h GLU 553 N 0.00 0.14 -0.63 3.23 4.81 -1.56 -1.50 114.58 119.07 2put h GLU 553 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2put h GLU 553 Cb 0.12 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 2put h GLU 553 CO 0.00 0.09 0.38 -0.91 -0.73 0.00 0.00 179.01 177.84 2put h ASN 554 N 0.14 0.76 -0.52 1.04 2.35 -1.86 0.53 115.58 118.02 2put h ASN 554 Ca 0.25 -0.06 0.05 0.00 -0.55 0.00 0.00 56.30 55.99 2put h ASN 554 Cb 0.36 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 2put h ASN 554 CO -0.39 0.59 0.35 0.50 -1.65 0.00 0.00 177.43 176.83 2put h LYS 555 N 0.86 0.48 0.17 0.81 3.64 -1.71 -1.02 116.57 119.81 2put h LYS 555 Ca 0.23 -0.03 -0.31 0.00 -1.27 0.00 0.00 60.65 59.26 2put h LYS 555 Cb -0.03 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2put h LYS 555 CO -0.04 0.32 -1.47 0.82 -2.27 0.00 0.00 179.45 176.80 2put h ILE 556 N 0.50 1.26 -0.77 2.00 2.04 -0.15 -2.12 117.51 120.26 2put h ILE 556 Ca 0.22 -2.80 0.02 0.00 1.00 0.00 0.00 64.86 63.30 2put h ILE 556 Cb 0.25 2.90 -0.04 0.00 -0.74 0.00 0.00 36.82 39.19 2put h ILE 556 CO -0.06 0.84 0.50 0.11 0.00 0.00 0.00 178.15 179.54 2put h LYS 557 N 0.10 0.95 -0.40 2.37 1.57 0.40 -0.09 116.57 121.47 2put h LYS 557 Ca -0.23 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.51 2put h LYS 557 Cb 2.07 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 34.13 2put h LYS 557 CO 0.21 0.63 0.22 -0.44 -0.57 0.00 0.00 179.45 179.50 2put h ASP 558 N 0.98 0.34 -0.74 0.86 3.32 -1.10 -0.25 116.42 119.83 2put h ASP 558 Ca 0.30 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.37 2put h ASP 558 Cb -0.03 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 2put h ASP 558 CO -0.09 0.25 0.49 0.25 -1.72 0.00 0.00 179.24 178.41 2put h LEU 559 N 0.44 0.85 -0.10 1.55 5.85 -1.20 -2.80 115.31 119.91 2put h LEU 559 Ca 0.16 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2put h LEU 559 Cb 0.04 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.85 2put h LEU 559 CO -0.09 0.62 0.00 0.00 -0.34 0.00 0.00 178.44 178.62 2put h ASN 561 N 0.00 0.00 -2.86 0.00 2.35 -0.79 -3.38 115.58 110.90 2put h ASN 561 Ca 0.00 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.47 2put h ASN 561 Cb 0.68 0.00 0.13 0.00 0.05 0.00 0.00 38.32 39.18 2put h ASN 561 CO 0.00 0.15 0.11 -1.54 -1.65 0.00 0.00 177.43 174.50 2put n SER 562 N -3.17 -1.50 0.00 5.81 3.41 -1.03 -4.88 113.62 112.26 2put n SER 562 Ca 0.02 -1.01 0.03 0.00 -0.26 0.00 0.00 58.87 57.65 2put n SER 562 Cb 0.53 -0.70 0.15 0.00 -0.26 0.00 0.00 64.21 63.93 2put n SER 562 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2put n SER 563 N -4.20 0.00 -0.30 4.04 3.41 -1.26 -1.93 113.62 113.38 2put n SER 563 Ca 0.11 0.37 0.14 0.00 -0.26 0.00 0.00 58.87 59.23 2put n SER 563 Cb 0.41 -0.41 0.32 0.00 -0.26 0.00 0.00 64.21 64.26 2put n SER 563 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2put h LEU 564 N 0.00 0.15 0.00 1.04 5.85 -1.90 -0.46 115.31 119.99 2put h LEU 564 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 2put h LEU 564 Cb 0.09 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2put h LEU 564 CO 0.00 -0.11 0.00 -0.46 -0.34 0.00 0.00 178.44 177.53 2put n ASN 565 N -5.16 0.00 -1.13 1.25 0.23 -0.81 -2.56 115.26 107.08 2put n ASN 565 Ca 0.23 0.41 0.12 0.00 -0.53 0.00 0.00 54.58 54.80 2put n ASN 565 Cb 0.71 -0.46 0.20 0.00 -2.08 0.00 0.00 39.78 38.15 2put n ASN 565 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2put n ASP 566 N -1.46 3.42 -4.87 0.53 8.00 -0.19 -4.88 116.55 117.11 2put n ASP 566 Ca 0.05 -1.99 -0.31 0.00 0.71 0.00 0.00 54.79 53.24 2put n ASP 566 Cb 0.18 -0.22 0.01 0.00 -0.02 0.00 0.00 41.12 41.07 2put n ASP 566 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2put s GLN 567 N -1.55 3.58 -0.10 -1.24 -1.52 -1.06 -5.00 119.66 112.77 2put s GLN 567 Ca 0.37 0.75 0.16 0.00 -1.95 0.00 0.00 55.36 54.70 2put s GLN 567 Cb 0.22 -2.08 -0.23 0.00 -0.22 0.00 0.00 33.01 30.70 2put s GLN 567 CO 0.31 -0.58 0.40 0.36 -0.25 0.00 0.00 175.29 175.53 2put n LYS 568 N -2.76 0.66 -3.86 2.91 2.85 -1.26 -4.92 118.16 111.78 2put n LYS 568 Ca 0.06 0.12 -0.12 0.00 -1.05 0.00 0.00 58.31 57.32 2put n LYS 568 Cb 0.54 -1.65 -0.12 0.00 -0.65 0.00 0.00 35.03 33.15 2put n LYS 568 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2put s SER 569 N -5.69 -0.03 -0.11 -5.58 0.15 -1.26 -2.91 113.70 98.27 2put s SER 569 Ca -0.07 0.02 0.01 0.00 0.70 0.00 0.00 55.95 56.60 2put s SER 569 Cb 0.07 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.60 2put s SER 569 CO 0.83 -0.15 -0.11 -0.22 1.20 0.00 0.00 173.24 174.79 2put s LEU 570 N -0.48 1.48 -0.12 3.45 2.96 0.16 -3.93 118.68 122.20 2put s LEU 570 Ca -0.06 -0.36 -0.06 0.00 -0.22 0.00 0.00 54.13 53.44 2put s LEU 570 Cb -0.04 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 2put s LEU 570 CO 0.00 -0.05 0.09 -0.76 -1.32 0.00 0.00 176.35 174.32 2put s LEU 571 N 1.30 4.07 -0.12 -0.68 1.43 -0.74 -2.50 118.68 121.44 2put s LEU 571 Ca -0.02 0.31 0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2put s LEU 571 Cb -0.14 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.10 2put s LEU 571 CO -0.05 0.36 -0.23 -0.76 0.23 0.00 0.00 176.35 175.90 2put s LEU 572 N -0.72 2.10 -0.19 1.79 1.02 0.09 -0.32 118.68 122.45 2put s LEU 572 Ca 0.12 -0.58 -0.05 0.00 0.02 0.00 0.00 54.13 53.64 2put s LEU 572 Cb -0.12 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.64 2put s LEU 572 CO 0.03 0.12 -0.01 -0.76 0.02 0.00 0.00 176.35 175.75 2put s LEU 573 N 0.58 3.26 0.22 1.79 1.43 0.11 -0.12 118.68 125.95 2put s LEU 573 Ca -0.13 -0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 52.63 2put s LEU 573 Cb -0.17 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2put s LEU 573 CO 0.03 0.08 0.52 -0.83 0.23 0.00 0.00 176.35 176.38 2put s GLY 574 N 0.88 0.13 0.10 -3.19 0.00 -0.72 -1.15 107.32 103.37 2put s GLY 574 Ca 0.01 -0.48 -0.12 0.00 0.00 0.00 0.00 44.72 44.13 2put s GLY 574 CO 0.02 -0.39 0.30 -1.60 0.00 0.00 0.00 173.10 171.42 2put s ARG 575 N -3.93 0.95 5.91 2.90 3.52 -1.26 -1.14 118.95 125.90 2put s ARG 575 Ca 0.14 -0.81 0.00 0.00 -0.13 0.00 0.00 55.73 54.93 2put s ARG 575 Cb -0.01 0.40 0.00 0.00 -1.56 0.00 0.00 34.95 33.78 2put s ARG 575 CO 0.02 -0.34 0.00 0.41 -0.81 0.00 0.00 175.30 174.58 2put n GLY 576 N -0.09 2.14 0.34 8.12 0.00 -1.26 -1.91 105.19 112.52 2put n GLY 576 Ca -0.16 -0.49 0.13 0.00 0.00 0.00 0.00 46.02 45.50 2put n GLY 576 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2put h TYR 577 N 0.00 0.26 -0.01 1.61 0.05 -1.94 -2.32 116.97 114.62 2put h TYR 577 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2put h TYR 577 Cb 0.00 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.66 2put h TYR 577 CO 0.00 0.13 -0.07 1.04 -1.05 0.00 0.00 178.16 178.20 2put n GLN 578 N -4.46 1.22 -0.24 4.88 1.13 -0.80 -3.79 117.38 115.33 2put n GLN 578 Ca 0.08 -0.60 -0.07 0.00 -1.94 0.00 0.00 57.00 54.47 2put n GLN 578 Cb 0.38 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.28 2put n GLN 578 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 2put h PHE 579 N 1.46 1.03 -0.77 1.08 3.57 -1.39 -1.60 116.94 120.32 2put h PHE 579 Ca 0.00 -0.09 0.04 0.00 3.53 0.00 0.00 57.97 61.44 2put h PHE 579 Cb 0.40 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 2put h PHE 579 CO 0.00 0.83 0.48 0.00 -2.23 0.00 0.00 178.31 177.39 2put h ALA 580 N 1.10 1.02 -0.92 2.41 0.00 -1.77 -1.21 119.26 119.88 2put h ALA 580 Ca 0.22 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2put h ALA 580 Cb 0.26 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2put h ALA 580 CO -0.01 0.27 0.61 1.15 0.00 0.00 0.00 179.25 181.27 2put h THR 581 N 0.93 1.20 -0.62 0.00 2.02 -1.64 -0.67 112.91 114.13 2put h THR 581 Ca 0.31 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 2put h THR 581 Cb 0.04 -0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.31 2put h THR 581 CO -0.12 0.22 0.17 0.00 0.37 0.00 0.00 175.52 176.16 2put h ALA 582 N 1.44 0.82 -0.55 6.16 0.00 -0.50 0.19 119.26 126.82 2put h ALA 582 Ca 0.35 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2put h ALA 582 Cb -0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2put h ALA 582 CO -0.09 0.51 0.06 -0.07 0.00 0.00 0.00 179.25 179.67 2put h LEU 583 N 0.90 0.85 -0.01 0.00 3.38 -0.55 -0.80 115.31 119.08 2put h LEU 583 Ca 0.20 -0.19 -0.24 0.00 0.09 0.00 0.00 57.88 57.74 2put h LEU 583 Cb 0.33 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 40.87 2put h LEU 583 CO -0.00 0.87 -0.94 -0.08 0.09 0.00 0.00 178.44 178.39 2put h GLU 584 N 0.84 0.65 -0.57 1.13 4.57 -0.99 -1.36 114.58 118.85 2put h GLU 584 Ca 0.17 -0.69 0.02 0.00 -1.18 0.00 0.00 59.36 57.68 2put h GLU 584 Cb 0.41 0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.16 2put h GLU 584 CO 0.01 1.28 0.36 0.78 -1.18 0.00 0.00 179.01 180.26 2put h GLY 585 N 0.30 0.80 0.74 1.92 0.00 -0.53 -0.88 103.07 105.41 2put h GLY 585 Ca -0.11 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 46.99 2put h GLY 585 CO 0.18 0.25 0.38 0.00 0.00 0.00 0.00 176.54 177.35 2put h ALA 586 N 1.23 0.87 -0.49 3.60 0.00 -1.03 -1.69 119.26 121.75 2put h ALA 586 Ca 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2put h ALA 586 Cb -0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2put h ALA 586 CO -0.08 0.08 0.26 1.25 0.00 0.00 0.00 179.25 180.76 2put h LEU 587 N 0.71 0.62 -0.69 0.00 5.85 -0.87 -1.55 115.31 119.38 2put h LEU 587 Ca 0.29 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2put h LEU 587 Cb 0.14 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2put h LEU 587 CO -0.16 0.55 0.42 0.11 -0.34 0.00 0.00 178.44 179.02 2put h LYS 588 N 0.65 0.93 -0.41 1.25 1.79 -0.85 -0.29 116.57 119.64 2put h LYS 588 Ca 0.17 -0.08 -0.08 0.00 -2.18 0.00 0.00 60.65 58.48 2put h LYS 588 Cb 0.07 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.51 2put h LYS 588 CO -0.03 0.65 -0.06 0.82 -1.08 0.00 0.00 179.45 179.76 2put h ILE 589 N 0.94 1.27 -0.16 1.86 2.04 -0.94 0.65 117.51 123.17 2put h ILE 589 Ca 0.25 -1.13 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 2put h ILE 589 Cb -0.04 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2put h ILE 589 CO -0.05 0.38 0.08 0.11 0.00 0.00 0.00 178.15 178.68 2put h LYS 590 N 0.58 0.22 0.00 2.37 1.57 -1.20 -1.04 116.57 119.08 2put h LYS 590 Ca 0.11 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.71 2put h LYS 590 Cb 0.57 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2put h LYS 590 CO 0.03 0.24 -0.69 0.93 -0.57 0.00 0.00 179.45 179.39 2put h GLU 591 N 0.15 0.00 0.00 3.15 5.08 -0.93 -3.04 114.58 118.99 2put h GLU 591 Ca 0.06 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 58.03 2put h GLU 591 Cb 0.08 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 2put h GLU 591 CO -0.01 0.69 -2.33 -0.89 -1.00 0.00 0.00 179.01 175.48 2put n ILE 592 N -3.31 1.31 0.69 3.13 2.08 0.21 -4.67 119.36 118.80 2put n ILE 592 Ca 0.01 -0.37 0.12 0.00 0.56 0.00 0.00 62.75 63.07 2put n ILE 592 Cb 0.80 -1.71 0.16 0.00 -0.75 0.00 0.00 39.64 38.14 2put n ILE 592 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 2put n SER 593 N -3.87 0.62 -3.78 4.38 7.64 -0.45 -4.69 113.62 113.47 2put n SER 593 Ca -0.46 -0.06 -0.24 0.00 1.01 0.00 0.00 58.87 59.12 2put n SER 593 Cb 0.86 0.33 0.03 0.00 -1.01 0.00 0.00 64.21 64.41 2put n SER 593 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2put n TYR 594 N -1.91 -2.05 -4.78 1.43 4.01 -0.84 -4.71 117.16 108.33 2put n TYR 594 Ca 0.04 0.86 -0.24 0.00 -0.16 0.00 0.00 57.90 58.39 2put n TYR 594 Cb 0.41 -4.24 -0.16 0.00 -0.31 0.00 0.00 39.34 35.04 2put n TYR 594 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 2put s MET 595 N -6.22 1.46 0.38 -0.72 1.75 -1.12 -5.01 119.30 109.82 2put s MET 595 Ca 0.23 -0.58 -0.27 0.00 -1.25 0.00 0.00 55.69 53.82 2put s MET 595 Cb -0.12 -1.35 -0.10 0.00 2.84 0.00 0.00 34.83 36.10 2put s MET 595 CO 0.82 0.30 1.38 -1.58 -0.65 0.00 0.00 175.02 175.29 2put s HIS 596 N -0.21 2.77 -0.01 4.11 2.46 -1.15 -3.04 115.29 120.24 2put s HIS 596 Ca 0.02 1.31 -0.15 0.00 0.47 0.00 0.00 55.06 56.72 2put s HIS 596 Cb -0.08 -3.82 0.02 0.00 -0.13 0.00 0.00 32.58 28.57 2put s HIS 596 CO 0.00 -2.41 0.31 0.45 -2.47 0.00 0.00 174.74 170.63 2put s SER 597 N -0.43 -0.19 -0.00 9.88 0.15 -1.26 -0.67 113.70 121.18 2put s SER 597 Ca 0.53 0.05 0.01 0.00 0.70 0.00 0.00 55.95 57.25 2put s SER 597 Cb -0.42 0.32 -0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2put s SER 597 CO 0.56 -0.48 -0.04 -0.70 1.20 0.00 0.00 173.24 173.78 2put s GLU 598 N -1.51 0.33 -0.25 5.44 2.12 -1.04 -4.86 118.70 118.92 2put s GLU 598 Ca -0.12 -0.16 -0.13 0.00 0.36 0.00 0.00 54.97 54.92 2put s GLU 598 Cb -0.04 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 33.99 2put s GLU 598 CO 0.03 0.08 0.27 0.20 -0.54 0.00 0.00 175.26 175.31 2put s GLY 599 N -0.14 1.96 -0.09 -1.50 0.00 -1.26 -0.73 107.32 105.56 2put s GLY 599 Ca 0.01 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.89 2put s GLY 599 CO -0.00 0.70 -0.13 0.14 0.00 0.00 0.00 173.10 173.81 2put s VAL 600 N 1.58 3.09 -0.29 1.40 1.01 0.83 -4.84 120.40 123.18 2put s VAL 600 Ca 0.11 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 2put s VAL 600 Cb -0.15 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2put s VAL 600 CO 0.08 0.56 1.60 -0.22 0.00 0.00 0.00 175.10 177.12 2put s LEU 601 N -0.18 3.74 0.05 3.92 2.96 -1.26 -1.76 118.68 126.15 2put s LEU 601 Ca -0.00 1.37 -0.30 0.00 -0.22 0.00 0.00 54.13 54.98 2put s LEU 601 Cb -0.13 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 42.94 2put s LEU 601 CO 0.03 -1.38 1.73 0.00 -1.32 0.00 0.00 176.35 175.41 2put s ALA 602 N 5.58 3.67 -1.05 5.97 0.00 -0.29 -2.33 121.76 133.31 2put s ALA 602 Ca 0.70 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2put s ALA 602 Cb -0.22 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.17 2put s ALA 602 CO 0.30 -1.25 0.00 0.41 0.00 0.00 0.00 175.76 175.22 2put n GLY 603 N 4.14 1.07 0.14 0.00 0.00 -1.26 -4.40 105.19 104.89 2put n GLY 603 Ca 0.17 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.48 2put n GLY 603 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2put h GLU 604 N 0.00 0.39 -6.78 1.61 4.57 -1.80 -3.45 114.58 109.12 2put h GLU 604 Ca -0.21 -0.27 -0.50 0.00 -1.18 0.00 0.00 59.36 57.21 2put h GLU 604 Cb 0.69 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2put h GLU 604 CO 0.30 0.88 0.08 -0.51 -1.18 0.00 0.00 179.01 178.58 2put s LEU 605 N -8.83 3.90 -1.20 1.64 1.02 -1.26 -5.19 118.68 108.76 2put s LEU 605 Ca -0.14 1.11 -0.09 0.00 0.02 0.00 0.00 54.13 55.04 2put s LEU 605 Cb 0.05 -3.97 0.22 0.00 0.02 0.00 0.00 46.19 42.50 2put s LEU 605 CO 0.78 -0.34 1.60 0.29 0.02 0.00 0.00 176.35 178.70 2put n LYS 606 N -1.07 3.79 -0.02 1.70 5.02 -1.26 -5.10 118.16 121.22 2put n LYS 606 Ca 0.02 -3.96 0.00 0.00 -2.02 0.00 0.00 58.31 52.35 2put n LYS 606 Cb 0.54 -2.80 0.00 0.00 -0.02 0.00 0.00 35.03 32.75 2put n LYS 606 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2put n LEU 617 N 3.41 -0.04 -4.76 -0.35 0.00 -1.26 -5.15 117.00 108.84 2put n LEU 617 Ca 0.34 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.98 2put n LEU 617 Cb 0.37 -0.02 0.01 0.00 0.00 0.00 0.00 43.42 43.78 2put n LEU 617 CO 0.72 0.00 0.88 -2.16 0.00 0.00 0.00 177.39 176.82 2put s PRO 618 N -1.89 3.43 -0.03 1.96 0.04 -1.25 -4.92 135.00 132.33 2put s PRO 618 Ca 0.00 1.92 0.01 0.00 0.04 0.00 0.00 61.00 62.97 2put s PRO 618 Cb 0.00 -2.27 0.02 0.00 0.04 0.00 0.00 34.50 32.29 2put s PRO 618 CO 0.00 -0.86 -0.03 0.42 0.04 0.00 0.00 177.00 176.57 2put s ILE 619 N -1.49 0.36 -0.13 0.56 1.01 -1.26 -1.79 121.20 118.47 2put s ILE 619 Ca 0.68 -0.05 -0.02 0.00 0.00 0.00 0.00 60.65 61.27 2put s ILE 619 Cb -0.32 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 2put s ILE 619 CO 0.38 0.17 -0.07 -0.63 0.00 0.00 0.00 174.94 174.79 2put s ILE 620 N 0.78 3.61 -0.08 2.92 1.01 0.56 -0.80 121.20 129.20 2put s ILE 620 Ca -0.09 -0.47 0.05 0.00 0.00 0.00 0.00 60.65 60.14 2put s ILE 620 Cb -0.12 -2.54 -0.00 0.00 0.01 0.00 0.00 42.46 39.80 2put s ILE 620 CO -0.01 0.52 -0.23 0.00 0.00 0.00 0.00 174.94 175.23 2put s ALA 621 N 0.10 2.05 -0.29 9.38 0.00 0.49 0.06 121.76 133.56 2put s ALA 621 Ca -0.02 -0.93 -0.21 0.00 0.00 0.00 0.00 51.96 50.79 2put s ALA 621 Cb -0.14 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.25 2put s ALA 621 CO 0.03 0.32 0.67 -0.06 0.00 0.00 0.00 175.76 176.72 2put s PHE 622 N 0.18 3.24 -0.06 0.00 0.08 -0.30 -0.75 117.98 120.37 2put s PHE 622 Ca -0.13 0.74 0.19 0.00 0.12 0.00 0.00 56.93 57.85 2put s PHE 622 Cb -0.16 -2.99 0.38 0.00 -0.57 0.00 0.00 43.02 39.68 2put s PHE 622 CO 0.06 -0.44 1.17 0.00 -0.10 0.00 0.00 175.22 175.91 2put n ALA 623 N 5.90 2.65 -1.22 5.36 0.00 0.13 -4.79 120.51 128.55 2put n ALA 623 Ca 0.00 -2.47 -0.32 0.00 0.00 0.00 0.00 53.44 50.65 2put n ALA 623 Cb 0.49 -0.60 0.10 0.00 0.00 0.00 0.00 19.45 19.43 2put n ALA 623 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2put s THR 624 N -0.93 2.94 0.45 0.00 -4.23 -1.17 -4.51 115.64 108.19 2put s THR 624 Ca 0.32 0.35 0.17 0.00 -1.18 0.00 0.00 61.69 61.35 2put s THR 624 Cb 0.34 -2.77 0.21 0.00 1.34 0.00 0.00 72.50 71.62 2put s THR 624 CO -0.12 -0.35 2.02 0.03 -0.54 0.00 0.00 174.62 175.65 2put h ARG 625 N -0.90 0.00 0.00 3.99 3.08 -1.96 -1.58 114.38 117.01 2put h ARG 625 Ca -0.45 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.58 2put h ARG 625 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 2put h ARG 625 CO 0.50 0.16 -0.12 0.38 -1.07 0.00 0.00 179.97 179.82 2put h ASP 626 N 0.00 0.00 -0.00 7.04 2.03 -1.91 -3.17 116.42 120.41 2put h ASP 626 Ca -0.00 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.22 2put h ASP 626 Cb 0.30 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 38.65 2put h ASP 626 CO 0.02 0.12 -0.72 -1.20 -1.03 0.00 0.00 179.24 176.44 2put n SER 627 N -4.24 1.44 -3.81 4.15 7.64 -0.63 -4.73 113.62 113.44 2put n SER 627 Ca -0.03 -3.15 -0.42 0.00 1.01 0.00 0.00 58.87 56.28 2put n SER 627 Cb 0.20 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 2put n SER 627 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2put n LEU 628 N -0.48 6.86 -4.83 -3.43 7.94 -1.01 -4.65 117.00 117.40 2put n LEU 628 Ca 0.14 -4.68 -0.32 0.00 -1.11 0.00 0.00 56.01 50.04 2put n LEU 628 Cb 0.87 -1.46 0.01 0.00 0.53 0.00 0.00 43.42 43.37 2put n LEU 628 CO -0.04 1.48 0.71 -0.36 -1.11 0.00 0.00 177.39 178.07 2put s PHE 629 N 0.18 3.27 0.29 1.96 0.08 -1.26 -4.90 117.98 117.59 2put s PHE 629 Ca 0.42 1.43 0.04 0.00 0.12 0.00 0.00 56.93 58.94 2put s PHE 629 Cb 0.11 -2.86 0.76 0.00 -0.57 0.00 0.00 43.02 40.46 2put s PHE 629 CO -0.01 -0.88 1.68 -1.35 -0.10 0.00 0.00 175.22 174.56 2put h PRO 630 N 0.08 0.34 0.00 0.24 0.11 -2.00 -0.78 132.00 129.99 2put h PRO 630 Ca -0.45 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 2put h PRO 630 Cb 1.20 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2put h PRO 630 CO 0.59 0.23 -0.27 0.87 -0.21 0.00 0.00 178.00 179.21 2put h LYS 631 N 0.35 0.00 -0.08 1.05 1.57 -1.93 -1.17 116.57 116.36 2put h LYS 631 Ca 0.57 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.33 2put h LYS 631 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 2put h LYS 631 CO -0.56 0.27 -0.06 0.28 -0.57 0.00 0.00 179.45 178.81 2put h VAL 632 N 0.00 1.35 -0.98 0.50 2.07 -1.37 -2.08 116.25 115.74 2put h VAL 632 Ca -0.00 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.37 2put h VAL 632 Cb 0.60 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.26 2put h VAL 632 CO 0.04 0.32 0.63 0.24 0.02 0.00 0.00 177.57 178.82 2put h MET 633 N -0.21 1.30 -0.22 1.57 2.86 -1.02 -0.77 114.93 118.44 2put h MET 633 Ca 0.02 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.59 2put h MET 633 Cb 0.54 -0.29 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 2put h MET 633 CO 0.02 0.87 0.06 0.77 1.06 0.00 0.00 176.91 179.69 2put h SER 634 N 1.33 0.05 -0.63 1.22 0.02 -1.24 0.71 113.55 115.01 2put h SER 634 Ca 0.36 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.36 2put h SER 634 Cb -0.13 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 2put h SER 634 CO -0.07 0.06 0.39 0.00 -1.14 0.00 0.00 176.83 176.07 2put h ALA 635 N 1.15 0.81 -0.38 3.77 0.00 -1.01 -0.60 119.26 123.00 2put h ALA 635 Ca 0.10 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2put h ALA 635 Cb 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2put h ALA 635 CO -0.12 0.15 0.03 0.82 0.00 0.00 0.00 179.25 180.13 2put h ILE 636 N 0.77 1.25 -0.91 0.00 2.04 -0.88 -2.36 117.51 117.42 2put h ILE 636 Ca 0.25 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 2put h ILE 636 Cb 0.01 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 2put h ILE 636 CO -0.10 0.31 0.52 -0.33 0.00 0.00 0.00 178.15 178.55 2put h GLU 637 N 0.49 1.26 -0.76 2.37 5.08 -0.65 -0.84 114.58 121.53 2put h GLU 637 Ca 0.11 -0.13 0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2put h GLU 637 Cb 0.41 -0.25 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 2put h GLU 637 CO 0.01 0.90 0.43 1.96 -1.00 0.00 0.00 179.01 181.31 2put h GLN 638 N 1.27 0.73 -0.07 2.33 4.20 -0.90 0.04 115.11 122.71 2put h GLN 638 Ca 0.32 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.98 2put h GLN 638 Cb -0.00 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.61 2put h GLN 638 CO -0.06 0.48 0.00 0.28 -0.67 0.00 0.00 178.83 178.87 2put h VAL 639 N 0.75 1.23 -0.15 -0.54 2.07 -0.88 -3.25 116.25 115.48 2put h VAL 639 Ca 0.35 -0.72 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 2put h VAL 639 Cb 0.27 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 2put h VAL 639 CO -0.22 0.20 -0.33 0.71 0.02 0.00 0.00 177.57 177.96 2put h THR 640 N -0.16 1.28 -0.01 2.57 1.35 -0.82 0.25 112.91 117.37 2put h THR 640 Ca 0.02 -1.34 0.00 0.00 -0.55 0.00 0.00 66.41 64.54 2put h THR 640 Cb 0.31 1.52 -0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2put h THR 640 CO 0.00 0.41 0.01 0.00 -0.25 0.00 0.00 175.52 175.69 2put h ALA 641 N 1.39 1.34 -0.44 6.62 0.00 -1.04 0.11 119.26 127.24 2put h ALA 641 Ca 0.03 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2put h ALA 641 Cb 0.71 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2put h ALA 641 CO 0.05 -0.01 0.07 -2.13 0.00 0.00 0.00 179.25 177.23 2put n ARG 642 N -3.55 2.97 -4.27 0.00 0.63 -0.99 -4.97 116.66 106.47 2put n ARG 642 Ca -0.03 -3.01 -0.33 0.00 -0.92 0.00 0.00 57.85 53.57 2put n ARG 642 Cb 0.09 -1.96 -0.07 0.00 0.45 0.00 0.00 32.46 30.96 2put n ARG 642 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2put n ASP 643 N -0.52 -0.30 0.23 6.15 2.03 0.38 -4.91 116.55 119.60 2put n ASP 643 Ca 0.30 -1.18 0.16 0.00 0.52 0.00 0.00 54.79 54.58 2put n ASP 643 Cb 1.09 -2.04 0.63 0.00 -0.72 0.00 0.00 41.12 40.08 2put n ASP 643 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2put h GLY 644 N -1.60 0.00 -5.60 0.27 0.00 -1.14 -3.49 103.07 91.52 2put h GLY 644 Ca -0.63 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.40 2put h GLY 644 CO 0.73 0.00 -0.85 0.54 0.00 0.00 0.00 176.54 176.96 2put n ARG 645 N -2.81 -3.06 -1.85 4.80 1.74 -1.26 -4.82 116.66 109.40 2put n ARG 645 Ca 0.01 0.81 -0.33 0.00 -0.77 0.00 0.00 57.85 57.57 2put n ARG 645 Cb 0.28 -5.63 0.04 0.00 -1.02 0.00 0.00 32.46 26.12 2put n ARG 645 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2put s PRO 646 N -4.81 2.91 -0.27 5.56 0.04 -1.26 -4.66 135.00 132.51 2put s PRO 646 Ca 0.36 1.42 -0.16 0.00 0.04 0.00 0.00 61.00 62.66 2put s PRO 646 Cb -0.06 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 2put s PRO 646 CO 0.75 -1.17 0.42 0.42 0.04 0.00 0.00 177.00 177.47 2put s ILE 647 N -2.24 5.14 -0.19 0.56 1.01 0.02 -1.57 121.20 123.93 2put s ILE 647 Ca 0.68 0.67 -0.03 0.00 0.00 0.00 0.00 60.65 61.97 2put s ILE 647 Cb -0.21 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 2put s ILE 647 CO 0.39 0.14 -0.05 -0.69 0.00 0.00 0.00 174.94 174.72 2put s VAL 648 N 2.13 3.50 -0.26 2.92 1.01 0.44 -0.38 120.40 129.76 2put s VAL 648 Ca 0.17 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.54 2put s VAL 648 Cb -0.16 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 2put s VAL 648 CO 0.10 0.45 0.33 -0.63 0.00 0.00 0.00 175.10 175.35 2put s ILE 649 N 0.99 5.21 0.28 2.22 1.01 0.07 -0.33 121.20 130.65 2put s ILE 649 Ca 0.00 0.50 -0.08 0.00 0.00 0.00 0.00 60.65 61.07 2put s ILE 649 Cb -0.15 -3.66 -0.00 0.00 0.01 0.00 0.00 42.46 38.66 2put s ILE 649 CO 0.00 0.20 0.45 0.00 0.00 0.00 0.00 174.94 175.59 2put s ASN 651 N -3.11 7.34 -0.32 0.00 0.02 -1.26 -1.02 114.94 116.59 2put s ASN 651 Ca 0.27 1.81 -0.39 0.00 -1.02 0.00 0.00 52.86 53.53 2put s ASN 651 Cb 0.00 -2.57 -0.17 0.00 0.02 0.00 0.00 41.25 38.53 2put s ASN 651 CO 0.13 -0.04 1.26 -0.62 0.02 0.00 0.00 177.10 177.85 2put n GLU 652 N 0.65 0.00 0.00 -0.60 1.02 -0.47 -1.21 120.64 120.04 2put n GLU 652 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2put n GLU 652 Cb 0.50 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 2put n GLU 652 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2put n GLY 653 N 2.89 2.36 3.75 0.62 0.00 -1.26 -4.97 105.19 108.58 2put n GLY 653 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 2put n GLY 653 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2put s ASP 654 N -1.88 7.60 -0.37 1.61 1.01 -0.35 -5.03 116.67 119.27 2put s ASP 654 Ca 0.00 1.89 -0.03 0.00 0.71 0.00 0.00 52.55 55.12 2put s ASP 654 Cb 0.00 -2.59 0.08 0.00 1.01 0.00 0.00 42.92 41.42 2put s ASP 654 CO 0.00 0.14 0.14 0.00 0.21 0.00 0.00 175.17 175.65 2put s ALA 655 N -1.03 3.05 -0.04 5.23 0.00 -1.26 -4.86 121.76 122.86 2put s ALA 655 Ca 0.41 -2.20 -0.03 0.00 0.00 0.00 0.00 51.96 50.14 2put s ALA 655 Cb -0.25 -2.27 -0.27 0.00 0.00 0.00 0.00 23.12 20.32 2put s ALA 655 CO 0.31 -1.59 0.70 0.82 0.00 0.00 0.00 175.76 176.01 2put h ILE 656 N 6.36 0.97 -4.00 0.00 1.08 -1.97 -3.46 117.51 116.50 2put h ILE 656 Ca -0.17 -2.65 -0.43 0.00 -0.39 0.00 0.00 64.86 61.23 2put h ILE 656 Cb 1.06 2.67 -0.23 0.00 -3.07 0.00 0.00 36.82 37.24 2put h ILE 656 CO 0.64 0.80 -0.79 0.27 -0.69 0.00 0.00 178.15 178.39 2put s ILE 657 N -2.60 1.09 -2.22 -0.67 -4.36 -1.26 -5.08 121.20 106.11 2put s ILE 657 Ca -0.12 -1.11 0.20 0.00 -0.26 0.00 0.00 60.65 59.35 2put s ILE 657 Cb 0.07 -1.01 0.46 0.00 1.25 0.00 0.00 42.46 43.22 2put s ILE 657 CO 0.83 -0.10 1.57 -1.54 0.24 0.00 0.00 174.94 175.94 2put n SER 658 N 1.65 1.34 -4.71 4.36 3.41 -1.26 -5.08 113.62 113.32 2put n SER 658 Ca -0.19 -1.66 -0.42 0.00 -0.26 0.00 0.00 58.87 56.34 2put n SER 658 Cb 0.54 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 2put n SER 658 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2put s VAL 662 N -1.83 4.61 0.06 -3.33 1.01 -1.26 -5.17 120.40 114.49 2put s VAL 662 Ca 0.31 1.91 -0.27 0.00 0.00 0.00 0.00 61.98 63.93 2put s VAL 662 Cb 0.16 -4.23 0.09 0.00 0.00 0.00 0.00 36.38 32.40 2put s VAL 662 CO 0.25 0.17 0.91 -1.38 0.00 0.00 0.00 175.10 175.05 2put s HIS 663 N 0.86 -0.27 -0.07 5.22 -0.00 -1.26 -4.02 115.29 115.75 2put s HIS 663 Ca 0.53 0.06 0.01 0.00 -0.00 0.00 0.00 55.06 55.66 2put s HIS 663 Cb -0.23 0.58 -0.03 0.00 -0.00 0.00 0.00 32.58 32.90 2put s HIS 663 CO 0.29 -0.67 -0.07 0.99 -0.00 0.00 0.00 174.74 175.28 2put s THR 664 N -3.21 3.65 -0.08 -5.38 2.01 -0.61 -5.00 115.64 107.02 2put s THR 664 Ca 0.08 -0.50 0.04 0.00 0.31 0.00 0.00 61.69 61.62 2put s THR 664 Cb -0.01 -2.49 -0.01 0.00 0.01 0.00 0.00 72.50 70.00 2put s THR 664 CO -0.05 0.60 -0.23 -0.89 -0.69 0.00 0.00 174.62 173.36 2put s THR 665 N -0.79 2.23 -0.26 -0.82 2.01 -1.26 -0.42 115.64 116.32 2put s THR 665 Ca 0.12 -0.98 0.03 0.00 0.31 0.00 0.00 61.69 61.16 2put s THR 665 Cb -0.11 -1.84 0.06 0.00 0.01 0.00 0.00 72.50 70.62 2put s THR 665 CO 0.01 0.56 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.65 2put s LEU 666 N 0.08 3.34 -0.07 4.42 1.43 0.55 -4.94 118.68 123.50 2put s LEU 666 Ca -0.10 -1.39 -0.15 0.00 -1.03 0.00 0.00 54.13 51.46 2put s LEU 666 Cb -0.16 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.53 2put s LEU 666 CO 0.06 -0.21 0.38 -1.61 0.23 0.00 0.00 176.35 175.20 2put s GLU 667 N 1.15 4.03 0.11 1.70 2.02 -1.26 -2.04 118.70 124.41 2put s GLU 667 Ca -0.08 0.31 0.07 0.00 0.02 0.00 0.00 54.97 55.29 2put s GLU 667 Cb -0.20 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.69 2put s GLU 667 CO -0.05 0.50 -0.17 0.14 0.02 0.00 0.00 175.26 175.70 2put s VAL 668 N -0.42 1.46 0.67 2.63 -7.23 -0.19 -4.79 120.40 112.54 2put s VAL 668 Ca 0.22 -1.62 -0.17 0.00 -1.81 0.00 0.00 61.98 58.60 2put s VAL 668 Cb -0.15 -1.49 0.00 0.00 0.56 0.00 0.00 36.38 35.30 2put s VAL 668 CO 0.10 -0.27 1.26 -2.84 -0.31 0.00 0.00 175.10 173.04 2put s PRO 669 N -2.29 2.45 0.01 4.82 0.02 -1.26 -1.36 135.00 137.39 2put s PRO 669 Ca 0.07 1.94 -0.26 0.00 0.02 0.00 0.00 61.00 62.77 2put s PRO 669 Cb -0.07 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 2put s PRO 669 CO 0.04 -1.64 0.82 -2.00 -0.33 0.00 0.00 177.00 173.89 2put s GLU 670 N -3.54 4.52 0.11 5.54 2.12 -1.26 -4.84 118.70 121.34 2put s GLU 670 Ca 0.79 1.14 0.01 0.00 0.36 0.00 0.00 54.97 57.27 2put s GLU 670 Cb -0.34 -3.41 -0.00 0.00 0.26 0.00 0.00 34.13 30.64 2put s GLU 670 CO 0.41 0.14 0.02 -2.37 -0.54 0.00 0.00 175.26 172.91 2put n THR 671 N 3.33 0.00 -1.81 -1.70 5.66 -1.26 -5.10 114.28 113.40 2put n THR 671 Ca 0.00 -0.56 -0.41 0.00 -3.05 0.00 0.00 64.05 60.03 2put n THR 671 Cb 0.51 0.16 -0.01 0.00 -1.55 0.00 0.00 70.33 69.44 2put n THR 671 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2put s VAL 672 N -1.69 2.11 0.28 1.08 1.01 -1.26 -4.77 120.40 117.16 2put s VAL 672 Ca 0.03 0.10 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 2put s VAL 672 Cb 0.00 -3.06 0.40 0.00 0.00 0.00 0.00 36.38 33.72 2put s VAL 672 CO 0.02 0.02 1.58 -2.24 0.00 0.00 0.00 175.10 174.48 2put h ASP 673 N 3.80 -0.71 0.51 3.32 3.04 -1.99 0.17 116.42 124.57 2put h ASP 673 Ca -0.49 0.27 0.00 0.00 -3.24 0.00 0.00 57.03 53.57 2put h ASP 673 Cb 1.23 0.53 0.00 0.00 -1.04 0.00 0.00 39.33 40.05 2put h ASP 673 CO 0.71 -0.31 0.00 0.00 -2.04 0.00 0.00 179.24 177.60 2put n LEU 675 N -1.33 0.96 -0.30 0.00 4.77 0.57 -4.60 117.00 117.07 2put n LEU 675 Ca 0.10 -0.56 0.06 0.00 -0.03 0.00 0.00 56.01 55.58 2put n LEU 675 Cb 0.20 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.56 2put n LEU 675 CO 0.19 0.22 1.24 -0.61 -1.33 0.00 0.00 177.39 177.10 2put h GLN 676 N 0.42 0.92 -0.69 3.23 5.75 -1.16 -0.70 115.11 122.88 2put h GLN 676 Ca 0.00 -0.06 0.20 0.00 -0.15 0.00 0.00 58.65 58.65 2put h GLN 676 Cb 0.42 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 2put h GLN 676 CO 0.00 0.61 0.56 0.78 -2.65 0.00 0.00 178.83 178.13 2put h GLY 677 N 0.95 0.00 1.58 2.39 0.00 -1.81 0.88 103.07 107.07 2put h GLY 677 Ca 0.41 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.61 2put h GLY 677 CO -0.17 0.00 -0.43 1.41 0.00 0.00 0.00 176.54 177.35 2put h LEU 678 N 0.00 0.49 0.11 3.11 3.38 -1.45 -2.50 115.31 118.45 2put h LEU 678 Ca 0.33 -0.22 -0.34 0.00 0.09 0.00 0.00 57.88 57.74 2put h LEU 678 Cb 1.44 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 2put h LEU 678 CO -0.00 0.86 -1.78 -0.07 0.09 0.00 0.00 178.44 177.53 2put h LEU 679 N 0.37 0.38 -1.73 1.67 3.38 -1.24 -3.38 115.31 114.76 2put h LEU 679 Ca 0.03 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 57.28 2put h LEU 679 Cb 0.91 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 2put h LEU 679 CO 0.08 1.60 -0.16 0.78 0.09 0.00 0.00 178.44 180.83 2put h ASN 680 N 0.07 0.00 1.06 -0.43 4.21 -0.88 -2.74 115.58 116.86 2put h ASN 680 Ca -0.34 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.10 2put h ASN 680 Cb 2.04 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 39.23 2put h ASN 680 CO 0.12 0.16 -0.35 1.62 -1.29 0.00 0.00 177.43 177.69 2put h VAL 681 N 0.00 0.76 -0.13 2.81 3.04 -1.61 -3.35 116.25 117.75 2put h VAL 681 Ca -0.00 -1.56 -0.01 0.00 -1.01 0.00 0.00 66.70 64.12 2put h VAL 681 Cb 0.42 2.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.70 2put h VAL 681 CO 0.02 0.35 0.04 0.40 -1.01 0.00 0.00 177.57 177.37 2put h ILE 682 N 0.00 1.18 0.00 3.17 1.08 -1.67 -0.67 117.51 120.60 2put h ILE 682 Ca -0.00 -0.55 -0.02 0.00 -0.39 0.00 0.00 64.86 63.90 2put h ILE 682 Cb 0.98 1.29 -0.00 0.00 -3.07 0.00 0.00 36.82 36.02 2put h ILE 682 CO 0.05 0.17 -0.08 -0.65 -0.69 0.00 0.00 178.15 176.94 2put h PRO 683 N 0.04 0.00 -0.36 2.37 0.11 -1.74 -1.38 132.00 131.03 2put h PRO 683 Ca 0.04 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.01 2put h PRO 683 Cb 0.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 2put h PRO 683 CO -0.00 0.08 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.46 2put h LEU 684 N 0.00 0.88 -0.41 2.35 -0.00 -1.50 0.59 115.31 117.21 2put h LEU 684 Ca -0.00 -0.38 0.03 0.00 -0.00 0.00 0.00 57.88 57.53 2put h LEU 684 Cb 0.16 -0.24 -0.03 0.00 -0.00 0.00 0.00 40.66 40.54 2put h LEU 684 CO 0.01 1.13 0.21 1.56 -0.00 0.00 0.00 178.44 181.35 2put h GLN 685 N 0.69 0.42 -0.39 1.13 4.20 -0.17 -0.23 115.11 120.76 2put h GLN 685 Ca 0.07 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.64 2put h GLN 685 Cb 0.90 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.58 2put h GLN 685 CO 0.08 0.27 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.25 2put h LEU 686 N 0.43 0.84 -0.33 1.46 3.38 -1.14 -1.70 115.31 118.25 2put h LEU 686 Ca 0.18 -0.41 0.03 0.00 0.09 0.00 0.00 57.88 57.77 2put h LEU 686 Cb 0.07 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2put h LEU 686 CO -0.12 1.07 0.14 0.40 0.09 0.00 0.00 178.44 180.02 2put h ILE 687 N 0.62 0.95 -0.76 1.22 2.04 -0.75 0.10 117.51 120.92 2put h ILE 687 Ca 0.08 -0.10 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 2put h ILE 687 Cb 0.75 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 2put h ILE 687 CO 0.06 0.05 0.29 0.77 0.00 0.00 0.00 178.15 179.32 2put h SER 688 N 0.30 1.05 0.29 1.72 4.64 -0.93 0.17 113.55 120.80 2put h SER 688 Ca 0.14 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 2put h SER 688 Cb 0.09 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2put h SER 688 CO -0.12 0.94 -0.14 0.22 -0.87 0.00 0.00 176.83 176.85 2put h TYR 689 N 1.10 -0.36 -0.00 4.77 3.20 -1.01 -2.38 116.97 122.28 2put h TYR 689 Ca 0.25 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 62.02 2put h TYR 689 Cb 0.23 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2put h TYR 689 CO 0.02 -0.07 -0.44 -1.49 -1.64 0.00 0.00 178.16 174.53 2put h TRP 690 N -0.64 0.00 -0.47 -3.82 4.06 -0.67 -1.76 115.95 112.65 2put h TRP 690 Ca -0.04 -0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 2put h TRP 690 Cb 0.46 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.59 2put h TRP 690 CO 0.01 0.45 0.25 -0.07 -3.56 0.00 0.00 178.44 175.51 2put h LEU 691 N 0.00 0.59 -0.03 -4.49 3.38 -0.99 -0.29 115.31 113.48 2put h LEU 691 Ca -0.00 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.89 2put h LEU 691 Cb 0.79 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 2put h LEU 691 CO 0.06 0.52 -0.16 0.00 0.09 0.00 0.00 178.44 178.95 2put h ALA 692 N 1.09 -0.16 -0.53 1.53 0.00 -1.14 -1.03 119.26 119.02 2put h ALA 692 Ca 0.16 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2put h ALA 692 Cb 0.07 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2put h ALA 692 CO -0.03 -0.64 0.33 0.28 0.00 0.00 0.00 179.25 179.20 2put h VAL 693 N -0.24 1.08 -0.19 0.00 2.07 -1.10 -0.16 116.25 117.71 2put h VAL 693 Ca 0.06 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2put h VAL 693 Cb 0.33 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2put h VAL 693 CO -0.17 0.12 0.09 0.78 0.02 0.00 0.00 177.57 178.41 2put h ASN 694 N 0.67 0.23 -0.37 0.57 2.35 -0.91 -1.96 115.58 116.16 2put h ASN 694 Ca 0.21 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2put h ASN 694 Cb -0.01 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2put h ASN 694 CO -0.08 0.20 0.00 0.54 -1.65 0.00 0.00 177.43 176.44 2put n ARG 695 N -4.47 1.88 -1.81 0.81 1.74 -0.40 -4.93 116.66 109.47 2put n ARG 695 Ca -0.00 -1.36 -0.12 0.00 -0.77 0.00 0.00 57.85 55.60 2put n ARG 695 Cb 0.11 -1.30 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 2put n ARG 695 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2put n GLY 696 N 1.11 0.55 3.77 -0.13 0.00 -0.74 -5.02 105.19 104.73 2put n GLY 696 Ca 0.13 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 2put n GLY 696 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2put s ILE 697 N -2.52 5.19 -0.65 -0.61 1.01 -0.16 -5.01 121.20 118.45 2put s ILE 697 Ca 0.00 0.75 -0.23 0.00 0.00 0.00 0.00 60.65 61.16 2put s ILE 697 Cb 0.00 -3.70 0.06 0.00 0.01 0.00 0.00 42.46 38.83 2put s ILE 697 CO 0.00 0.45 1.00 -0.62 0.00 0.00 0.00 174.94 175.77 2put s ASP 698 N -0.09 6.20 0.39 3.58 -1.08 -1.26 -4.27 116.67 120.15 2put s ASP 698 Ca 0.22 -0.79 0.28 0.00 -0.52 0.00 0.00 52.55 51.73 2put s ASP 698 Cb -0.15 -2.44 1.38 0.00 -1.46 0.00 0.00 42.92 40.25 2put s ASP 698 CO 0.09 -1.45 1.84 -0.37 0.52 0.00 0.00 175.17 175.81 2put h VAL 699 N 5.99 0.00 -0.02 1.11 -1.51 -1.94 -3.53 116.25 116.35 2put h VAL 699 Ca -0.28 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 2put h VAL 699 Cb 1.07 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 2put h VAL 699 CO 1.17 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.98