#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 3.52 0.12 0.54 2.02 -1.26 -5.01 117.35 117.28 2put s TYR 350 Ca 0.00 0.46 -0.13 0.00 -0.37 0.00 0.00 57.07 57.03 2put s TYR 350 Cb 0.00 -1.92 -0.07 0.00 -0.40 0.00 0.00 41.96 39.57 2put s TYR 350 CO 0.00 0.54 1.45 0.87 -1.57 0.00 0.00 175.55 176.83 2put h LYS 351 N 3.24 0.82 -4.18 -0.62 1.57 -2.02 -3.46 116.57 111.91 2put h LYS 351 Ca -0.47 -0.44 -0.14 0.00 -1.87 0.00 0.00 60.65 57.74 2put h LYS 351 Cb 1.17 0.02 -0.17 0.00 0.08 0.00 0.00 32.23 33.33 2put h LYS 351 CO 0.72 1.07 -0.69 -1.01 -0.57 0.00 0.00 179.45 178.98 2put s HIS 352 N -4.37 0.46 0.33 -1.35 3.76 -1.26 -5.04 115.29 107.83 2put s HIS 352 Ca -0.12 -0.91 0.05 0.00 -0.15 0.00 0.00 55.06 53.93 2put s HIS 352 Cb 0.10 -0.34 0.70 0.00 1.11 0.00 0.00 32.58 34.14 2put s HIS 352 CO 0.86 -0.32 1.89 0.74 -0.85 0.00 0.00 174.74 177.06 2put h PHE 353 N 3.56 0.91 -0.37 1.40 0.04 -1.95 -1.59 116.94 118.94 2put h PHE 353 Ca -0.34 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.47 2put h PHE 353 Cb 1.16 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.99 2put h PHE 353 CO 0.57 0.40 0.22 1.98 -0.60 0.00 0.00 178.31 180.88 2put h MET 354 N 0.83 0.43 -0.58 1.51 4.05 -1.92 -0.67 114.93 118.57 2put h MET 354 Ca 0.41 -0.03 -0.05 0.00 -0.28 0.00 0.00 59.70 59.76 2put h MET 354 Cb 0.47 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.15 2put h MET 354 CO -0.18 0.28 0.18 0.37 0.23 0.00 0.00 176.91 177.80 2put h GLN 355 N 0.44 0.91 -0.54 0.39 4.15 -1.75 -1.36 115.11 117.36 2put h GLN 355 Ca 0.14 -0.20 0.05 0.00 0.77 0.00 0.00 58.65 59.42 2put h GLN 355 Cb -0.00 -0.13 -0.05 0.00 0.21 0.00 0.00 27.48 27.51 2put h GLN 355 CO -0.06 0.82 0.26 -0.22 -1.93 0.00 0.00 178.83 177.70 2put h LYS 356 N 0.83 0.49 -0.18 1.69 3.64 -1.11 -1.73 116.57 120.20 2put h LYS 356 Ca 0.19 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.38 2put h LYS 356 Cb 0.29 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 2put h LYS 356 CO -0.01 0.33 -0.54 0.93 -2.27 0.00 0.00 179.45 177.89 2put h GLU 357 N 0.51 0.54 -0.43 1.90 5.08 -0.89 0.79 114.58 122.07 2put h GLU 357 Ca 0.24 -0.33 0.05 0.00 -1.00 0.00 0.00 59.36 58.32 2put h GLU 357 Cb 0.17 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 2put h GLU 357 CO -0.18 0.94 0.17 0.82 -1.00 0.00 0.00 179.01 179.76 2put h ILE 358 N 0.41 0.89 0.00 3.13 2.04 -1.05 -2.89 117.51 120.05 2put h ILE 358 Ca 0.01 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2put h ILE 358 Cb 1.08 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2put h ILE 358 CO 0.10 0.06 0.00 0.49 0.00 0.00 0.00 178.15 178.80 2put n PHE 359 N -4.98 0.88 0.71 1.37 3.01 -0.67 -2.46 117.46 115.32 2put n PHE 359 Ca 0.03 0.27 0.10 0.00 1.01 0.00 0.00 57.45 58.86 2put n PHE 359 Cb 0.15 -0.94 0.44 0.00 -0.01 0.00 0.00 39.48 39.12 2put n PHE 359 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2put n GLU 360 N -2.23 0.01 -0.12 -1.08 2.13 0.21 -4.35 120.64 115.21 2put n GLU 360 Ca 0.05 0.15 0.04 0.00 0.66 0.00 0.00 57.16 58.06 2put n GLU 360 Cb 0.40 -1.51 0.36 0.00 0.27 0.00 0.00 31.44 30.95 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 0.72 -0.85 5.31 4.20 -1.52 0.17 115.11 123.14 2put h GLN 361 Ca 0.00 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.74 2put h GLN 361 Cb 0.36 -0.16 -0.07 0.00 0.30 0.00 0.00 27.48 27.92 2put h GLN 361 CO 0.00 0.48 0.51 -1.35 -0.67 0.00 0.00 178.83 177.80 2put h PRO 362 N 0.74 0.87 -0.22 1.46 0.11 -1.81 0.57 132.00 133.73 2put h PRO 362 Ca 0.24 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 2put h PRO 362 Cb 0.03 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 30.95 2put h PRO 362 CO -0.06 0.58 -0.35 -0.44 -0.21 0.00 0.00 178.00 177.51 2put h ASP 363 N 0.90 0.69 0.05 -2.05 3.32 -1.40 -2.70 116.42 115.22 2put h ASP 363 Ca 0.39 -0.53 -0.13 0.00 0.02 0.00 0.00 57.03 56.78 2put h ASP 363 Cb 0.26 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2put h ASP 363 CO -0.21 1.08 -0.42 0.77 -1.72 0.00 0.00 179.24 178.74 2put h SER 364 N 0.32 0.50 -0.60 6.45 4.64 -0.86 -0.07 113.55 123.92 2put h SER 364 Ca 0.02 -0.22 -0.07 0.00 -0.47 0.00 0.00 61.79 61.04 2put h SER 364 Cb 0.94 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 2put h SER 364 CO 0.08 0.86 0.09 0.00 -0.87 0.00 0.00 176.83 176.99 2put h ALA 365 N 1.16 0.80 -0.48 5.18 0.00 -0.94 -0.87 119.26 124.11 2put h ALA 365 Ca 0.03 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 2put h ALA 365 Cb 0.91 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2put h ALA 365 CO 0.08 0.56 0.04 0.35 0.00 0.00 0.00 179.25 180.27 2put h PHE 366 N 0.90 0.89 -0.21 0.00 3.04 -1.32 -3.01 116.94 117.23 2put h PHE 366 Ca 0.18 -0.14 -0.09 0.00 3.98 0.00 0.00 57.97 61.90 2put h PHE 366 Cb 0.44 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.70 2put h PHE 366 CO 0.03 0.83 -0.28 -0.91 -2.02 0.00 0.00 178.31 175.97 2put h ASN 367 N 0.68 0.41 -0.92 0.41 2.35 -0.72 -1.71 115.58 116.08 2put h ASN 367 Ca 0.14 -0.14 0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2put h ASN 367 Cb 0.46 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.66 2put h ASN 367 CO 0.02 0.68 0.60 0.74 -1.65 0.00 0.00 177.43 177.82 2put h THR 368 N 0.36 1.13 0.00 2.81 2.02 -1.04 -2.98 112.91 115.20 2put h THR 368 Ca 0.05 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.85 2put h THR 368 Cb 0.67 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2put h THR 368 CO 0.05 0.20 -0.59 0.24 0.37 0.00 0.00 175.52 175.79 2put h MET 369 N 1.12 0.00 -6.47 6.66 2.86 -1.33 -3.46 114.93 114.31 2put h MET 369 Ca 0.38 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.49 2put h MET 369 Cb 0.08 0.00 0.03 0.00 0.06 0.00 0.00 31.60 31.77 2put h MET 369 CO -0.13 0.00 1.11 0.50 1.06 0.00 0.00 176.91 179.46 2put s ARG 370 N -3.17 4.15 0.00 1.72 3.52 -0.68 -0.89 118.95 123.60 2put s ARG 370 Ca 0.06 2.55 0.00 0.00 -0.13 0.00 0.00 55.73 58.21 2put s ARG 370 Cb 0.13 -3.69 0.00 0.00 -1.56 0.00 0.00 34.95 29.83 2put s ARG 370 CO 0.72 -0.84 0.00 0.41 -0.81 0.00 0.00 175.30 174.77 2put n GLY 371 N 4.24 0.64 0.00 8.12 0.00 -1.26 -4.82 105.19 112.10 2put n GLY 371 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.71 1.46 -4.64 1.61 1.74 -0.06 -4.88 116.66 109.17 2put n ARG 372 Ca 0.00 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.79 2put n ARG 372 Cb 0.00 -0.87 -0.17 0.00 -1.02 0.00 0.00 32.46 30.40 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 -1.61 1.65 -0.47 0.55 1.01 -1.09 -0.22 121.20 121.02 2put s ILE 373 Ca 0.00 -0.74 -0.20 0.00 0.00 0.00 0.00 60.65 59.71 2put s ILE 373 Cb 0.00 -1.48 0.04 0.00 0.01 0.00 0.00 42.46 41.03 2put s ILE 373 CO 0.00 0.47 0.62 -0.62 0.00 0.00 0.00 174.94 175.41 2put s ASP 374 N 0.81 6.26 0.28 3.58 -1.08 0.54 -4.93 116.67 122.14 2put s ASP 374 Ca -0.10 -0.62 0.15 0.00 -0.52 0.00 0.00 52.55 51.46 2put s ASP 374 Cb -0.16 -2.30 0.19 0.00 -1.46 0.00 0.00 42.92 39.20 2put s ASP 374 CO 0.01 -0.81 1.50 -0.26 0.52 0.00 0.00 175.17 176.12 2put h PHE 375 N 8.92 0.00 0.19 -5.34 0.04 -1.95 0.18 116.94 118.98 2put h PHE 375 Ca -0.26 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.50 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 0.73 0.55 -0.09 0.93 -0.60 0.00 0.00 178.31 179.83 2put h GLU 376 N 0.00 -0.25 -0.00 1.51 5.08 -1.98 -3.32 114.58 115.62 2put h GLU 376 Ca -0.01 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2put h GLU 376 Cb 1.31 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2put h GLU 376 CO 0.07 0.15 -0.16 0.09 -1.00 0.00 0.00 179.01 178.16 2put n ASN 377 N -4.98 0.35 -3.35 1.42 4.13 -1.24 -4.97 115.26 106.62 2put n ASN 377 Ca -0.08 -0.23 -0.16 0.00 1.68 0.00 0.00 54.58 55.78 2put n ASN 377 Cb 0.26 -0.12 0.08 0.00 -1.54 0.00 0.00 39.78 38.46 2put n ASN 377 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2put s VAL 379 N -3.39 1.62 -0.14 0.00 1.01 -0.84 -4.93 120.40 113.73 2put s VAL 379 Ca 0.25 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.41 2put s VAL 379 Cb -0.04 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 2put s VAL 379 CO 0.74 0.47 0.33 -0.69 0.00 0.00 0.00 175.10 175.95 2put s VAL 380 N 1.32 5.27 -0.25 2.92 1.01 -1.26 -0.34 120.40 129.08 2put s VAL 380 Ca 0.02 0.63 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 2put s VAL 380 Cb -0.13 -3.67 0.07 0.00 0.00 0.00 0.00 36.38 32.65 2put s VAL 380 CO -0.08 0.39 0.03 -0.89 0.00 0.00 0.00 175.10 174.55 2put s THR 381 N 0.36 0.96 -0.50 3.92 2.01 0.69 -4.86 115.64 118.21 2put s THR 381 Ca 0.19 -1.06 -0.14 0.00 0.31 0.00 0.00 61.69 60.98 2put s THR 381 Cb -0.14 -1.49 0.11 0.00 0.01 0.00 0.00 72.50 71.00 2put s THR 381 CO 0.06 -0.35 0.43 -0.76 -0.69 0.00 0.00 174.62 173.31 2put s LEU 382 N 1.63 5.90 0.26 4.42 1.43 -1.26 -4.46 118.68 126.59 2put s LEU 382 Ca 0.02 -1.69 -0.02 0.00 -1.03 0.00 0.00 54.13 51.41 2put s LEU 382 Cb -0.18 -2.15 0.45 0.00 0.03 0.00 0.00 46.19 44.34 2put s LEU 382 CO -0.13 -0.76 1.83 1.23 0.23 0.00 0.00 176.35 178.75 2put h GLY 383 N 8.74 1.45 2.00 -3.19 0.00 -1.94 -1.02 103.07 109.11 2put h GLY 383 Ca -0.28 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.67 2put h GLY 383 CO 0.95 0.18 0.00 -1.33 0.00 0.00 0.00 176.54 176.34 2put h GLY 384 N 0.94 0.00 -0.04 4.60 0.00 -1.94 -3.11 103.07 103.52 2put h GLY 384 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2put h GLY 384 CO -0.24 0.00 -0.06 1.04 0.00 0.00 0.00 176.54 177.29 2put n LEU 385 N -2.93 0.36 -0.15 3.11 4.77 -0.44 -3.82 117.00 117.91 2put n LEU 385 Ca -0.02 -0.63 -0.04 0.00 -0.03 0.00 0.00 56.01 55.29 2put n LEU 385 Cb 0.10 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.35 2put n LEU 385 CO 0.19 0.09 0.94 0.50 -1.33 0.00 0.00 177.39 177.78 2put h LYS 386 N 0.10 0.87 0.00 3.23 1.63 -1.35 0.37 116.57 121.42 2put h LYS 386 Ca 0.00 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2put h LYS 386 Cb 0.05 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 2put h LYS 386 CO 0.00 0.81 0.00 0.43 -3.45 0.00 0.00 179.45 177.24 2put n SER 387 N -4.25 0.00 -0.00 4.20 7.64 -1.26 -3.56 113.62 116.39 2put n SER 387 Ca 0.04 0.36 0.07 0.00 1.01 0.00 0.00 58.87 60.34 2put n SER 387 Cb 0.26 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 62.93 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 -1.43 0.00 -0.34 1.43 7.02 0.13 -4.60 117.44 119.64 2put n TRP 388 Ca 0.05 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.54 2put n TRP 388 Cb 0.18 -0.13 0.15 0.00 -2.42 0.00 0.00 31.31 29.09 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 0.95 -1.02 -0.99 3.38 -1.51 0.24 115.31 116.37 2put h LEU 389 Ca 0.00 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2put h LEU 389 Cb 0.46 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2put h LEU 389 CO 0.00 0.62 -0.33 0.77 0.09 0.00 0.00 178.44 179.59 2put h SER 390 N 1.10 0.29 -0.00 -0.43 4.64 -1.84 -1.71 113.55 115.60 2put h SER 390 Ca 0.39 -0.11 -0.20 0.00 -0.47 0.00 0.00 61.79 61.41 2put h SER 390 Cb 0.12 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.15 2put h SER 390 CO -0.16 0.62 -0.77 0.74 -0.87 0.00 0.00 176.83 176.39 2put h THR 391 N 0.25 1.37 -0.59 2.95 2.02 -1.63 -3.22 112.91 114.05 2put h THR 391 Ca 0.03 -2.14 0.09 0.00 0.77 0.00 0.00 66.41 65.16 2put h THR 391 Cb 0.72 2.50 -0.07 0.00 -1.74 0.00 0.00 68.15 69.56 2put h THR 391 CO 0.05 0.64 0.21 0.40 0.37 0.00 0.00 175.52 177.19 2put h ILE 392 N 0.10 0.77 0.00 3.11 2.04 -0.22 -1.54 117.51 121.77 2put h ILE 392 Ca -0.10 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2put h ILE 392 Cb 1.46 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 2put h ILE 392 CO 0.15 0.07 0.00 -0.09 0.00 0.00 0.00 178.15 178.28 2put h ARG 393 N 0.39 0.00 -2.50 2.37 2.43 -1.38 -3.28 114.38 112.41 2put h ARG 393 Ca 0.29 0.00 -0.75 0.00 -0.81 0.00 0.00 59.98 58.71 2put h ARG 393 Cb 0.36 0.00 -0.31 0.00 -0.42 0.00 0.00 29.97 29.60 2put h ARG 393 CO -0.30 0.00 0.50 -2.13 -1.51 0.00 0.00 179.97 176.52 2put n ARG 394 N -2.80 4.40 -4.36 0.20 3.00 -0.58 -4.98 116.66 111.54 2put n ARG 394 Ca -0.01 -4.66 -0.18 0.00 -0.00 0.00 0.00 57.85 53.00 2put n ARG 394 Cb 0.13 -2.43 -0.10 0.00 0.00 0.00 0.00 32.46 30.06 2put n ARG 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2put h ARG 396 N 2.41 0.74 -1.99 0.00 2.43 -1.02 -3.48 114.38 113.46 2put h ARG 396 Ca -0.39 -0.39 0.19 0.00 -0.81 0.00 0.00 59.98 58.57 2put h ARG 396 Cb 1.23 0.02 -0.14 0.00 -0.42 0.00 0.00 29.97 30.65 2put h ARG 396 CO 0.65 1.02 0.61 -0.98 -1.51 0.00 0.00 179.97 179.76 2put s ARG 397 N -4.28 0.72 -0.15 0.20 1.04 -1.25 -4.50 118.95 110.73 2put s ARG 397 Ca -0.09 -0.32 -0.03 0.00 -1.04 0.00 0.00 55.73 54.25 2put s ARG 397 Cb 0.12 0.30 -0.03 0.00 -2.04 0.00 0.00 34.95 33.30 2put s ARG 397 CO 0.85 -0.32 -0.04 0.42 -0.04 0.00 0.00 175.30 176.17 2put s ILE 398 N -2.89 3.84 -0.24 4.99 1.01 0.38 -1.69 121.20 126.60 2put s ILE 398 Ca 0.09 -0.38 -0.03 0.00 0.00 0.00 0.00 60.65 60.33 2put s ILE 398 Cb -0.00 -2.67 0.01 0.00 0.01 0.00 0.00 42.46 39.81 2put s ILE 398 CO -0.05 0.50 -0.05 -0.63 0.00 0.00 0.00 174.94 174.71 2put s ILE 399 N 0.29 3.08 -0.14 2.92 1.01 0.30 -1.34 121.20 127.32 2put s ILE 399 Ca -0.04 -0.85 -0.18 0.00 0.00 0.00 0.00 60.65 59.58 2put s ILE 399 Cb -0.14 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2put s ILE 399 CO 0.03 0.26 0.49 -0.04 0.00 0.00 0.00 174.94 175.68 2put s MET 400 N 1.38 4.30 -0.07 2.79 -1.94 0.32 -0.15 119.30 125.93 2put s MET 400 Ca 0.02 0.44 0.01 0.00 -1.71 0.00 0.00 55.69 54.45 2put s MET 400 Cb -0.16 -3.47 0.02 0.00 2.01 0.00 0.00 34.83 33.23 2put s MET 400 CO -0.04 0.08 -0.09 0.42 -0.01 0.00 0.00 175.02 175.38 2put s ILE 401 N 0.89 0.92 0.19 2.53 1.01 0.59 -0.45 121.20 126.88 2put s ILE 401 Ca 0.25 -0.32 -0.23 0.00 0.00 0.00 0.00 60.65 60.35 2put s ILE 401 Cb -0.15 -0.89 0.07 0.00 0.01 0.00 0.00 42.46 41.50 2put s ILE 401 CO 0.10 0.32 0.97 0.00 0.00 0.00 0.00 174.94 176.33 2put s ALA 402 N 0.96 -1.53 0.12 9.38 0.00 -0.87 -2.82 121.76 127.00 2put s ALA 402 Ca -0.10 -0.16 0.10 0.00 0.00 0.00 0.00 51.96 51.81 2put s ALA 402 Cb -0.15 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 2put s ALA 402 CO 0.00 -1.05 -0.25 0.00 0.00 0.00 0.00 175.76 174.47 2put n GLY 404 N 1.02 3.06 0.29 0.00 0.00 -1.26 -1.94 105.19 106.35 2put n GLY 404 Ca -0.19 -0.30 0.02 0.00 0.00 0.00 0.00 46.02 45.55 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 1.14 -0.41 2.61 2.02 -1.98 -1.79 112.91 114.50 2put h THR 405 Ca 0.00 -0.45 -0.06 0.00 0.77 0.00 0.00 66.41 66.67 2put h THR 405 Cb 0.00 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 2put h THR 405 CO 0.00 0.17 0.01 0.28 0.37 0.00 0.00 175.52 176.35 2put h SER 406 N 0.52 0.62 -0.94 4.18 0.02 -1.72 -1.17 113.55 115.06 2put h SER 406 Ca 0.13 -0.13 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2put h SER 406 Cb 0.11 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.44 2put h SER 406 CO -0.01 0.69 0.62 0.22 -1.14 0.00 0.00 176.83 177.21 2put h TYR 407 N 0.63 1.18 -0.77 3.45 3.20 -0.93 -2.75 116.97 120.97 2put h TYR 407 Ca 0.13 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 2put h TYR 407 Cb 0.38 -0.40 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 2put h TYR 407 CO 0.02 0.74 0.41 0.45 -1.64 0.00 0.00 178.16 178.14 2put h HIS 408 N 1.28 1.06 0.00 -3.82 3.86 -0.59 -1.31 115.15 115.62 2put h HIS 408 Ca 0.35 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.47 2put h HIS 408 Cb -0.15 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 27.98 2put h HIS 408 CO -0.01 0.74 -0.28 0.66 0.86 0.00 0.00 177.93 179.90 2put h SER 409 N 1.08 0.00 0.03 2.45 4.64 -0.97 0.88 113.55 121.66 2put h SER 409 Ca 0.27 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2put h SER 409 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2put h SER 409 CO -0.04 0.28 -0.01 0.00 -0.87 0.00 0.00 176.83 176.19 2put h LEU 411 N -0.35 0.96 -2.00 0.00 3.38 -0.69 -1.03 115.31 115.58 2put h LEU 411 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2put h LEU 411 Cb 0.33 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2put h LEU 411 CO 0.01 0.62 -0.08 0.00 0.09 0.00 0.00 178.44 179.07 2put h ALA 412 N 1.42 1.19 -0.01 1.53 0.00 -0.78 -3.22 119.26 119.40 2put h ALA 412 Ca 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2put h ALA 412 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2put h ALA 412 CO -0.16 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.44 2put n THR 413 N -3.47 0.08 -0.15 0.00 -2.24 -0.98 -4.74 114.28 102.79 2put n THR 413 Ca -0.02 -0.54 -0.04 0.00 -2.27 0.00 0.00 64.05 61.19 2put n THR 413 Cb 0.23 1.02 0.05 0.00 -2.10 0.00 0.00 70.33 69.52 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 0.61 0.34 -0.42 -0.78 2.43 -1.21 -1.88 114.38 113.47 2put h ARG 414 Ca 0.00 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2put h ARG 414 Cb 0.16 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 2put h ARG 414 CO 0.00 0.22 0.18 1.03 -1.51 0.00 0.00 179.97 179.90 2put h SER 415 N 0.35 0.57 -0.09 -3.80 0.87 -1.85 -0.48 113.55 109.12 2put h SER 415 Ca 0.22 -0.15 -0.12 0.00 -1.23 0.00 0.00 61.79 60.51 2put h SER 415 Cb 0.21 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 2put h SER 415 CO -0.21 0.56 -0.32 -0.29 -0.53 0.00 0.00 176.83 176.03 2put h ILE 416 N 0.54 1.28 -0.56 2.23 6.09 -1.85 0.22 117.51 125.46 2put h ILE 416 Ca 0.14 -1.44 0.00 0.00 -1.37 0.00 0.00 64.86 62.20 2put h ILE 416 Cb 0.16 1.43 -0.03 0.00 0.47 0.00 0.00 36.82 38.85 2put h ILE 416 CO -0.01 0.46 0.37 -0.26 -3.07 0.00 0.00 178.15 175.63 2put h PHE 417 N 0.49 0.71 -0.22 2.19 0.04 -0.99 -1.17 116.94 117.99 2put h PHE 417 Ca 0.06 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 2put h PHE 417 Cb 0.80 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2put h PHE 417 CO 0.03 0.46 0.08 0.93 -0.60 0.00 0.00 178.31 179.21 2put h GLU 418 N 0.76 0.33 0.02 1.51 5.08 -0.49 -1.55 114.58 120.25 2put h GLU 418 Ca 0.20 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2put h GLU 418 Cb -0.08 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2put h GLU 418 CO -0.04 0.40 -0.01 1.49 -1.00 0.00 0.00 179.01 179.85 2put h GLU 419 N 0.20 -0.02 0.07 2.33 4.81 -0.51 0.18 114.58 121.63 2put h GLU 419 Ca 0.07 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 59.06 2put h GLU 419 Cb 0.20 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.58 2put h GLU 419 CO -0.00 0.02 -1.09 -0.07 -0.73 0.00 0.00 179.01 177.13 2put h LEU 420 N -0.06 0.42 0.00 1.64 3.38 -1.20 -3.37 115.31 116.13 2put h LEU 420 Ca -0.00 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.51 2put h LEU 420 Cb 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2put h LEU 420 CO 0.00 1.25 -2.02 0.35 0.09 0.00 0.00 178.44 178.11 2put n THR 421 N -3.61 0.24 -1.88 0.22 -2.24 -0.59 -4.75 114.28 101.67 2put n THR 421 Ca -0.07 -0.54 -0.20 0.00 -2.27 0.00 0.00 64.05 60.97 2put n THR 421 Cb 0.93 -0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.03 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 -2.32 -1.56 -3.80 -0.78 1.02 0.05 -4.98 120.64 108.28 2put n GLU 422 Ca -0.09 1.08 -0.36 0.00 -0.02 0.00 0.00 57.16 57.77 2put n GLU 422 Cb 0.65 -5.55 -0.07 0.00 -0.02 0.00 0.00 31.44 26.45 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 -2.78 5.45 0.35 -3.67 1.01 -1.26 -5.08 121.20 115.23 2put s ILE 423 Ca 0.00 0.22 -0.28 0.00 0.00 0.00 0.00 60.65 60.59 2put s ILE 423 Cb 0.00 -3.44 -0.12 0.00 0.01 0.00 0.00 42.46 38.91 2put s ILE 423 CO 0.00 0.53 1.35 -2.65 0.00 0.00 0.00 174.94 174.18 2put n PRO 424 N 2.71 2.30 -3.94 2.79 -0.02 -1.26 -4.62 135.00 132.97 2put n PRO 424 Ca -0.18 0.81 -0.23 0.00 -2.02 0.00 0.00 63.50 61.88 2put n PRO 424 Cb 0.54 -2.44 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 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 -1.09 0.59 0.22 -1.45 1.01 -1.26 -0.47 120.40 117.96 2put s VAL 425 Ca 0.55 -0.06 0.11 0.00 0.00 0.00 0.00 61.98 62.58 2put s VAL 425 Cb -0.54 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 2put s VAL 425 CO 0.63 0.28 -0.20 -0.94 0.00 0.00 0.00 175.10 174.87 2put s SER 426 N 1.59 3.23 -0.12 3.32 1.04 -0.45 -5.00 113.70 117.31 2put s SER 426 Ca 0.00 -0.95 0.01 0.00 0.48 0.00 0.00 55.95 55.49 2put s SER 426 Cb -0.13 -0.24 0.02 0.00 0.10 0.00 0.00 66.02 65.77 2put s SER 426 CO -0.04 0.02 -0.14 -0.69 0.98 0.00 0.00 173.24 173.37 2put s VAL 427 N -2.26 1.46 -0.02 5.02 1.01 -1.26 -0.52 120.40 123.83 2put s VAL 427 Ca 0.24 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 61.69 2put s VAL 427 Cb -0.05 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2put s VAL 427 CO 0.11 0.44 -0.23 -1.61 0.00 0.00 0.00 175.10 173.80 2put s GLU 428 N 1.16 1.87 -0.10 2.72 0.41 0.41 -4.97 118.70 120.20 2put s GLU 428 Ca -0.03 -0.84 -0.29 0.00 -0.41 0.00 0.00 54.97 53.41 2put s GLU 428 Cb -0.14 -1.82 -0.02 0.00 -1.78 0.00 0.00 34.13 30.38 2put s GLU 428 CO -0.04 0.50 0.96 -1.17 -0.49 0.00 0.00 175.26 175.02 2put s LEU 429 N -0.56 4.25 0.27 1.80 2.96 -1.26 -2.05 118.68 124.09 2put s LEU 429 Ca 0.09 1.48 0.01 0.00 -0.22 0.00 0.00 54.13 55.48 2put s LEU 429 Cb -0.09 -3.49 0.59 0.00 0.50 0.00 0.00 46.19 43.70 2put s LEU 429 CO -0.01 -0.40 1.77 0.00 -1.32 0.00 0.00 176.35 176.38 2put h ALA 430 N 7.08 1.38 -0.47 5.97 0.00 -1.33 -0.06 119.26 131.84 2put h ALA 430 Ca -0.32 0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 2put h ALA 430 Cb 1.15 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2put h ALA 430 CO 0.84 -0.08 -0.25 0.66 0.00 0.00 0.00 179.25 180.42 2put h SER 431 N 0.66 1.02 -0.10 0.00 4.64 -1.85 -2.19 113.55 115.74 2put h SER 431 Ca 0.49 -0.40 -0.16 0.00 -0.47 0.00 0.00 61.79 61.25 2put h SER 431 Cb 0.72 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2put h SER 431 CO -0.37 1.21 -0.51 -0.78 -0.87 0.00 0.00 176.83 175.50 2put h ASP 432 N 0.85 0.74 -0.50 4.97 3.58 -1.76 -0.08 116.42 124.21 2put h ASP 432 Ca 0.10 -0.38 0.07 0.00 0.42 0.00 0.00 57.03 57.24 2put h ASP 432 Cb 0.83 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 41.62 2put h ASP 432 CO 0.07 1.12 0.18 0.15 -2.88 0.00 0.00 179.24 177.88 2put h PHE 433 N 0.52 0.32 -0.33 0.28 3.57 -0.90 -1.36 116.94 119.03 2put h PHE 433 Ca 0.02 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 2put h PHE 433 Cb 1.07 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 2put h PHE 433 CO 0.05 0.11 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.05 2put h LEU 434 N 0.36 0.68 -0.95 0.59 3.38 -1.26 -2.89 115.31 115.24 2put h LEU 434 Ca 0.24 -0.39 0.15 0.00 0.09 0.00 0.00 57.88 57.97 2put h LEU 434 Cb 0.25 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.72 2put h LEU 434 CO -0.24 0.92 0.56 0.44 0.09 0.00 0.00 178.44 180.20 2put h ASP 435 N 0.45 0.75 1.16 -0.43 3.32 -0.62 -1.38 116.42 119.66 2put h ASP 435 Ca 0.08 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2put h ASP 435 Cb 0.64 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2put h ASP 435 CO 0.04 0.34 -0.02 0.54 -1.72 0.00 0.00 179.24 178.42 2put n ARG 436 N -4.75 0.10 -3.82 3.56 1.74 -0.55 -4.95 116.66 108.00 2put n ARG 436 Ca 0.19 0.08 -0.24 0.00 -0.77 0.00 0.00 57.85 57.11 2put n ARG 436 Cb 0.44 -1.61 0.01 0.00 -1.02 0.00 0.00 32.46 30.28 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 -1.79 -4.46 -1.68 5.56 5.12 -0.52 -4.81 116.66 114.08 2put n ARG 437 Ca 0.06 0.55 -0.44 0.00 -1.93 0.00 0.00 57.85 56.09 2put n ARG 437 Cb 0.37 -5.03 -0.03 0.00 -1.16 0.00 0.00 32.46 26.61 2put n ARG 437 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2put n SER 438 N -3.00 3.88 -4.77 0.55 2.88 -1.10 -4.90 113.62 107.17 2put n SER 438 Ca -0.25 0.97 -0.41 0.00 -1.33 0.00 0.00 58.87 57.85 2put n SER 438 Cb 0.66 -1.50 -0.01 0.00 -0.75 0.00 0.00 64.21 62.61 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 3.28 4.16 0.04 -1.46 0.02 -1.26 -5.02 135.00 134.76 2put s PRO 439 Ca 0.86 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.38 2put s PRO 439 Cb -0.53 -3.00 -0.03 0.00 0.02 0.00 0.00 34.50 30.96 2put s PRO 439 CO 0.41 -0.49 -0.04 0.14 -0.33 0.00 0.00 177.00 176.69 2put s VAL 440 N -0.83 0.27 0.28 3.83 -7.23 -1.26 -5.16 120.40 110.30 2put s VAL 440 Ca 0.55 -1.27 0.02 0.00 -1.81 0.00 0.00 61.98 59.47 2put s VAL 440 Cb -0.45 -0.78 -0.03 0.00 0.56 0.00 0.00 36.38 35.67 2put s VAL 440 CO 0.57 -0.65 0.26 -0.36 -0.31 0.00 0.00 175.10 174.61 2put s PHE 441 N -2.30 1.41 0.58 2.82 0.08 -1.26 -4.86 117.98 114.46 2put s PHE 441 Ca -0.06 -1.49 0.30 0.00 0.12 0.00 0.00 56.93 55.80 2put s PHE 441 Cb -0.04 -0.55 1.82 0.00 -0.57 0.00 0.00 43.02 43.68 2put s PHE 441 CO -0.03 -0.82 2.25 0.07 -0.10 0.00 0.00 175.22 176.58 2put h ARG 442 N 2.31 0.00 -0.11 0.44 0.11 -1.72 -1.28 114.38 114.13 2put h ARG 442 Ca -0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.79 2put h ARG 442 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2put h ARG 442 CO 0.42 0.01 0.00 -0.40 0.10 0.00 0.00 179.97 180.10 2put n ASP 443 N -3.82 0.94 -4.85 0.08 5.68 -1.26 -4.35 116.55 108.97 2put n ASP 443 Ca -0.03 -1.68 -0.37 0.00 -0.50 0.00 0.00 54.79 52.21 2put n ASP 443 Cb 0.09 -0.07 -0.06 0.00 -1.14 0.00 0.00 41.12 39.93 2put n ASP 443 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 2put s ASP 444 N -1.44 6.55 -0.30 -1.12 1.01 -0.48 -0.29 116.67 120.61 2put s ASP 444 Ca 0.26 0.66 -0.10 0.00 0.71 0.00 0.00 52.55 54.08 2put s ASP 444 Cb 0.13 -2.15 -0.03 0.00 1.01 0.00 0.00 42.92 41.89 2put s ASP 444 CO 0.20 0.36 0.17 -0.89 0.21 0.00 0.00 175.17 175.22 2put s THR 445 N -0.94 4.91 -0.19 -1.27 2.01 -0.68 -2.20 115.64 117.27 2put s THR 445 Ca 0.18 -0.17 -0.06 0.00 0.31 0.00 0.00 61.69 61.96 2put s THR 445 Cb -0.14 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2put s THR 445 CO 0.08 0.15 0.01 0.00 -0.69 0.00 0.00 174.62 174.16 2put s VAL 447 N 0.82 3.08 -0.25 0.00 1.01 0.79 -0.52 120.40 125.33 2put s VAL 447 Ca 0.01 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 2put s VAL 447 Cb -0.14 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 2put s VAL 447 CO 0.02 0.31 0.06 -0.36 0.00 0.00 0.00 175.10 175.14 2put s PHE 448 N 1.40 3.08 -0.21 5.22 0.40 0.95 -0.30 117.98 128.51 2put s PHE 448 Ca 0.03 -0.45 -0.07 0.00 -0.60 0.00 0.00 56.93 55.84 2put s PHE 448 Cb -0.15 -2.23 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 2put s PHE 448 CO -0.04 -0.36 0.07 0.08 0.70 0.00 0.00 175.22 175.66 2put s VAL 449 N 1.58 4.61 -0.25 -0.44 1.01 -1.13 -0.41 120.40 125.38 2put s VAL 449 Ca 0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 2put s VAL 449 Cb -0.15 -3.11 0.09 0.00 0.00 0.00 0.00 36.38 33.21 2put s VAL 449 CO 0.03 0.40 0.58 -0.55 0.00 0.00 0.00 175.10 175.56 2put s SER 450 N 0.93 -0.80 0.04 3.32 0.15 -0.63 -4.55 113.70 112.16 2put s SER 450 Ca 0.04 1.32 -0.31 0.00 0.70 0.00 0.00 55.95 57.70 2put s SER 450 Cb -0.14 1.49 -0.18 0.00 -1.71 0.00 0.00 66.02 65.48 2put s SER 450 CO 0.03 -0.22 1.36 -0.61 1.20 0.00 0.00 173.24 174.99 2put h GLN 451 N 7.46 -0.98 -0.12 5.44 -0.00 -1.95 -3.02 115.11 121.94 2put h GLN 451 Ca -0.26 0.07 -0.08 0.00 -0.00 0.00 0.00 58.65 58.38 2put h GLN 451 Cb 1.17 0.22 -0.01 0.00 0.00 0.00 0.00 27.48 28.86 2put h GLN 451 CO 0.17 -0.64 -0.27 0.66 0.00 0.00 0.00 178.83 178.75 2put h SER 452 N -1.17 0.21 -0.32 -0.69 4.64 -1.96 -2.00 113.55 112.25 2put h SER 452 Ca -0.10 -0.06 -0.14 0.00 -0.47 0.00 0.00 61.79 61.02 2put h SER 452 Cb 0.80 -0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 62.78 2put h SER 452 CO 0.17 0.49 -0.12 0.61 -0.87 0.00 0.00 176.83 177.10 2put n GLY 453 N -0.55 0.74 0.00 -0.77 0.00 -1.25 -4.50 105.19 98.86 2put n GLY 453 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.99 0.62 -1.69 1.61 -0.58 -1.26 -1.51 120.64 116.84 2put n GLU 454 Ca -0.07 -0.29 -0.44 0.00 -0.42 0.00 0.00 57.16 55.94 2put n GLU 454 Cb 0.44 -0.76 -0.04 0.00 -0.57 0.00 0.00 31.44 30.52 2put n GLU 454 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2put n THR 455 N -0.17 0.29 -0.12 2.62 -1.04 -1.26 -4.86 114.28 109.73 2put n THR 455 Ca 0.00 -0.05 -0.08 0.00 -2.04 0.00 0.00 64.05 61.88 2put n THR 455 Cb 0.05 -1.94 -0.00 0.00 -1.82 0.00 0.00 70.33 66.62 2put n THR 455 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2put h ALA 456 N 7.90 0.48 -0.17 2.41 0.00 -1.99 -0.54 119.26 127.34 2put h ALA 456 Ca -0.46 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 2put h ALA 456 Cb 1.24 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2put h ALA 456 CO 0.93 -0.06 -0.22 -0.44 0.00 0.00 0.00 179.25 179.46 2put h ASP 457 N 0.51 0.30 -0.43 0.00 3.32 -1.97 -0.89 116.42 117.26 2put h ASP 457 Ca 0.14 -0.09 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 2put h ASP 457 Cb -0.06 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2put h ASP 457 CO -0.03 0.54 -0.28 0.28 -1.72 0.00 0.00 179.24 178.02 2put h SER 458 N 0.28 1.01 -0.32 6.45 0.02 -1.73 -1.82 113.55 117.44 2put h SER 458 Ca 0.05 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.57 2put h SER 458 Cb 0.55 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2put h SER 458 CO 0.04 1.21 0.15 0.40 -1.14 0.00 0.00 176.83 177.49 2put h ILE 459 N 0.82 1.16 -0.69 3.27 2.04 -0.71 -0.64 117.51 122.76 2put h ILE 459 Ca 0.09 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 2put h ILE 459 Cb 0.87 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 2put h ILE 459 CO 0.08 0.17 0.26 -0.07 0.00 0.00 0.00 178.15 178.59 2put h LEU 460 N 0.38 0.94 -0.47 1.44 3.38 -1.13 -0.95 115.31 118.91 2put h LEU 460 Ca 0.11 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2put h LEU 460 Cb 0.13 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2put h LEU 460 CO -0.01 0.85 -0.01 0.00 0.09 0.00 0.00 178.44 179.35 2put h ALA 461 N 1.29 0.63 -0.05 1.53 0.00 -1.21 -1.24 119.26 120.21 2put h ALA 461 Ca 0.23 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2put h ALA 461 Cb 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2put h ALA 461 CO -0.02 0.45 -0.08 1.25 0.00 0.00 0.00 179.25 180.85 2put h LEU 462 N 0.69 -0.23 -1.14 0.00 5.85 -0.69 -1.43 115.31 118.36 2put h LEU 462 Ca 0.13 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 2put h LEU 462 Cb 0.53 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2put h LEU 462 CO 0.03 -0.11 0.25 1.56 -0.34 0.00 0.00 178.44 179.83 2put h GLN 463 N -0.11 0.86 -0.28 1.25 4.20 -1.07 -0.15 115.11 119.81 2put h GLN 463 Ca 0.05 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2put h GLN 463 Cb 0.18 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2put h GLN 463 CO -0.12 0.69 0.17 -0.92 -0.67 0.00 0.00 178.83 177.99 2put h TYR 464 N 0.85 0.36 -0.54 2.96 5.03 -0.93 -1.22 116.97 123.47 2put h TYR 464 Ca 0.20 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.41 2put h TYR 464 Cb 0.15 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 2put h TYR 464 CO 0.01 0.25 -0.08 0.00 -1.32 0.00 0.00 178.16 177.01 2put h LEU 466 N 0.89 0.87 -2.09 0.00 3.38 -0.90 -1.97 115.31 115.49 2put h LEU 466 Ca 0.15 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2put h LEU 466 Cb 0.63 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 2put h LEU 466 CO 0.04 0.98 -0.08 -0.33 0.09 0.00 0.00 178.44 179.14 2put h GLU 467 N 0.74 0.00 -0.18 1.13 5.08 -1.14 -1.91 114.58 118.30 2put h GLU 467 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2put h GLU 467 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2put h GLU 467 CO 0.03 0.08 0.00 0.54 -1.00 0.00 0.00 179.01 178.66 2put n ARG 468 N -3.71 2.11 -0.61 2.33 1.74 -0.78 -4.96 116.66 112.79 2put n ARG 468 Ca -0.02 -1.66 0.00 0.00 -0.77 0.00 0.00 57.85 55.40 2put n ARG 468 Cb 0.19 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 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 1.31 0.71 3.78 -0.13 0.00 -0.72 -3.90 105.19 106.25 2put n GLY 469 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.14 2.49 0.01 4.61 0.00 -0.96 -4.16 121.76 121.61 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 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 2put s ALA 470 CO 0.00 -1.28 0.81 -1.17 0.00 0.00 0.00 175.76 174.12 2put s LEU 471 N -5.05 4.40 0.02 0.00 2.96 -0.93 -4.68 118.68 115.40 2put s LEU 471 Ca 0.65 1.46 0.09 0.00 -0.22 0.00 0.00 54.13 56.10 2put s LEU 471 Cb -0.19 -3.30 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 2put s LEU 471 CO 0.44 -0.09 -0.25 0.42 -1.32 0.00 0.00 176.35 175.56 2put s THR 472 N 0.40 2.19 -0.05 3.68 -4.23 -1.26 -0.55 115.64 115.83 2put s THR 472 Ca 0.42 -1.26 0.01 0.00 -1.18 0.00 0.00 61.69 59.68 2put s THR 472 Cb -0.20 -1.83 0.02 0.00 1.34 0.00 0.00 72.50 71.83 2put s THR 472 CO 0.23 0.44 -0.05 -0.69 -0.54 0.00 0.00 174.62 174.01 2put s VAL 473 N -0.75 0.59 -0.13 2.29 1.01 0.32 -2.33 120.40 121.39 2put s VAL 473 Ca 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.88 2put s VAL 473 Cb -0.10 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2put s VAL 473 CO 0.01 0.23 0.07 -0.83 0.00 0.00 0.00 175.10 174.59 2put s GLY 474 N 0.88 1.98 -0.49 4.51 0.00 -0.16 -0.04 107.32 114.00 2put s GLY 474 Ca -0.12 -0.73 0.01 0.00 0.00 0.00 0.00 44.72 43.89 2put s GLY 474 CO 0.01 -0.27 0.25 -0.42 0.00 0.00 0.00 173.10 172.67 2put s ILE 475 N -0.46 2.94 0.04 0.90 -1.09 0.46 -0.77 121.20 123.22 2put s ILE 475 Ca 0.10 -2.80 0.04 0.00 -2.23 0.00 0.00 60.65 55.76 2put s ILE 475 Cb -0.12 -3.02 -0.02 0.00 -1.58 0.00 0.00 42.46 37.72 2put s ILE 475 CO 0.02 -0.76 -0.13 -0.69 -1.23 0.00 0.00 174.94 172.15 2put s VAL 476 N 0.27 1.00 -0.20 2.92 1.01 -0.81 -1.60 120.40 122.98 2put s VAL 476 Ca 0.14 -0.98 -0.19 0.00 0.00 0.00 0.00 61.98 60.95 2put s VAL 476 Cb -0.22 -0.93 -0.20 0.00 0.00 0.00 0.00 36.38 35.03 2put s VAL 476 CO -0.03 -0.05 0.19 -3.20 0.00 0.00 0.00 175.10 172.01 2put n ASN 477 N 1.87 1.91 -4.58 3.32 5.15 -1.06 -1.00 115.26 120.86 2put n ASN 477 Ca -0.18 0.38 -0.42 0.00 -0.60 0.00 0.00 54.58 53.76 2put n ASN 477 Cb 0.55 -0.94 -0.03 0.00 -0.53 0.00 0.00 39.78 38.84 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 -6.93 6.08 0.19 1.20 0.01 -0.78 -4.63 113.70 108.85 2put s SER 478 Ca -0.29 0.48 -0.32 0.00 1.31 0.00 0.00 55.95 57.13 2put s SER 478 Cb 0.07 -2.54 -0.11 0.00 0.21 0.00 0.00 66.02 63.64 2put s SER 478 CO 0.61 -1.71 1.72 -0.69 0.41 0.00 0.00 173.24 173.58 2put s VAL 479 N 6.24 2.18 -0.34 3.43 1.01 -1.26 -2.00 120.40 129.66 2put s VAL 479 Ca 0.57 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2put s VAL 479 Cb -0.12 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.21 2put s VAL 479 CO 0.27 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.98 2put n GLY 480 N 3.99 0.58 3.67 4.51 0.00 -1.26 -5.03 105.19 111.66 2put n GLY 480 Ca 0.16 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.36 2.49 0.19 1.61 1.04 -0.84 -4.61 113.70 111.21 2put s SER 481 Ca 0.00 1.14 -0.17 0.00 0.48 0.00 0.00 55.95 57.40 2put s SER 481 Cb 0.00 -1.80 0.17 0.00 0.10 0.00 0.00 66.02 64.49 2put s SER 481 CO 0.00 -3.21 1.62 0.28 0.98 0.00 0.00 173.24 172.91 2put h SER 482 N -1.95 -0.75 -0.29 7.02 0.02 -1.86 0.13 113.55 115.87 2put h SER 482 Ca -0.55 0.19 -0.07 0.00 -0.84 0.00 0.00 61.79 60.52 2put h SER 482 Cb 1.33 0.43 -0.02 0.00 0.14 0.00 0.00 62.40 64.28 2put h SER 482 CO 0.58 -0.24 -0.05 0.24 -1.14 0.00 0.00 176.83 176.21 2put h MET 483 N -0.08 0.66 0.10 3.45 2.07 -1.63 0.77 114.93 120.27 2put h MET 483 Ca 0.25 -0.18 -0.00 0.00 -2.07 0.00 0.00 59.70 57.70 2put h MET 483 Cb 0.48 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 30.13 2put h MET 483 CO -0.60 0.72 -0.05 1.03 1.07 0.00 0.00 176.91 179.08 2put h SER 484 N 0.62 -0.11 -0.06 1.22 0.87 -1.62 -2.74 113.55 111.72 2put h SER 484 Ca 0.12 -0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.48 2put h SER 484 Cb 0.47 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2put h SER 484 CO 0.02 0.15 0.02 0.03 -0.53 0.00 0.00 176.83 176.52 2put h ARG 485 N -0.38 0.04 0.00 2.24 3.08 -0.50 -3.33 114.38 115.53 2put h ARG 485 Ca -0.01 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2put h ARG 485 Cb 0.32 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2put h ARG 485 CO 0.02 0.03 -0.17 1.96 -1.07 0.00 0.00 179.97 180.74 2put h GLN 486 N 0.04 0.00 -7.09 0.04 4.20 -0.91 -3.44 115.11 107.96 2put h GLN 486 Ca 0.03 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.24 2put h GLN 486 Cb 0.02 0.00 0.06 0.00 0.30 0.00 0.00 27.48 27.86 2put h GLN 486 CO -0.03 0.03 0.42 0.95 -0.67 0.00 0.00 178.83 179.52 2put s THR 487 N -3.22 3.34 0.15 -0.54 -4.23 -1.03 -4.97 115.64 105.13 2put s THR 487 Ca 0.06 0.82 -0.13 0.00 -1.18 0.00 0.00 61.69 61.25 2put s THR 487 Cb 0.06 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.61 2put s THR 487 CO 0.69 -0.20 1.66 0.45 -0.54 0.00 0.00 174.62 176.69 2put h HIS 488 N 1.20 0.84 -3.85 3.99 3.86 -1.75 -3.47 115.15 115.98 2put h HIS 488 Ca -0.50 -0.10 -0.15 0.00 -1.16 0.00 0.00 60.37 58.47 2put h HIS 488 Cb 1.25 -0.24 -0.08 0.00 1.06 0.00 0.00 27.41 29.40 2put h HIS 488 CO 0.53 0.74 -0.15 0.00 0.86 0.00 0.00 177.93 179.91 2put n GLY 490 N -0.46 -1.32 3.02 0.00 0.00 -1.25 -0.99 105.19 104.19 2put n GLY 490 Ca -0.01 -0.94 -0.28 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.66 1.42 -0.07 1.61 1.01 0.05 -4.13 120.40 117.63 2put s VAL 491 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 2put s VAL 491 Cb 0.00 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 2put s VAL 491 CO 0.00 0.43 1.10 -1.00 0.00 0.00 0.00 175.10 175.63 2put s HIS 492 N 1.24 3.38 -0.42 5.22 0.09 -1.26 -1.93 115.29 121.62 2put s HIS 492 Ca -0.02 1.42 0.26 0.00 -0.00 0.00 0.00 55.06 56.73 2put s HIS 492 Cb -0.14 -3.30 0.78 0.00 -0.00 0.00 0.00 32.58 29.93 2put s HIS 492 CO -0.05 -0.73 1.75 -0.84 -0.00 0.00 0.00 174.74 174.87 2put h ILE 493 N 5.01 0.00 -5.23 0.60 3.07 -1.34 -3.48 117.51 116.14 2put h ILE 493 Ca -0.34 -0.63 -0.35 0.00 1.55 0.00 0.00 64.86 65.09 2put h ILE 493 Cb 1.16 1.59 0.12 0.00 -0.27 0.00 0.00 36.82 39.43 2put h ILE 493 CO 0.86 0.00 -0.59 0.59 -1.05 0.00 0.00 178.15 177.95 2put n ASN 494 N -2.73 -5.81 0.08 2.16 3.02 -1.26 -4.06 115.26 106.65 2put n ASN 494 Ca 0.03 -0.47 0.12 0.00 -0.03 0.00 0.00 54.58 54.24 2put n ASN 494 Cb 0.41 -4.46 0.26 0.00 -0.61 0.00 0.00 39.78 35.38 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 -4.69 2.69 0.00 5.41 0.00 -1.26 -3.94 120.51 118.71 2put n ALA 495 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2put n ALA 495 Cb 0.55 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 1.33 -1.21 3.77 0.00 0.00 -1.26 -4.79 105.19 103.03 2put n GLY 496 Ca 0.04 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.34 3.70 -0.30 1.61 0.02 -1.26 -4.98 135.00 131.45 2put s PRO 497 Ca 0.00 2.40 -0.04 0.00 0.02 0.00 0.00 61.00 63.39 2put s PRO 497 Cb 0.00 -2.66 0.04 0.00 0.02 0.00 0.00 34.50 31.90 2put s PRO 497 CO 0.00 -0.80 0.03 -2.00 -0.33 0.00 0.00 177.00 173.90 2put s GLU 498 N -2.44 2.63 -0.02 5.54 2.12 -1.26 -4.96 118.70 120.32 2put s GLU 498 Ca 0.61 -1.14 0.17 0.00 0.36 0.00 0.00 54.97 54.96 2put s GLU 498 Cb -0.43 -3.24 -0.24 0.00 0.26 0.00 0.00 34.13 30.47 2put s GLU 498 CO 0.56 -0.57 0.45 -0.89 -0.54 0.00 0.00 175.26 174.26 2put n ILE 499 N 4.71 0.00 -1.02 -3.70 5.41 -1.26 -4.93 119.36 118.56 2put n ILE 499 Ca -0.14 -0.32 -0.33 0.00 1.00 0.00 0.00 62.75 62.97 2put n ILE 499 Cb 0.45 0.34 0.14 0.00 -0.71 0.00 0.00 39.64 39.85 2put n ILE 499 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2put s GLY 500 N -3.58 2.05 0.00 7.39 0.00 -1.26 -4.94 107.32 106.98 2put s GLY 500 Ca -0.03 0.78 0.28 0.00 0.00 0.00 0.00 44.72 45.75 2put s GLY 500 CO 0.69 1.20 1.73 3.33 0.00 0.00 0.00 173.10 180.06 2put n VAL 501 N -3.51 0.00 -4.33 1.40 0.24 -1.26 -4.85 118.33 106.01 2put n VAL 501 Ca 0.13 -0.06 -0.23 0.00 -2.04 0.00 0.00 64.34 62.15 2put n VAL 501 Cb 0.51 0.02 -0.11 0.00 -1.47 0.00 0.00 33.84 32.78 2put n VAL 501 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2put s ALA 502 N -2.63 2.02 -0.21 2.33 0.00 -1.26 -5.10 121.76 116.90 2put s ALA 502 Ca 0.23 -1.46 -0.27 0.00 0.00 0.00 0.00 51.96 50.47 2put s ALA 502 Cb 0.19 -0.21 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 2put s ALA 502 CO 0.53 0.28 0.92 0.45 0.00 0.00 0.00 175.76 177.93 2put s SER 503 N -2.52 6.99 0.00 0.00 0.15 -1.26 -4.88 113.70 112.18 2put s SER 503 Ca 0.14 1.23 0.00 0.00 0.70 0.00 0.00 55.95 58.02 2put s SER 503 Cb -0.07 -2.49 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2put s SER 503 CO 0.06 -0.53 0.00 0.35 1.20 0.00 0.00 173.24 174.32 2put n THR 504 N 5.09 0.00 0.26 6.45 -2.24 -1.26 -4.66 114.28 117.93 2put n THR 504 Ca 0.08 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.96 2put n THR 504 Cb 0.47 -0.64 0.70 0.00 -2.10 0.00 0.00 70.33 68.77 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 -0.84 -0.78 2.10 -1.90 -2.15 116.57 113.00 2put h LYS 505 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2put h LYS 505 Cb 0.00 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.29 2put h LYS 505 CO 0.00 0.08 0.49 0.00 -2.00 0.00 0.00 179.45 178.02 2put h ALA 506 N 1.92 1.28 -0.02 0.07 0.00 -1.93 -0.48 119.26 120.10 2put h ALA 506 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2put h ALA 506 Cb 0.17 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2put h ALA 506 CO 0.01 0.60 0.01 -0.92 0.00 0.00 0.00 179.25 178.95 2put h TYR 507 N 1.16 0.04 -0.15 0.00 3.20 -1.66 0.20 116.97 119.77 2put h TYR 507 Ca 0.30 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 62.01 2put h TYR 507 Cb -0.02 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 2put h TYR 507 CO 0.01 0.21 -0.56 1.79 -1.64 0.00 0.00 178.16 177.97 2put h THR 508 N -0.15 1.34 -0.43 1.81 1.35 -1.45 -0.76 112.91 114.62 2put h THR 508 Ca 0.01 -1.83 -0.11 0.00 -0.55 0.00 0.00 66.41 63.92 2put h THR 508 Cb 0.19 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.43 2put h THR 508 CO -0.00 0.56 -0.17 0.28 -0.25 0.00 0.00 175.52 175.94 2put h SER 509 N 0.34 0.89 -0.37 5.36 0.02 -0.99 -1.64 113.55 117.17 2put h SER 509 Ca 0.00 -0.39 0.01 0.00 -0.84 0.00 0.00 61.79 60.57 2put h SER 509 Cb 1.08 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 2put h SER 509 CO 0.10 1.08 0.23 1.56 -1.14 0.00 0.00 176.83 178.66 2put h GLN 510 N 0.69 0.46 -0.37 3.45 4.20 -0.44 -1.25 115.11 121.85 2put h GLN 510 Ca 0.10 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.80 2put h GLN 510 Cb 0.73 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2put h GLN 510 CO 0.06 0.31 0.21 -0.92 -0.67 0.00 0.00 178.83 177.81 2put h TYR 511 N 0.47 0.40 -0.69 2.96 5.03 -1.00 0.23 116.97 124.37 2put h TYR 511 Ca 0.14 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.48 2put h TYR 511 Cb -0.04 -0.13 -0.04 0.00 1.55 0.00 0.00 36.73 38.07 2put h TYR 511 CO -0.06 0.24 0.44 0.82 -1.32 0.00 0.00 178.16 178.28 2put h ILE 512 N 0.44 1.12 -0.56 1.81 2.04 -1.13 -0.74 117.51 120.50 2put h ILE 512 Ca 0.14 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 2put h ILE 512 Cb 0.00 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 2put h ILE 512 CO -0.07 0.16 0.05 0.00 0.00 0.00 0.00 178.15 178.29 2put h ALA 513 N 1.28 1.04 -0.42 1.87 0.00 -0.82 0.17 119.26 122.39 2put h ALA 513 Ca 0.27 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 2put h ALA 513 Cb -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2put h ALA 513 CO -0.09 0.61 -0.32 -0.07 0.00 0.00 0.00 179.25 179.38 2put h LEU 514 N 0.86 1.00 -0.51 0.00 3.38 -0.67 0.12 115.31 119.50 2put h LEU 514 Ca 0.17 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 2put h LEU 514 Cb 0.44 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2put h LEU 514 CO 0.02 1.23 0.17 0.58 0.09 0.00 0.00 178.44 180.53 2put h VAL 515 N 0.78 1.23 -0.76 1.22 2.07 -0.71 -1.23 116.25 118.86 2put h VAL 515 Ca 0.08 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.87 2put h VAL 515 Cb 0.91 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2put h VAL 515 CO 0.08 0.27 0.50 0.24 0.02 0.00 0.00 177.57 178.69 2put h MET 516 N 0.68 0.99 -0.11 1.57 2.86 -0.65 -0.46 114.93 119.80 2put h MET 516 Ca 0.16 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2put h MET 516 Cb 0.25 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2put h MET 516 CO -0.01 0.65 0.06 0.35 1.06 0.00 0.00 176.91 179.02 2put h PHE 517 N 1.02 0.15 -0.55 -0.22 3.57 -0.68 0.67 116.94 120.90 2put h PHE 517 Ca 0.28 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.80 2put h PHE 517 Cb -0.10 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2put h PHE 517 CO -0.00 0.19 0.34 0.00 -2.23 0.00 0.00 178.31 176.60 2put h ALA 518 N 0.95 0.71 -0.65 2.41 0.00 -0.83 0.36 119.26 122.21 2put h ALA 518 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2put h ALA 518 Cb 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2put h ALA 518 CO -0.01 0.06 0.42 -0.07 0.00 0.00 0.00 179.25 179.66 2put h LEU 519 N 0.67 0.72 -0.30 0.00 3.38 -0.95 -2.29 115.31 116.54 2put h LEU 519 Ca 0.22 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 2put h LEU 519 Cb 0.00 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2put h LEU 519 CO -0.09 0.51 0.19 0.28 0.09 0.00 0.00 178.44 179.42 2put h SER 520 N 0.85 0.36 -0.07 -0.43 0.02 -0.00 -2.08 113.55 112.21 2put h SER 520 Ca 0.25 -0.04 0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2put h SER 520 Cb -0.06 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.39 2put h SER 520 CO -0.07 0.29 0.05 -0.07 -1.14 0.00 0.00 176.83 175.89 2put h LEU 521 N 0.40 0.00 -3.30 5.07 3.38 -0.78 -2.92 115.31 117.16 2put h LEU 521 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2put h LEU 521 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2put h LEU 521 CO -0.02 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.97 2put n SER 522 N -4.48 4.14 0.00 -0.43 3.41 -0.88 -4.65 113.62 110.73 2put n SER 522 Ca -0.01 -2.99 0.11 0.00 -0.26 0.00 0.00 58.87 55.72 2put n SER 522 Cb 0.15 -0.56 0.63 0.00 -0.26 0.00 0.00 64.21 64.18 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 -0.33 0.00 -0.94 4.04 0.23 -0.83 -2.84 115.26 114.60 2put n ASN 523 Ca 0.22 -0.47 0.10 0.00 -0.53 0.00 0.00 54.58 53.91 2put n ASN 523 Cb 0.93 -0.10 0.15 0.00 -2.08 0.00 0.00 39.78 38.68 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 -1.10 3.05 -4.65 0.53 2.03 -1.26 -4.93 116.55 110.22 2put n ASP 524 Ca 0.15 -1.90 -0.39 0.00 0.52 0.00 0.00 54.79 53.16 2put n ASP 524 Cb 0.11 -0.15 -0.07 0.00 -0.72 0.00 0.00 41.12 40.29 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 -1.45 6.50 0.11 1.67 0.15 -1.13 -4.94 113.70 114.60 2put s SER 525 Ca 0.30 0.59 -0.16 0.00 0.70 0.00 0.00 55.95 57.39 2put s SER 525 Cb 0.19 -2.28 -0.04 0.00 -1.71 0.00 0.00 66.02 62.18 2put s SER 525 CO 0.27 -0.21 1.57 0.40 1.20 0.00 0.00 173.24 176.47 2put h ILE 526 N 5.22 1.25 0.00 6.45 2.04 -1.91 -3.05 117.51 127.50 2put h ILE 526 Ca -0.32 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2put h ILE 526 Cb 1.15 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2put h ILE 526 CO 0.73 0.31 0.00 0.77 0.00 0.00 0.00 178.15 179.96 2put h SER 527 N 0.44 0.00 -0.36 1.72 4.64 -1.99 -2.42 113.55 115.59 2put h SER 527 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2put h SER 527 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2put h SER 527 CO 0.01 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.51 2put n ARG 528 N -3.06 2.50 -0.23 4.77 1.74 -1.23 -4.52 116.66 116.63 2put n ARG 528 Ca -0.01 -2.03 -0.02 0.00 -0.77 0.00 0.00 57.85 55.03 2put n ARG 528 Cb 0.22 -1.32 0.09 0.00 -1.02 0.00 0.00 32.46 30.43 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 2.53 0.72 -0.47 5.56 3.64 -1.32 -0.02 116.57 127.21 2put h LYS 529 Ca 0.00 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2put h LYS 529 Cb 0.75 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2put h LYS 529 CO 0.00 0.48 0.16 0.78 -2.27 0.00 0.00 179.45 178.60 2put h GLY 530 N 0.74 0.78 0.95 5.01 0.00 -1.79 -0.58 103.07 108.17 2put h GLY 530 Ca 0.29 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 2put h GLY 530 CO -0.15 0.42 0.17 -0.09 0.00 0.00 0.00 176.54 176.89 2put h ARG 531 N 0.63 0.57 -0.39 4.80 9.65 -1.81 -1.13 114.38 126.70 2put h ARG 531 Ca 0.15 -0.09 0.08 0.00 -1.10 0.00 0.00 59.98 59.02 2put h ARG 531 Cb 0.24 -0.10 -0.07 0.00 -1.39 0.00 0.00 29.97 28.66 2put h ARG 531 CO -0.01 0.53 -0.06 0.45 2.80 0.00 0.00 179.97 183.68 2put h HIS 532 N 0.49 -0.13 -0.81 2.20 3.86 -0.80 -1.54 115.15 118.42 2put h HIS 532 Ca 0.13 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2put h HIS 532 Cb 0.16 0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 2put h HIS 532 CO -0.01 -0.13 0.52 0.93 0.86 0.00 0.00 177.93 180.10 2put h GLU 533 N 0.04 1.08 -0.17 2.45 5.08 -0.70 -0.51 114.58 121.84 2put h GLU 533 Ca 0.19 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2put h GLU 533 Cb 0.29 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2put h GLU 533 CO -0.37 0.73 0.11 1.49 -1.00 0.00 0.00 179.01 179.97 2put h GLU 534 N 1.11 0.23 -0.43 2.33 4.81 -0.95 0.85 114.58 122.53 2put h GLU 534 Ca 0.30 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2put h GLU 534 Cb -0.10 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2put h GLU 534 CO -0.06 0.16 -0.05 0.82 -0.73 0.00 0.00 179.01 179.15 2put h ILE 535 N 0.23 1.27 -0.66 2.32 2.04 -1.12 0.23 117.51 121.81 2put h ILE 535 Ca 0.06 -1.13 -0.06 0.00 1.00 0.00 0.00 64.86 64.74 2put h ILE 535 Cb -0.02 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 2put h ILE 535 CO -0.01 0.38 0.19 0.40 0.00 0.00 0.00 178.15 179.11 2put h ILE 536 N 0.62 1.25 -0.46 -0.67 2.04 -0.82 0.40 117.51 119.87 2put h ILE 536 Ca 0.11 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.99 2put h ILE 536 Cb 0.57 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2put h ILE 536 CO 0.03 0.34 -0.06 0.11 0.00 0.00 0.00 178.15 178.58 2put h LYS 537 N 0.97 0.79 -0.26 2.37 1.79 -0.73 -2.14 116.57 119.36 2put h LYS 537 Ca 0.21 -0.24 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 2put h LYS 537 Cb 0.32 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2put h LYS 537 CO -0.00 0.84 0.10 0.78 -1.08 0.00 0.00 179.45 180.08 2put h GLY 538 N 0.97 0.43 0.87 3.86 0.00 -0.35 -2.80 103.07 106.05 2put h GLY 538 Ca 0.13 -0.24 0.11 0.00 0.00 0.00 0.00 47.33 47.33 2put h GLY 538 CO 0.03 0.23 0.47 1.41 0.00 0.00 0.00 176.54 178.67 2put h LEU 539 N 0.27 0.47 -1.60 3.11 3.38 0.09 -1.29 115.31 119.74 2put h LEU 539 Ca 0.09 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2put h LEU 539 Cb 0.20 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2put h LEU 539 CO -0.01 0.27 -0.21 -0.61 0.09 0.00 0.00 178.44 177.98 2put h GLN 540 N 0.51 0.00 0.00 1.13 4.15 -1.12 -2.28 115.11 117.50 2put h GLN 540 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.75 2put h GLN 540 Cb 0.60 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.29 2put h GLN 540 CO -0.11 0.21 -0.53 1.63 -1.93 0.00 0.00 178.83 178.10 2put n LYS 541 N -4.27 0.01 -0.18 1.69 5.02 -0.51 -4.44 118.16 115.49 2put n LYS 541 Ca -0.02 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.20 2put n LYS 541 Cb 0.27 -1.51 0.02 0.00 -0.02 0.00 0.00 35.03 33.79 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 1.14 -0.72 -0.18 1.08 -1.14 -1.19 117.51 116.50 2put h ILE 542 Ca 0.00 -0.27 0.03 0.00 -0.39 0.00 0.00 64.86 64.23 2put h ILE 542 Cb 0.51 0.38 -0.04 0.00 -3.07 0.00 0.00 36.82 34.60 2put h ILE 542 CO 0.00 0.14 0.45 -0.65 -0.69 0.00 0.00 178.15 177.40 2put h PRO 543 N 0.71 0.87 -0.09 2.37 0.11 -1.78 0.26 132.00 134.44 2put h PRO 543 Ca 0.19 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.13 2put h PRO 543 Cb -0.07 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.83 2put h PRO 543 CO -0.04 0.57 -0.47 1.05 -0.21 0.00 0.00 178.00 178.91 2put h GLU 544 N 0.89 0.22 -0.41 1.05 4.11 -1.82 -2.20 114.58 116.42 2put h GLU 544 Ca 0.29 -0.12 -0.11 0.00 0.07 0.00 0.00 59.36 59.49 2put h GLU 544 Cb 0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2put h GLU 544 CO -0.10 0.65 -0.18 1.96 0.07 0.00 0.00 179.01 181.40 2put h GLN 545 N 0.18 0.79 -0.60 1.06 4.20 -0.70 -1.78 115.11 118.26 2put h GLN 545 Ca 0.01 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.42 2put h GLN 545 Cb 0.90 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.60 2put h GLN 545 CO 0.07 0.91 0.35 0.82 -0.67 0.00 0.00 178.83 180.32 2put h ILE 546 N 0.70 1.18 -0.69 2.54 2.04 -0.24 -0.13 117.51 122.91 2put h ILE 546 Ca 0.11 -0.42 0.13 0.00 1.00 0.00 0.00 64.86 65.67 2put h ILE 546 Cb 0.68 0.37 -0.09 0.00 -0.74 0.00 0.00 36.82 37.05 2put h ILE 546 CO 0.05 0.19 0.24 0.11 0.00 0.00 0.00 178.15 178.74 2put h LYS 547 N 0.81 0.38 -0.49 2.37 1.57 -1.20 -0.71 116.57 119.30 2put h LYS 547 Ca 0.21 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2put h LYS 547 Cb -0.01 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2put h LYS 547 CO -0.04 0.25 0.30 1.96 -0.57 0.00 0.00 179.45 181.35 2put h GLN 548 N 0.39 0.66 -0.44 3.15 4.20 -0.66 -2.92 115.11 119.49 2put h GLN 548 Ca 0.37 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.95 2put h GLN 548 Cb 0.54 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 2put h GLN 548 CO -0.39 0.48 -0.01 0.28 -0.67 0.00 0.00 178.83 178.53 2put h VAL 549 N 0.65 1.23 -0.02 -0.54 2.07 -0.30 -2.30 116.25 117.04 2put h VAL 549 Ca 0.18 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.74 2put h VAL 549 Cb -0.01 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2put h VAL 549 CO -0.03 0.34 0.06 -0.07 0.02 0.00 0.00 177.57 177.88 2put h LEU 550 N 0.67 0.00 -0.45 2.57 3.38 -0.96 0.45 115.31 120.98 2put h LEU 550 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2put h LEU 550 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2put h LEU 550 CO 0.02 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.84 2put n LYS 551 N -3.36 0.07 0.00 1.13 5.02 -0.87 -2.02 118.16 118.13 2put n LYS 551 Ca -0.02 0.44 0.08 0.00 -2.02 0.00 0.00 58.31 56.79 2put n LYS 551 Cb 0.14 -1.67 0.39 0.00 -0.02 0.00 0.00 35.03 33.86 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 -1.81 0.00 -0.33 -0.35 4.77 0.15 -4.27 117.00 115.16 2put n LEU 552 Ca 0.01 0.38 0.01 0.00 -0.03 0.00 0.00 56.01 56.38 2put n LEU 552 Cb 0.10 -0.38 0.15 0.00 -2.33 0.00 0.00 43.42 40.96 2put n LEU 552 CO 0.10 -0.17 1.22 -0.08 -1.33 0.00 0.00 177.39 177.13 2put h GLU 553 N 0.00 1.02 -0.46 3.23 4.81 -1.62 -0.54 114.58 121.02 2put h GLU 553 Ca 0.00 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 2put h GLU 553 Cb 0.21 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 2put h GLU 553 CO 0.00 0.67 0.10 -0.91 -0.73 0.00 0.00 179.01 178.14 2put h ASN 554 N 1.05 0.71 -0.81 1.04 2.35 -1.86 0.48 115.58 118.54 2put h ASN 554 Ca 0.39 -0.24 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2put h ASN 554 Cb 0.14 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 2put h ASN 554 CO -0.16 0.77 0.54 0.50 -1.65 0.00 0.00 177.43 177.42 2put h LYS 555 N 0.61 1.06 -0.42 0.81 3.64 -1.70 -1.37 116.57 119.21 2put h LYS 555 Ca 0.14 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.31 2put h LYS 555 Cb 0.34 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2put h LYS 555 CO 0.00 0.70 -0.33 0.82 -2.27 0.00 0.00 179.45 178.38 2put h ILE 556 N 1.09 1.27 -0.98 2.00 2.04 -0.40 -2.00 117.51 120.54 2put h ILE 556 Ca 0.30 -1.50 0.02 0.00 1.00 0.00 0.00 64.86 64.68 2put h ILE 556 Cb -0.12 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 2put h ILE 556 CO -0.07 0.51 0.64 0.11 0.00 0.00 0.00 178.15 179.35 2put h LYS 557 N 0.80 1.26 -0.31 2.37 1.57 0.32 -0.35 116.57 122.22 2put h LYS 557 Ca 0.08 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2put h LYS 557 Cb 0.92 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2put h LYS 557 CO 0.09 0.83 0.11 -0.44 -0.57 0.00 0.00 179.45 179.46 2put h ASP 558 N 1.29 0.45 -0.62 0.86 3.32 -1.05 -0.15 116.42 120.52 2put h ASP 558 Ca 0.37 -0.19 0.02 0.00 0.02 0.00 0.00 57.03 57.25 2put h ASP 558 Cb -0.10 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 2put h ASP 558 CO -0.09 0.52 0.39 0.25 -1.72 0.00 0.00 179.24 178.59 2put h LEU 559 N 0.35 0.64 -0.32 1.55 5.85 -1.07 -2.54 115.31 119.77 2put h LEU 559 Ca 0.10 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2put h LEU 559 Cb 0.23 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2put h LEU 559 CO -0.00 0.45 0.00 0.00 -0.34 0.00 0.00 178.44 178.54 2put h ASN 561 N 0.00 0.00 -3.44 0.00 2.35 -0.61 -3.38 115.58 110.51 2put h ASN 561 Ca 0.00 0.00 -0.41 0.00 -0.55 0.00 0.00 56.30 55.34 2put h ASN 561 Cb 0.69 0.00 0.20 0.00 0.05 0.00 0.00 38.32 39.25 2put h ASN 561 CO 0.00 0.27 0.12 -0.94 -1.65 0.00 0.00 177.43 175.22 2put s SER 562 N -6.25 0.61 0.00 5.81 1.04 -1.00 -4.86 113.70 109.05 2put s SER 562 Ca 0.02 0.55 0.07 0.00 0.48 0.00 0.00 55.95 57.08 2put s SER 562 Cb 0.09 -0.72 0.36 0.00 0.10 0.00 0.00 66.02 65.85 2put s SER 562 CO 0.67 -4.30 1.13 -1.54 0.98 0.00 0.00 173.24 170.17 2put n SER 563 N -4.87 0.00 -0.36 7.02 3.41 -1.26 -1.67 113.62 115.89 2put n SER 563 Ca 0.15 0.25 0.26 0.00 -0.26 0.00 0.00 58.87 59.26 2put n SER 563 Cb 0.60 -0.33 0.52 0.00 -0.26 0.00 0.00 64.21 64.74 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 0.43 0.00 1.04 5.85 -1.90 -1.62 115.31 119.11 2put h LEU 564 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2put h LEU 564 Cb 0.08 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.18 2put h LEU 564 CO 0.00 -0.02 0.00 -0.46 -0.34 0.00 0.00 178.44 177.62 2put n ASN 565 N -4.75 0.00 -0.81 1.25 0.23 -0.67 -2.58 115.26 107.93 2put n ASN 565 Ca 0.29 0.17 0.08 0.00 -0.53 0.00 0.00 54.58 54.60 2put n ASN 565 Cb 1.02 -0.35 0.23 0.00 -2.08 0.00 0.00 39.78 38.60 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 -1.35 3.64 -4.83 0.53 8.00 -0.61 -4.88 116.55 117.05 2put n ASP 566 Ca 0.07 -2.81 -0.33 0.00 0.71 0.00 0.00 54.79 52.44 2put n ASP 566 Cb 0.17 -0.47 -0.04 0.00 -0.02 0.00 0.00 41.12 40.75 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 -2.45 3.95 0.12 -1.24 -1.52 -1.06 -4.97 119.66 112.48 2put s GLN 567 Ca 0.38 1.06 0.20 0.00 -1.95 0.00 0.00 55.36 55.05 2put s GLN 567 Cb 0.29 -2.13 -0.08 0.00 -0.22 0.00 0.00 33.01 30.86 2put s GLN 567 CO 0.10 -0.27 0.89 0.36 -0.25 0.00 0.00 175.29 176.12 2put n LYS 568 N -1.32 0.62 -3.69 2.91 2.85 -1.26 -4.90 118.16 113.36 2put n LYS 568 Ca 0.07 0.13 -0.12 0.00 -1.05 0.00 0.00 58.31 57.35 2put n LYS 568 Cb 0.54 -1.79 -0.06 0.00 -0.65 0.00 0.00 35.03 33.06 2put n LYS 568 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2put s SER 569 N -5.46 -0.22 -0.04 -5.58 1.04 -1.26 -2.65 113.70 99.53 2put s SER 569 Ca -0.02 -0.11 -0.01 0.00 0.48 0.00 0.00 55.95 56.29 2put s SER 569 Cb 0.09 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.65 2put s SER 569 CO 0.81 -0.67 0.02 -0.22 0.98 0.00 0.00 173.24 174.16 2put s LEU 570 N -2.12 0.73 -0.03 2.42 0.20 -0.17 -4.05 118.68 115.66 2put s LEU 570 Ca -0.04 0.00 -0.03 0.00 0.69 0.00 0.00 54.13 54.75 2put s LEU 570 Cb -0.00 -0.22 -0.04 0.00 -0.43 0.00 0.00 46.19 45.50 2put s LEU 570 CO -0.04 -0.17 0.16 -0.76 -0.29 0.00 0.00 176.35 175.25 2put s LEU 571 N 1.56 4.28 -0.12 -0.68 1.43 -0.90 -2.73 118.68 121.52 2put s LEU 571 Ca -0.02 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 2put s LEU 571 Cb -0.13 -2.46 0.01 0.00 0.03 0.00 0.00 46.19 43.65 2put s LEU 571 CO -0.03 0.29 -0.17 -0.76 0.23 0.00 0.00 176.35 175.91 2put s LEU 572 N -1.75 1.84 -0.19 1.79 1.02 -0.35 -0.82 118.68 120.22 2put s LEU 572 Ca 0.24 -0.48 -0.05 0.00 0.02 0.00 0.00 54.13 53.86 2put s LEU 572 Cb -0.12 -1.19 -0.03 0.00 0.02 0.00 0.00 46.19 44.87 2put s LEU 572 CO 0.15 0.04 0.01 -0.76 0.02 0.00 0.00 176.35 175.81 2put s LEU 573 N 0.92 3.40 0.17 1.79 1.43 0.97 -0.39 118.68 126.97 2put s LEU 573 Ca -0.07 -0.12 -0.21 0.00 -1.03 0.00 0.00 54.13 52.69 2put s LEU 573 Cb -0.15 -1.86 0.06 0.00 0.03 0.00 0.00 46.19 44.27 2put s LEU 573 CO -0.01 0.10 0.58 -0.83 0.23 0.00 0.00 176.35 176.42 2put s GLY 574 N 0.78 -0.47 0.12 -3.19 0.00 -0.77 -1.13 107.32 102.67 2put s GLY 574 Ca 0.01 0.26 -0.12 0.00 0.00 0.00 0.00 44.72 44.87 2put s GLY 574 CO 0.02 0.03 0.30 -1.60 0.00 0.00 0.00 173.10 171.84 2put s ARG 575 N -3.79 0.99 7.34 2.90 3.52 -1.26 -1.77 118.95 126.88 2put s ARG 575 Ca 0.03 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 54.74 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 -0.10 -0.36 0.00 0.41 -0.81 0.00 0.00 175.30 174.45 2put n GLY 576 N -0.15 3.00 0.24 8.12 0.00 -1.26 -1.79 105.19 113.35 2put n GLY 576 Ca -0.14 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 -0.10 1.61 0.05 -1.95 -1.96 116.97 114.62 2put h TYR 577 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2put h TYR 577 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2put h TYR 577 CO 0.00 0.13 0.00 1.04 -1.05 0.00 0.00 178.16 178.28 2put n GLN 578 N -4.20 1.71 -0.15 4.88 1.13 -0.74 -3.91 117.38 116.10 2put n GLN 578 Ca -0.02 -1.06 -0.12 0.00 -1.94 0.00 0.00 57.00 53.86 2put n GLN 578 Cb 0.21 -1.43 -0.01 0.00 0.11 0.00 0.00 30.24 29.12 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 2.31 1.07 -0.86 1.08 3.57 -1.35 -1.60 116.94 121.17 2put h PHE 579 Ca 0.00 -0.27 0.03 0.00 3.53 0.00 0.00 57.97 61.27 2put h PHE 579 Cb 0.50 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 2put h PHE 579 CO 0.06 1.07 0.57 0.00 -2.23 0.00 0.00 178.31 177.78 2put h ALA 580 N 0.84 1.46 -0.61 2.41 0.00 -1.77 -1.53 119.26 120.06 2put h ALA 580 Ca 0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2put h ALA 580 Cb 0.79 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2put h ALA 580 CO 0.07 0.45 0.19 1.15 0.00 0.00 0.00 179.25 181.11 2put h THR 581 N 1.08 1.23 -0.36 0.00 2.02 -1.68 -0.34 112.91 114.86 2put h THR 581 Ca 0.34 -0.80 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 2put h THR 581 Cb 0.02 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2put h THR 581 CO -0.10 0.31 0.05 0.00 0.37 0.00 0.00 175.52 176.15 2put h ALA 582 N 1.30 0.48 -0.75 6.16 0.00 -0.41 0.23 119.26 126.27 2put h ALA 582 Ca 0.20 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2put h ALA 582 Cb 0.26 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2put h ALA 582 CO -0.01 0.20 0.26 -0.07 0.00 0.00 0.00 179.25 179.63 2put h LEU 583 N 0.44 1.07 -0.29 0.00 3.38 -1.04 -1.35 115.31 117.52 2put h LEU 583 Ca 0.11 -0.18 -0.19 0.00 0.09 0.00 0.00 57.88 57.70 2put h LEU 583 Cb 0.38 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2put h LEU 583 CO 0.01 0.97 -0.59 -0.08 0.09 0.00 0.00 178.44 178.84 2put h GLU 584 N 1.11 0.84 -0.62 1.13 4.57 -0.94 -1.62 114.58 119.06 2put h GLU 584 Ca 0.25 -0.56 0.03 0.00 -1.18 0.00 0.00 59.36 57.89 2put h GLU 584 Cb 0.27 0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.89 2put h GLU 584 CO -0.01 1.19 0.38 0.78 -1.18 0.00 0.00 179.01 180.17 2put h GLY 585 N 0.70 0.89 1.34 1.92 0.00 -0.78 -1.01 103.07 106.13 2put h GLY 585 Ca 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 2put h GLY 585 CO 0.13 0.24 -0.14 0.00 0.00 0.00 0.00 176.54 176.77 2put h ALA 586 N 1.27 0.97 -0.75 3.60 0.00 -1.12 -0.07 119.26 123.15 2put h ALA 586 Ca 0.25 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2put h ALA 586 Cb 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2put h ALA 586 CO -0.10 0.61 0.33 1.25 0.00 0.00 0.00 179.25 181.33 2put h LEU 587 N 0.69 1.02 -0.26 0.00 5.85 -0.93 -1.99 115.31 119.69 2put h LEU 587 Ca 0.11 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 2put h LEU 587 Cb 0.63 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2put h LEU 587 CO 0.04 0.89 -0.09 0.11 -0.34 0.00 0.00 178.44 179.06 2put h LYS 588 N 1.07 0.52 -0.73 1.25 1.79 -0.68 -0.42 116.57 119.38 2put h LYS 588 Ca 0.25 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.51 2put h LYS 588 Cb 0.17 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 2put h LYS 588 CO -0.03 0.75 0.43 0.82 -1.08 0.00 0.00 179.45 180.34 2put h ILE 589 N 0.26 1.21 -0.12 1.86 2.04 -0.87 0.94 117.51 122.83 2put h ILE 589 Ca 0.06 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 2put h ILE 589 Cb 0.57 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 2put h ILE 589 CO 0.03 0.22 -0.00 0.11 0.00 0.00 0.00 178.15 178.51 2put h LYS 590 N 0.99 0.21 0.05 2.37 1.57 -1.26 -1.68 116.57 118.82 2put h LYS 590 Ca 0.26 -0.07 -0.23 0.00 -1.87 0.00 0.00 60.65 58.74 2put h LYS 590 Cb -0.02 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2put h LYS 590 CO -0.05 0.46 -1.06 0.93 -0.57 0.00 0.00 179.45 179.17 2put h GLU 591 N -0.07 0.13 0.00 3.15 5.08 -0.91 -2.91 114.58 119.05 2put h GLU 591 Ca 0.03 -0.20 -0.24 0.00 -1.00 0.00 0.00 59.36 57.95 2put h GLU 591 Cb 0.37 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 2put h GLU 591 CO 0.01 1.06 -1.63 -0.89 -1.00 0.00 0.00 179.01 176.56 2put n ILE 592 N -3.48 1.51 1.03 3.13 2.08 0.31 -4.59 119.36 119.36 2put n ILE 592 Ca -0.04 -0.10 0.13 0.00 0.56 0.00 0.00 62.75 63.31 2put n ILE 592 Cb 0.94 -2.11 0.52 0.00 -0.75 0.00 0.00 39.64 38.24 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 -4.39 0.17 -3.87 4.38 7.64 -0.68 -4.70 113.62 112.17 2put n SER 593 Ca -0.33 0.21 -0.26 0.00 1.01 0.00 0.00 58.87 59.49 2put n SER 593 Cb 0.67 -0.25 0.01 0.00 -1.01 0.00 0.00 64.21 63.63 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 -1.47 -1.94 -4.83 1.43 4.01 -0.94 -4.70 117.16 108.73 2put n TYR 594 Ca 0.07 0.83 -0.25 0.00 -0.16 0.00 0.00 57.90 58.40 2put n TYR 594 Cb 0.33 -3.98 -0.15 0.00 -0.31 0.00 0.00 39.34 35.23 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 -6.39 1.46 0.35 -0.72 1.75 -1.07 -5.00 119.30 109.67 2put s MET 595 Ca 0.26 -0.62 -0.28 0.00 -1.25 0.00 0.00 55.69 53.80 2put s MET 595 Cb -0.13 -1.38 -0.11 0.00 2.84 0.00 0.00 34.83 36.05 2put s MET 595 CO 0.85 0.35 1.40 -1.58 -0.65 0.00 0.00 175.02 175.39 2put s HIS 596 N -0.34 2.81 0.05 4.11 2.46 -1.09 -3.02 115.29 120.28 2put s HIS 596 Ca 0.05 1.28 -0.12 0.00 0.47 0.00 0.00 55.06 56.74 2put s HIS 596 Cb -0.07 -3.86 0.01 0.00 -0.13 0.00 0.00 32.58 28.53 2put s HIS 596 CO -0.00 -2.46 0.25 0.45 -2.47 0.00 0.00 174.74 170.51 2put s SER 597 N -0.29 -0.04 -0.02 9.88 0.15 -1.26 -1.00 113.70 121.12 2put s SER 597 Ca 0.51 -0.31 -0.01 0.00 0.70 0.00 0.00 55.95 56.84 2put s SER 597 Cb -0.43 0.33 0.01 0.00 -1.71 0.00 0.00 66.02 64.22 2put s SER 597 CO 0.58 -0.61 0.06 -0.70 1.20 0.00 0.00 173.24 173.77 2put s GLU 598 N -2.70 0.04 -0.17 5.44 2.12 -1.11 -4.89 118.70 117.44 2put s GLU 598 Ca -0.04 0.13 -0.18 0.00 0.36 0.00 0.00 54.97 55.24 2put s GLU 598 Cb -0.00 -0.05 -0.04 0.00 0.26 0.00 0.00 34.13 34.30 2put s GLU 598 CO -0.04 -0.06 0.49 0.20 -0.54 0.00 0.00 175.26 175.31 2put s GLY 599 N 0.38 2.18 -0.08 -1.50 0.00 -1.26 -1.21 107.32 105.83 2put s GLY 599 Ca -0.03 -0.35 0.04 0.00 0.00 0.00 0.00 44.72 44.39 2put s GLY 599 CO -0.01 0.95 -0.23 0.14 0.00 0.00 0.00 173.10 173.95 2put s VAL 600 N 1.27 2.23 -0.40 1.40 1.01 0.48 -4.83 120.40 121.55 2put s VAL 600 Ca 0.24 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 60.96 2put s VAL 600 Cb -0.15 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 2put s VAL 600 CO 0.10 0.56 1.63 -0.22 0.00 0.00 0.00 175.10 177.17 2put s LEU 601 N 0.08 3.51 0.11 3.92 2.96 -1.26 -1.84 118.68 126.17 2put s LEU 601 Ca -0.10 0.98 -0.31 0.00 -0.22 0.00 0.00 54.13 54.48 2put s LEU 601 Cb -0.16 -3.42 -0.11 0.00 0.50 0.00 0.00 46.19 43.00 2put s LEU 601 CO 0.06 -1.65 1.85 0.00 -1.32 0.00 0.00 176.35 175.28 2put n ALA 602 N 9.85 2.08 -0.92 5.97 0.00 -0.73 -2.28 120.51 134.48 2put n ALA 602 Ca 0.20 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2put n ALA 602 Cb 0.48 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.34 2put n ALA 602 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2put n GLY 603 N 4.24 0.68 0.15 0.00 0.00 -1.25 -4.34 105.19 104.67 2put n GLY 603 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 1.89 0.43 0.00 1.61 4.57 -1.79 -3.49 114.58 117.79 2put h GLU 604 Ca 0.00 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 2put h GLU 604 Cb 0.00 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 2put h GLU 604 CO 0.00 0.81 0.00 1.28 -1.18 0.00 0.00 179.01 179.92 2put n LEU 605 N -4.48 0.10 -0.56 1.64 4.77 -1.26 -5.19 117.00 112.02 2put n LEU 605 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2put n LEU 605 Cb 0.40 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2put n LEU 605 CO 0.41 -0.11 -0.16 0.00 -1.33 0.00 0.00 177.39 176.19 2put n LEU 617 N -1.68 -1.25 -4.80 2.23 -0.00 -1.26 -5.12 117.00 105.12 2put n LEU 617 Ca 0.00 1.07 -0.34 0.00 -0.00 0.00 0.00 56.01 56.74 2put n LEU 617 Cb 0.00 -0.43 -0.06 0.00 -0.00 0.00 0.00 43.42 42.93 2put n LEU 617 CO 0.00 0.06 0.67 -2.16 -0.00 0.00 0.00 177.39 175.96 2put s PRO 618 N -5.03 4.23 -0.02 1.47 0.04 -1.26 -4.96 135.00 129.47 2put s PRO 618 Ca 0.00 1.25 0.02 0.00 0.04 0.00 0.00 61.00 62.31 2put s PRO 618 Cb 0.00 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.20 2put s PRO 618 CO 0.00 -0.04 -0.06 0.42 0.04 0.00 0.00 177.00 177.36 2put s ILE 619 N -1.96 0.50 -0.16 0.56 1.09 -1.26 -2.13 121.20 117.84 2put s ILE 619 Ca 0.60 -0.21 -0.02 0.00 -1.10 0.00 0.00 60.65 59.92 2put s ILE 619 Cb -0.14 -0.46 -0.01 0.00 -1.06 0.00 0.00 42.46 40.79 2put s ILE 619 CO 0.18 0.17 -0.09 -0.63 -0.10 0.00 0.00 174.94 174.47 2put s ILE 620 N 0.22 3.26 -0.04 2.92 1.01 -0.00 -0.48 121.20 128.08 2put s ILE 620 Ca -0.02 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.12 2put s ILE 620 Cb -0.07 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.98 2put s ILE 620 CO -0.00 0.49 -0.24 0.00 0.00 0.00 0.00 174.94 175.20 2put s ALA 621 N 0.66 2.02 -0.33 9.38 0.00 -0.20 -0.02 121.76 133.27 2put s ALA 621 Ca -0.05 -1.00 -0.18 0.00 0.00 0.00 0.00 51.96 50.73 2put s ALA 621 Cb -0.15 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.37 2put s ALA 621 CO 0.02 0.42 0.51 -0.06 0.00 0.00 0.00 175.76 176.66 2put s PHE 622 N -0.28 3.19 -0.10 0.00 0.08 -0.28 -1.16 117.98 119.42 2put s PHE 622 Ca 0.01 0.26 0.17 0.00 0.12 0.00 0.00 56.93 57.50 2put s PHE 622 Cb -0.12 -2.89 0.40 0.00 -0.57 0.00 0.00 43.02 39.83 2put s PHE 622 CO 0.02 -0.49 1.18 0.00 -0.10 0.00 0.00 175.22 175.83 2put n ALA 623 N 5.71 2.94 -1.34 5.36 0.00 0.11 -4.81 120.51 128.49 2put n ALA 623 Ca -0.05 -2.74 -0.33 0.00 0.00 0.00 0.00 53.44 50.33 2put n ALA 623 Cb 0.49 -0.53 0.08 0.00 0.00 0.00 0.00 19.45 19.49 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 -1.65 2.95 0.43 0.00 -4.23 -1.18 -4.54 115.64 107.44 2put s THR 624 Ca 0.34 0.40 0.11 0.00 -1.18 0.00 0.00 61.69 61.36 2put s THR 624 Cb 0.35 -2.87 0.22 0.00 1.34 0.00 0.00 72.50 71.54 2put s THR 624 CO -0.10 -0.32 2.02 0.03 -0.54 0.00 0.00 174.62 175.71 2put h ARG 625 N -0.50 0.22 -0.14 3.99 3.08 -1.96 -1.47 114.38 117.61 2put h ARG 625 Ca -0.46 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 59.60 2put h ARG 625 Cb 1.25 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 2put h ARG 625 CO 0.51 0.25 0.10 0.38 -1.07 0.00 0.00 179.97 180.14 2put h ASP 626 N 0.22 0.00 0.00 7.04 2.03 -1.91 -3.05 116.42 120.75 2put h ASP 626 Ca 0.05 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.27 2put h ASP 626 Cb 0.17 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 38.50 2put h ASP 626 CO 0.00 0.00 -0.70 -1.20 -1.03 0.00 0.00 179.24 176.32 2put n SER 627 N -4.48 1.29 -4.25 4.15 7.64 -0.60 -4.75 113.62 112.62 2put n SER 627 Ca 0.00 -2.82 -0.43 0.00 1.01 0.00 0.00 58.87 56.62 2put n SER 627 Cb 0.22 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 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 -0.33 5.72 -4.89 -3.43 7.94 -0.90 -4.69 117.00 116.42 2put n LEU 628 Ca 0.11 -4.47 -0.29 0.00 -1.11 0.00 0.00 56.01 50.25 2put n LEU 628 Cb 0.89 -1.58 -0.03 0.00 0.53 0.00 0.00 43.42 43.23 2put n LEU 628 CO -0.03 0.91 0.35 -0.36 -1.11 0.00 0.00 177.39 177.15 2put s PHE 629 N 1.41 3.48 0.32 1.96 0.08 -1.26 -4.94 117.98 119.04 2put s PHE 629 Ca 0.43 0.87 0.10 0.00 0.12 0.00 0.00 56.93 58.45 2put s PHE 629 Cb 0.02 -2.30 0.93 0.00 -0.57 0.00 0.00 43.02 41.10 2put s PHE 629 CO 0.01 -0.01 1.71 -1.35 -0.10 0.00 0.00 175.22 175.48 2put h PRO 630 N 1.35 0.50 0.00 0.24 0.11 -2.00 0.14 132.00 132.34 2put h PRO 630 Ca -0.47 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2put h PRO 630 Cb 1.19 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2put h PRO 630 CO 0.64 0.33 -0.30 0.87 -0.21 0.00 0.00 178.00 179.33 2put h LYS 631 N 0.51 0.00 -0.07 1.05 1.57 -1.93 -1.17 116.57 116.53 2put h LYS 631 Ca 0.66 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.42 2put h LYS 631 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 2put h LYS 631 CO -0.51 0.30 -0.04 0.28 -0.57 0.00 0.00 179.45 178.91 2put h VAL 632 N 0.00 1.33 -0.68 0.50 2.07 -1.18 -1.83 116.25 116.46 2put h VAL 632 Ca -0.00 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.48 2put h VAL 632 Cb 0.73 1.90 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 2put h VAL 632 CO 0.04 0.30 0.42 0.24 0.02 0.00 0.00 177.57 178.58 2put h MET 633 N -0.24 0.78 0.00 1.57 2.86 -1.08 -0.27 114.93 118.55 2put h MET 633 Ca 0.02 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 2put h MET 633 Cb 0.49 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2put h MET 633 CO 0.01 0.52 -0.50 0.66 1.06 0.00 0.00 176.91 178.66 2put h SER 634 N 0.80 0.00 -0.27 1.22 4.64 -1.21 -0.05 113.55 118.68 2put h SER 634 Ca 0.28 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 2put h SER 634 Cb 0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2put h SER 634 CO -0.12 0.50 -0.17 0.00 -0.87 0.00 0.00 176.83 176.18 2put h ALA 635 N 1.50 0.38 -0.35 5.18 0.00 -0.89 -1.31 119.26 123.77 2put h ALA 635 Ca -0.01 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.58 2put h ALA 635 Cb 1.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2put h ALA 635 CO 0.07 0.29 0.21 0.82 0.00 0.00 0.00 179.25 180.63 2put h ILE 636 N 0.32 1.04 -0.62 0.00 2.04 -0.70 -2.33 117.51 117.26 2put h ILE 636 Ca 0.06 -0.14 0.04 0.00 1.00 0.00 0.00 64.86 65.81 2put h ILE 636 Cb 0.69 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 2put h ILE 636 CO 0.05 0.08 0.41 -0.33 0.00 0.00 0.00 178.15 178.35 2put h GLU 637 N 0.42 0.67 -0.61 2.37 5.08 -0.93 -0.62 114.58 120.95 2put h GLU 637 Ca 0.14 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 2put h GLU 637 Cb -0.00 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2put h GLU 637 CO -0.06 0.44 0.22 1.96 -1.00 0.00 0.00 179.01 180.57 2put h GLN 638 N 0.69 0.90 -0.19 2.33 4.20 -0.69 -0.83 115.11 121.52 2put h GLN 638 Ca 0.25 -0.15 -0.17 0.00 0.06 0.00 0.00 58.65 58.64 2put h GLN 638 Cb 0.14 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2put h GLN 638 CO -0.07 0.75 -0.56 0.28 -0.67 0.00 0.00 178.83 178.56 2put h VAL 639 N 0.88 1.31 0.00 -0.54 2.07 -0.89 -3.19 116.25 115.89 2put h VAL 639 Ca 0.20 -1.79 -0.02 0.00 0.82 0.00 0.00 66.70 65.92 2put h VAL 639 Cb 0.20 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2put h VAL 639 CO -0.02 0.56 -0.07 0.71 0.02 0.00 0.00 177.57 178.77 2put h THR 640 N 0.41 0.15 0.00 2.57 1.35 -1.05 0.23 112.91 116.57 2put h THR 640 Ca -0.02 -0.90 -0.03 0.00 -0.55 0.00 0.00 66.41 64.91 2put h THR 640 Cb 1.18 1.79 -0.00 0.00 -1.73 0.00 0.00 68.15 69.39 2put h THR 640 CO 0.12 0.07 -0.16 0.00 -0.25 0.00 0.00 175.52 175.30 2put h ALA 641 N 1.93 1.21 -0.34 6.62 0.00 -1.13 -2.07 119.26 125.47 2put h ALA 641 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2put h ALA 641 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2put h ALA 641 CO 0.01 0.20 0.00 -2.13 0.00 0.00 0.00 179.25 177.32 2put n ARG 642 N -3.58 2.98 -4.11 0.00 0.63 -1.00 -4.98 116.66 106.59 2put n ARG 642 Ca -0.01 -2.44 -0.30 0.00 -0.92 0.00 0.00 57.85 54.18 2put n ARG 642 Cb 0.29 -1.55 -0.04 0.00 0.45 0.00 0.00 32.46 31.62 2put n ARG 642 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2put n ASP 643 N 0.17 -1.20 0.00 6.15 8.00 -0.78 -4.89 116.55 123.99 2put n ASP 643 Ca 0.17 -1.05 0.09 0.00 0.71 0.00 0.00 54.79 54.70 2put n ASP 643 Cb 0.65 -2.72 0.45 0.00 -0.02 0.00 0.00 41.12 39.48 2put n ASP 643 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2put n GLY 644 N -1.85 -0.87 3.56 0.44 0.00 0.76 -4.96 105.19 102.27 2put n GLY 644 Ca -0.17 -0.08 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 2put n GLY 644 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2put n ARG 645 N -1.28 -2.29 -1.40 1.61 1.74 -1.24 -4.81 116.66 108.98 2put n ARG 645 Ca 0.08 0.61 -0.32 0.00 -0.77 0.00 0.00 57.85 57.46 2put n ARG 645 Cb 0.14 -4.85 0.08 0.00 -1.02 0.00 0.00 32.46 26.81 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 -5.51 2.42 -0.25 5.56 0.04 -1.26 -4.66 135.00 131.33 2put s PRO 646 Ca 0.37 1.22 -0.09 0.00 0.04 0.00 0.00 61.00 62.55 2put s PRO 646 Cb -0.10 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2put s PRO 646 CO 0.82 -1.52 0.12 0.42 0.04 0.00 0.00 177.00 176.88 2put s ILE 647 N -2.75 4.84 -0.18 0.56 1.01 0.37 -1.23 121.20 123.83 2put s ILE 647 Ca 0.63 0.01 -0.01 0.00 0.00 0.00 0.00 60.65 61.27 2put s ILE 647 Cb -0.18 -3.28 -0.00 0.00 0.01 0.00 0.00 42.46 39.01 2put s ILE 647 CO 0.52 0.32 -0.11 -0.69 0.00 0.00 0.00 174.94 174.98 2put s VAL 648 N 1.50 2.97 -0.26 2.92 1.01 0.18 -1.04 120.40 127.69 2put s VAL 648 Ca 0.06 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 2put s VAL 648 Cb -0.15 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2put s VAL 648 CO 0.06 0.48 0.35 -0.63 0.00 0.00 0.00 175.10 175.37 2put s ILE 649 N 1.02 5.20 0.30 2.22 1.01 -0.31 0.04 121.20 130.67 2put s ILE 649 Ca -0.01 0.54 -0.06 0.00 0.00 0.00 0.00 60.65 61.13 2put s ILE 649 Cb -0.15 -3.68 -0.00 0.00 0.01 0.00 0.00 42.46 38.64 2put s ILE 649 CO -0.02 0.18 0.45 0.00 0.00 0.00 0.00 174.94 175.55 2put s ASN 651 N -3.16 6.97 -0.14 0.00 0.02 -1.26 -0.45 114.94 116.92 2put s ASN 651 Ca 0.29 1.56 -0.40 0.00 -1.02 0.00 0.00 52.86 53.29 2put s ASN 651 Cb 0.00 -2.48 -0.17 0.00 0.02 0.00 0.00 41.25 38.62 2put s ASN 651 CO 0.16 -0.21 1.47 -0.62 0.02 0.00 0.00 177.10 177.92 2put n GLU 652 N -0.18 0.80 -0.17 -0.60 1.02 -0.83 -1.66 120.64 119.02 2put n GLU 652 Ca 0.04 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 2put n GLU 652 Cb 0.53 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 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 3.15 1.13 3.67 0.62 0.00 -1.26 -4.97 105.19 107.54 2put n GLY 653 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.95 6.50 -0.82 1.61 1.01 -0.66 -5.02 116.67 116.34 2put s ASP 654 Ca 0.00 0.59 -0.20 0.00 0.71 0.00 0.00 52.55 53.65 2put s ASP 654 Cb 0.00 -2.26 0.11 0.00 1.01 0.00 0.00 42.92 41.79 2put s ASP 654 CO 0.00 -0.10 1.04 0.00 0.21 0.00 0.00 175.17 176.31 2put s ALA 655 N 1.35 3.31 0.11 5.23 0.00 -1.26 -4.84 121.76 125.66 2put s ALA 655 Ca 0.21 -2.46 -0.09 0.00 0.00 0.00 0.00 51.96 49.62 2put s ALA 655 Cb -0.15 -3.94 -0.12 0.00 0.00 0.00 0.00 23.12 18.91 2put s ALA 655 CO 0.09 -2.86 1.29 0.82 0.00 0.00 0.00 175.76 175.10 2put h ILE 656 N 5.87 1.33 -4.20 0.00 1.08 -1.96 -3.44 117.51 116.19 2put h ILE 656 Ca -0.01 -2.21 -0.64 0.00 -0.39 0.00 0.00 64.86 61.61 2put h ILE 656 Cb 1.04 2.24 -0.31 0.00 -3.07 0.00 0.00 36.82 36.73 2put h ILE 656 CO 1.12 0.68 -0.87 -0.63 -0.69 0.00 0.00 178.15 177.77 2put s ILE 657 N -3.47 1.78 0.90 -0.67 1.01 -1.26 -5.09 121.20 114.41 2put s ILE 657 Ca -0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 2put s ILE 657 Cb 0.08 -1.50 0.13 0.00 0.01 0.00 0.00 42.46 41.19 2put s ILE 657 CO 0.89 0.50 1.14 -0.94 0.00 0.00 0.00 174.94 176.53 2put s SER 658 N -0.28 3.60 0.00 3.58 1.04 -1.26 -4.93 113.70 115.44 2put s SER 658 Ca 0.02 0.94 0.22 0.00 0.48 0.00 0.00 55.95 57.61 2put s SER 658 Cb -0.11 -1.50 1.24 0.00 0.10 0.00 0.00 66.02 65.76 2put s SER 658 CO 0.01 -2.49 1.81 0.59 0.98 0.00 0.00 173.24 174.14 2put n ASN 659 N -3.72 0.26 -0.46 7.02 3.02 -1.26 -2.69 115.26 117.43 2put n ASN 659 Ca 0.07 -1.36 0.08 0.00 -0.03 0.00 0.00 54.58 53.34 2put n ASN 659 Cb 0.59 -0.01 0.30 0.00 -0.61 0.00 0.00 39.78 40.06 2put n ASN 659 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2put n ASP 660 N -0.67 1.36 -4.10 6.41 5.68 -1.26 -4.67 116.55 119.30 2put n ASP 660 Ca 0.17 -1.78 -0.26 0.00 -0.50 0.00 0.00 54.79 52.42 2put n ASP 660 Cb 0.12 -0.12 -0.16 0.00 -1.14 0.00 0.00 41.12 39.81 2put n ASP 660 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2put s LYS 661 N -1.76 1.93 0.11 0.11 -0.14 -1.09 -5.12 119.74 113.78 2put s LYS 661 Ca 0.26 -0.57 -0.31 0.00 -1.36 0.00 0.00 55.97 54.00 2put s LYS 661 Cb 0.14 -1.60 -0.08 0.00 -1.68 0.00 0.00 37.83 34.61 2put s LYS 661 CO 0.20 0.15 1.36 0.08 -0.76 0.00 0.00 175.35 176.38 2put s VAL 662 N 0.33 3.38 0.14 3.17 1.01 -1.26 -4.85 120.40 122.32 2put s VAL 662 Ca -0.10 1.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.67 2put s VAL 662 Cb -0.14 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.66 2put s VAL 662 CO 0.04 0.08 0.52 -1.38 0.00 0.00 0.00 175.10 174.36 2put s HIS 663 N 1.03 -0.41 -0.05 5.22 -3.43 -1.26 -3.73 115.29 112.66 2put s HIS 663 Ca 0.63 0.17 0.00 0.00 -0.80 0.00 0.00 55.06 55.06 2put s HIS 663 Cb -0.36 0.44 -0.03 0.00 -1.43 0.00 0.00 32.58 31.20 2put s HIS 663 CO 0.31 -0.79 -0.02 0.99 -2.00 0.00 0.00 174.74 173.23 2put s THR 664 N -3.73 4.09 -0.03 -5.38 2.01 -0.36 -4.99 115.64 107.25 2put s THR 664 Ca 0.02 -0.44 0.07 0.00 0.31 0.00 0.00 61.69 61.64 2put s THR 664 Cb 0.00 -2.75 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 2put s THR 664 CO -0.12 0.52 -0.23 -0.89 -0.69 0.00 0.00 174.62 173.21 2put s THR 665 N -0.94 2.31 -0.29 -0.82 2.01 -1.26 -0.65 115.64 116.00 2put s THR 665 Ca 0.15 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.15 2put s THR 665 Cb -0.11 -1.83 0.09 0.00 0.01 0.00 0.00 72.50 70.65 2put s THR 665 CO 0.05 0.58 0.03 -0.76 -0.69 0.00 0.00 174.62 173.83 2put s LEU 666 N -0.62 3.10 0.03 4.42 1.43 0.11 -4.91 118.68 122.24 2put s LEU 666 Ca 0.10 -1.63 -0.19 0.00 -1.03 0.00 0.00 54.13 51.37 2put s LEU 666 Cb -0.10 -1.19 -0.06 0.00 0.03 0.00 0.00 46.19 44.86 2put s LEU 666 CO -0.00 -0.34 0.55 -1.61 0.23 0.00 0.00 176.35 175.17 2put s GLU 667 N 1.33 4.21 0.10 1.70 2.02 -1.26 -2.22 118.70 124.58 2put s GLU 667 Ca 0.05 0.67 0.06 0.00 0.02 0.00 0.00 54.97 55.77 2put s GLU 667 Cb -0.18 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 2put s GLU 667 CO -0.13 0.54 -0.14 0.14 0.02 0.00 0.00 175.26 175.68 2put s VAL 668 N -0.73 1.26 0.57 2.63 -7.23 0.40 -4.81 120.40 112.49 2put s VAL 668 Ca 0.29 -1.58 -0.21 0.00 -1.81 0.00 0.00 61.98 58.67 2put s VAL 668 Cb -0.18 -1.39 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 2put s VAL 668 CO 0.17 -0.35 1.27 -2.65 -0.31 0.00 0.00 175.10 173.23 2put n PRO 669 N 0.78 1.44 -2.79 4.82 -0.02 -1.26 -1.96 135.00 136.01 2put n PRO 669 Ca -0.17 0.54 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 2put n PRO 669 Cb 0.56 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 2put n PRO 669 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2put s GLU 670 N -2.94 4.57 0.20 -0.52 2.12 -1.26 -4.87 118.70 116.01 2put s GLU 670 Ca 0.74 1.32 0.00 0.00 0.36 0.00 0.00 54.97 57.39 2put s GLU 670 Cb -0.42 -3.43 -0.00 0.00 0.26 0.00 0.00 34.13 30.54 2put s GLU 670 CO 0.47 0.06 0.02 -2.37 -0.54 0.00 0.00 175.26 172.89 2put n THR 671 N 3.53 0.00 -1.75 -1.70 5.66 -1.26 -5.11 114.28 113.66 2put n THR 671 Ca 0.03 -1.01 -0.42 0.00 -3.05 0.00 0.00 64.05 59.60 2put n THR 671 Cb 0.51 0.24 -0.01 0.00 -1.55 0.00 0.00 70.33 69.52 2put n THR 671 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2put n VAL 672 N -0.50 1.45 -0.29 1.08 0.31 -1.26 -4.79 118.33 114.33 2put n VAL 672 Ca -0.07 -0.36 0.05 0.00 -0.01 0.00 0.00 64.34 63.95 2put n VAL 672 Cb 0.27 -1.90 0.14 0.00 -0.91 0.00 0.00 33.84 31.44 2put n VAL 672 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 2put h ASP 673 N 3.91 -0.61 0.36 4.52 3.04 -1.99 0.99 116.42 126.64 2put h ASP 673 Ca -0.48 0.24 0.00 0.00 -3.24 0.00 0.00 57.03 53.55 2put h ASP 673 Cb 1.24 0.46 0.00 0.00 -1.04 0.00 0.00 39.33 39.99 2put h ASP 673 CO 0.72 -0.26 0.00 0.00 -2.04 0.00 0.00 179.24 177.66 2put n LEU 675 N -1.21 1.37 -0.01 0.00 4.77 0.31 -4.63 117.00 117.61 2put n LEU 675 Ca 0.14 -0.66 0.07 0.00 -0.03 0.00 0.00 56.01 55.54 2put n LEU 675 Cb 0.18 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 41.73 2put n LEU 675 CO 0.18 0.28 1.16 -0.61 -1.33 0.00 0.00 177.39 177.08 2put h GLN 676 N 1.19 0.45 0.00 3.23 5.75 -1.15 -1.71 115.11 122.87 2put h GLN 676 Ca 0.00 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2put h GLN 676 Cb 0.53 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 2put h GLN 676 CO 0.00 0.30 -0.06 0.78 -2.65 0.00 0.00 178.83 177.20 2put h GLY 677 N 0.47 0.00 1.36 2.39 0.00 -1.82 0.14 103.07 105.61 2put h GLY 677 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.49 2put h GLY 677 CO -0.04 0.00 0.27 1.41 0.00 0.00 0.00 176.54 178.18 2put h LEU 678 N 0.00 0.75 0.13 3.11 3.38 -1.64 -2.41 115.31 118.63 2put h LEU 678 Ca -0.00 -0.08 -0.35 0.00 0.09 0.00 0.00 57.88 57.54 2put h LEU 678 Cb 0.14 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2put h LEU 678 CO 0.01 0.65 -1.85 -0.07 0.09 0.00 0.00 178.44 177.26 2put h LEU 679 N 0.83 0.44 -1.46 1.67 3.38 -1.52 -3.39 115.31 115.25 2put h LEU 679 Ca 0.20 -0.82 -0.06 0.00 0.09 0.00 0.00 57.88 57.30 2put h LEU 679 Cb 0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2put h LEU 679 CO -0.03 1.72 -0.27 0.78 0.09 0.00 0.00 178.44 180.73 2put h ASN 680 N 0.08 0.00 0.66 -0.43 4.21 -0.94 -2.31 115.58 116.85 2put h ASN 680 Ca -0.37 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.03 2put h ASN 680 Cb 2.05 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 39.24 2put h ASN 680 CO 0.12 0.27 -0.51 1.62 -1.29 0.00 0.00 177.43 177.64 2put h VAL 681 N 0.00 1.23 -0.35 2.81 3.04 -1.62 -3.34 116.25 118.03 2put h VAL 681 Ca -0.00 -1.82 0.02 0.00 -1.01 0.00 0.00 66.70 63.89 2put h VAL 681 Cb 0.54 2.02 -0.02 0.00 -2.01 0.00 0.00 31.29 31.81 2put h VAL 681 CO 0.04 0.50 0.20 0.40 -1.01 0.00 0.00 177.57 177.69 2put h ILE 682 N 0.00 1.03 -0.36 3.17 1.08 -1.60 -0.95 117.51 119.88 2put h ILE 682 Ca -0.01 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 64.32 2put h ILE 682 Cb 0.97 0.59 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 2put h ILE 682 CO 0.07 0.07 0.22 -0.65 -0.69 0.00 0.00 178.15 177.17 2put h PRO 683 N 0.41 0.48 -0.49 2.37 0.11 -1.74 -1.42 132.00 131.72 2put h PRO 683 Ca 0.14 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.10 2put h PRO 683 Cb 0.01 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 2put h PRO 683 CO -0.07 0.33 -0.15 -0.07 -0.21 0.00 0.00 178.00 177.83 2put h LEU 684 N 0.49 0.95 -0.17 2.35 -0.00 -1.49 0.15 115.31 117.57 2put h LEU 684 Ca 0.13 -0.32 0.01 0.00 -0.00 0.00 0.00 57.88 57.70 2put h LEU 684 Cb -0.02 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 40.36 2put h LEU 684 CO -0.03 1.09 0.07 1.56 -0.00 0.00 0.00 178.44 181.13 2put h GLN 685 N 0.83 0.15 -0.61 1.13 4.20 -0.65 -0.58 115.11 119.59 2put h GLN 685 Ca 0.12 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 2put h GLN 685 Cb 0.70 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.42 2put h GLN 685 CO 0.05 0.10 0.38 -0.07 -0.67 0.00 0.00 178.83 178.62 2put h LEU 686 N 0.15 0.72 -0.38 1.46 3.38 -1.16 -1.50 115.31 117.98 2put h LEU 686 Ca 0.07 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2put h LEU 686 Cb 0.04 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2put h LEU 686 CO -0.07 0.56 0.22 0.40 0.09 0.00 0.00 178.44 179.64 2put h ILE 687 N 0.82 1.14 -0.80 1.22 2.04 -0.58 -0.47 117.51 120.88 2put h ILE 687 Ca 0.22 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 2put h ILE 687 Cb -0.04 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 2put h ILE 687 CO -0.04 0.14 0.37 0.77 0.00 0.00 0.00 178.15 179.39 2put h SER 688 N 0.50 1.04 0.39 1.72 4.64 -0.90 0.12 113.55 121.05 2put h SER 688 Ca 0.14 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 2put h SER 688 Cb 0.04 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.86 2put h SER 688 CO -0.02 0.89 -0.19 0.22 -0.87 0.00 0.00 176.83 176.86 2put h TYR 689 N 1.14 -0.48 -0.34 4.77 3.20 -1.06 -2.60 116.97 121.60 2put h TYR 689 Ca 0.27 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 2put h TYR 689 Cb 0.13 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 2put h TYR 689 CO 0.01 -0.15 0.08 -1.49 -1.64 0.00 0.00 178.16 174.97 2put h TRP 690 N -0.88 0.50 -0.54 -3.82 4.06 -0.97 -1.62 115.95 112.68 2put h TRP 690 Ca -0.05 -0.03 0.01 0.00 2.06 0.00 0.00 58.89 60.87 2put h TRP 690 Cb 0.54 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.53 2put h TRP 690 CO 0.02 0.44 0.36 -0.07 -3.56 0.00 0.00 178.44 175.63 2put h LEU 691 N 0.49 0.62 -0.35 -4.49 3.38 -0.79 -0.85 115.31 113.32 2put h LEU 691 Ca 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2put h LEU 691 Cb 0.20 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2put h LEU 691 CO -0.00 0.45 0.21 0.00 0.09 0.00 0.00 178.44 179.19 2put h ALA 692 N 1.20 0.45 -0.66 1.53 0.00 -1.01 -1.10 119.26 119.67 2put h ALA 692 Ca 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2put h ALA 692 Cb -0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2put h ALA 692 CO -0.04 -0.06 0.40 0.28 0.00 0.00 0.00 179.25 179.83 2put h VAL 693 N 0.46 1.19 0.00 0.00 2.07 -1.07 0.12 116.25 119.02 2put h VAL 693 Ca 0.13 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.18 2put h VAL 693 Cb -0.00 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2put h VAL 693 CO -0.02 0.19 -0.25 0.78 0.02 0.00 0.00 177.57 178.29 2put h ASN 694 N 0.89 0.00 -0.30 0.57 2.35 -0.92 -2.49 115.58 115.68 2put h ASN 694 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 2put h ASN 694 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2put h ASN 694 CO -0.04 0.25 0.00 0.54 -1.65 0.00 0.00 177.43 176.53 2put n ARG 695 N -3.85 1.83 -1.42 0.81 1.74 -0.44 -4.94 116.66 110.40 2put n ARG 695 Ca -0.02 -1.28 -0.07 0.00 -0.77 0.00 0.00 57.85 55.72 2put n ARG 695 Cb 0.34 -1.33 -0.02 0.00 -1.02 0.00 0.00 32.46 30.43 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 1.12 0.70 3.73 -0.13 0.00 -0.83 -5.02 105.19 104.75 2put n GLY 696 Ca 0.14 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.27 5.27 -0.60 -0.61 1.01 0.33 -5.01 121.20 119.33 2put s ILE 697 Ca 0.00 0.65 -0.26 0.00 0.00 0.00 0.00 60.65 61.05 2put s ILE 697 Cb 0.00 -3.68 0.04 0.00 0.01 0.00 0.00 42.46 38.83 2put s ILE 697 CO 0.00 0.38 1.07 -0.62 0.00 0.00 0.00 174.94 175.77 2put s ASP 698 N 0.47 6.33 0.19 3.58 -1.08 -1.26 -4.27 116.67 120.63 2put s ASP 698 Ca 0.19 -0.28 0.22 0.00 -0.52 0.00 0.00 52.55 52.16 2put s ASP 698 Cb -0.14 -2.49 0.89 0.00 -1.46 0.00 0.00 42.92 39.73 2put s ASP 698 CO 0.06 -1.41 1.68 1.33 0.52 0.00 0.00 175.17 177.34 2put n VAL 699 N 6.35 0.80 1.39 1.11 0.24 -1.26 -5.15 118.33 121.80 2put n VAL 699 Ca 0.04 0.16 0.14 0.00 -2.04 0.00 0.00 64.34 62.63 2put n VAL 699 Cb 0.48 -1.03 0.43 0.00 -1.47 0.00 0.00 33.84 32.25 2put n VAL 699 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16