#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pzf n THR 389 N 0.00 0.00 -2.62 12.58 -1.04 -1.26 -4.86 114.28 117.08 2pzf n THR 389 Ca 0.00 -0.06 -0.43 0.00 -2.04 0.00 0.00 64.05 61.52 2pzf n THR 389 Cb 0.00 -0.07 -0.02 0.00 -1.82 0.00 0.00 70.33 68.42 2pzf n THR 389 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2pzf s THR 390 N -2.48 4.62 -0.24 12.58 2.01 -1.26 0.13 115.64 131.00 2pzf s THR 390 Ca 0.28 1.94 -0.00 0.00 0.31 0.00 0.00 61.69 64.22 2pzf s THR 390 Cb 0.20 -4.25 -0.15 0.00 0.01 0.00 0.00 72.50 68.31 2pzf s THR 390 CO 0.48 -0.12 -0.23 -0.62 -0.69 0.00 0.00 174.62 173.44 2pzf n GLU 391 N 5.97 0.58 -4.43 4.92 -0.58 0.09 -4.88 120.64 122.31 2pzf n GLU 391 Ca 0.11 0.15 -0.23 0.00 -0.42 0.00 0.00 57.16 56.78 2pzf n GLU 391 Cb 0.46 -1.46 -0.16 0.00 -0.57 0.00 0.00 31.44 29.71 2pzf n GLU 391 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2pzf s VAL 392 N -2.47 0.90 -0.08 2.62 1.01 -1.06 -4.30 120.40 117.01 2pzf s VAL 392 Ca -0.32 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.32 2pzf s VAL 392 Cb 0.09 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.65 2pzf s VAL 392 CO 0.53 0.30 -0.09 -0.69 0.00 0.00 0.00 175.10 175.14 2pzf s VAL 393 N 0.69 1.01 -0.11 2.92 1.01 -0.78 -0.04 120.40 125.10 2pzf s VAL 393 Ca -0.13 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.50 2pzf s VAL 393 Cb -0.15 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 2pzf s VAL 393 CO 0.02 0.34 -0.13 -0.04 0.00 0.00 0.00 175.10 175.30 2pzf s MET 394 N 1.09 3.18 -0.13 2.72 -1.94 0.14 -0.84 119.30 123.52 2pzf s MET 394 Ca -0.07 -0.68 -0.01 0.00 -1.71 0.00 0.00 55.69 53.22 2pzf s MET 394 Cb -0.14 -2.58 0.04 0.00 2.01 0.00 0.00 34.83 34.15 2pzf s MET 394 CO -0.01 0.32 -0.02 -1.21 -0.01 0.00 0.00 175.02 174.09 2pzf s GLU 395 N 0.07 1.01 -1.53 2.03 2.02 0.03 -2.04 118.70 120.29 2pzf s GLU 395 Ca -0.05 -0.22 -0.04 0.00 0.02 0.00 0.00 54.97 54.68 2pzf s GLU 395 Cb -0.15 -1.56 0.01 0.00 0.10 0.00 0.00 34.13 32.54 2pzf s GLU 395 CO 0.04 -0.39 0.46 -1.71 0.02 0.00 0.00 175.26 173.68 2pzf n ASN 396 N 5.02 -5.62 -4.67 -0.19 4.05 -0.98 -1.28 115.26 111.59 2pzf n ASN 396 Ca -0.10 -0.23 -0.43 0.00 0.45 0.00 0.00 54.58 54.28 2pzf n ASN 396 Cb 0.49 -4.58 -0.02 0.00 1.23 0.00 0.00 39.78 36.89 2pzf n ASN 396 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2pzf s VAL 397 N -3.09 4.64 0.03 3.44 1.01 -0.64 -3.41 120.40 122.39 2pzf s VAL 397 Ca 0.25 1.95 0.07 0.00 0.00 0.00 0.00 61.98 64.25 2pzf s VAL 397 Cb -0.12 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 31.99 2pzf s VAL 397 CO 0.31 -0.09 -0.22 -0.89 0.00 0.00 0.00 175.10 174.21 2pzf s THR 398 N 2.68 1.73 -0.01 3.92 2.01 -0.99 -0.47 115.64 124.52 2pzf s THR 398 Ca 0.48 -1.13 -0.18 0.00 0.31 0.00 0.00 61.69 61.16 2pzf s THR 398 Cb -0.18 -1.48 0.03 0.00 0.01 0.00 0.00 72.50 70.88 2pzf s THR 398 CO 0.13 0.31 0.40 0.00 -0.69 0.00 0.00 174.62 174.76 2pzf s ALA 399 N -0.71 -1.00 -0.03 7.40 0.00 -0.23 -1.25 121.76 125.94 2pzf s ALA 399 Ca 0.08 0.50 0.06 0.00 0.00 0.00 0.00 51.96 52.60 2pzf s ALA 399 Cb -0.09 0.12 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 2pzf s ALA 399 CO 0.01 -0.32 -0.21 -0.06 0.00 0.00 0.00 175.76 175.18 2pzf s PHE 400 N -1.54 1.96 0.22 0.00 0.40 -1.26 -0.48 117.98 117.28 2pzf s PHE 400 Ca -0.11 -0.48 0.07 0.00 -0.60 0.00 0.00 56.93 55.80 2pzf s PHE 400 Cb -0.03 -1.29 0.17 0.00 0.51 0.00 0.00 43.02 42.38 2pzf s PHE 400 CO 0.04 -0.11 1.50 -1.49 0.70 0.00 0.00 175.22 175.86 2pzf h TRP 401 N 5.91 0.13 -3.43 0.36 4.06 -1.96 -3.45 115.95 117.57 2pzf h TRP 401 Ca -0.36 -0.06 -0.43 0.00 2.06 0.00 0.00 58.89 60.11 2pzf h TRP 401 Cb 1.16 -0.02 -0.34 0.00 -1.00 0.00 0.00 29.16 28.96 2pzf h TRP 401 CO 0.41 0.79 -0.78 -1.21 -3.56 0.00 0.00 178.44 174.09 2pzf s GLU 402 N -3.42 0.93 0.56 0.49 8.01 -1.26 -5.05 118.70 118.96 2pzf s GLU 402 Ca -0.02 -0.12 0.40 0.00 0.01 0.00 0.00 54.97 55.23 2pzf s GLU 402 Cb 0.12 -0.94 1.56 0.00 -4.31 0.00 0.00 34.13 30.56 2pzf s GLU 402 CO 0.79 -0.10 1.71 0.93 0.01 0.00 0.00 175.26 178.61 2pzf h GLU 403 N 7.30 0.00 0.00 1.61 4.39 -1.98 0.94 114.58 126.84 2pzf h GLU 403 Ca -0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.35 2pzf h GLU 403 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 2pzf h GLU 403 CO 0.45 0.00 -1.33 0.41 -1.16 0.00 0.00 179.01 177.38 2pzf n GLY 404 N -1.80 -1.15 0.00 -3.84 0.00 -1.26 -5.02 105.19 92.12 2pzf n GLY 404 Ca 0.30 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2pzf n GLY 404 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pzf n GLY 437 N 1.32 -0.82 3.88 -0.02 0.00 0.32 -5.07 105.19 104.81 2pzf n GLY 437 Ca -0.00 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.13 2pzf n GLY 437 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2pzf s THR 438 N 0.00 4.85 0.20 2.61 -1.32 -1.26 -5.02 115.64 115.70 2pzf s THR 438 Ca 0.00 0.52 -0.30 0.00 -1.21 0.00 0.00 61.69 60.70 2pzf s THR 438 Cb 0.00 -3.68 -0.09 0.00 -1.51 0.00 0.00 72.50 67.22 2pzf s THR 438 CO 0.00 -0.32 1.34 -2.16 -2.21 0.00 0.00 174.62 171.27 2pzf s PRO 439 N -3.40 4.36 0.21 7.08 0.04 -1.26 -4.61 135.00 137.43 2pzf s PRO 439 Ca 0.49 2.10 0.10 0.00 0.04 0.00 0.00 61.00 63.73 2pzf s PRO 439 Cb -0.11 -3.19 0.10 0.00 0.04 0.00 0.00 34.50 31.35 2pzf s PRO 439 CO 0.26 -0.30 1.46 -0.24 0.04 0.00 0.00 177.00 178.22 2pzf h VAL 440 N 3.76 1.47 -3.81 -0.36 3.04 -1.13 -3.45 116.25 115.76 2pzf h VAL 440 Ca -0.45 -2.67 -0.28 0.00 -1.01 0.00 0.00 66.70 62.30 2pzf h VAL 440 Cb 1.21 2.47 -0.28 0.00 -2.01 0.00 0.00 31.29 32.68 2pzf h VAL 440 CO 0.78 0.74 -0.74 -0.76 -1.01 0.00 0.00 177.57 176.59 2pzf s LEU 441 N -7.06 2.00 -0.04 3.16 1.43 -1.07 -4.14 118.68 112.96 2pzf s LEU 441 Ca 0.00 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2pzf s LEU 441 Cb 0.11 -0.13 0.03 0.00 0.03 0.00 0.00 46.19 46.23 2pzf s LEU 441 CO 0.78 0.03 0.04 -0.54 0.23 0.00 0.00 176.35 176.89 2pzf s LYS 442 N -0.05 0.11 -1.23 1.70 -0.14 0.07 -1.07 119.74 119.12 2pzf s LYS 442 Ca 0.01 0.28 -0.16 0.00 -1.36 0.00 0.00 55.97 54.74 2pzf s LYS 442 Cb -0.01 -0.58 0.00 0.00 -1.68 0.00 0.00 37.83 35.56 2pzf s LYS 442 CO -0.00 -0.29 0.66 -0.40 -0.76 0.00 0.00 175.35 174.56 2pzf n ASP 443 N 5.06 -3.57 -4.74 2.83 5.68 -0.65 -4.23 116.55 116.93 2pzf n ASP 443 Ca -0.08 -1.05 -0.39 0.00 -0.50 0.00 0.00 54.79 52.77 2pzf n ASP 443 Cb 0.50 -3.07 -0.06 0.00 -1.14 0.00 0.00 41.12 37.36 2pzf n ASP 443 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2pzf s ILE 444 N -3.63 5.05 -0.04 2.12 -1.09 0.38 -4.68 121.20 119.31 2pzf s ILE 444 Ca 0.33 1.17 -0.01 0.00 -2.23 0.00 0.00 60.65 59.91 2pzf s ILE 444 Cb -0.13 -3.91 0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2pzf s ILE 444 CO 0.88 0.35 0.03 0.20 -1.23 0.00 0.00 174.94 175.17 2pzf s ASN 445 N 0.33 0.91 0.18 3.58 0.01 -1.26 -1.61 114.94 117.07 2pzf s ASN 445 Ca 0.30 0.01 -0.24 0.00 -0.71 0.00 0.00 52.86 52.22 2pzf s ASN 445 Cb -0.17 -0.22 0.06 0.00 0.41 0.00 0.00 41.25 41.33 2pzf s ASN 445 CO 0.15 -0.18 0.93 0.72 -1.51 0.00 0.00 177.10 177.20 2pzf s PHE 446 N 1.66 -0.13 -0.01 2.20 -0.12 -0.87 -4.98 117.98 115.74 2pzf s PHE 446 Ca -0.01 -0.21 -0.05 0.00 -0.05 0.00 0.00 56.93 56.61 2pzf s PHE 446 Cb -0.13 0.65 0.00 0.00 -0.63 0.00 0.00 43.02 42.92 2pzf s PHE 446 CO -0.03 -0.90 0.10 0.15 -0.05 0.00 0.00 175.22 174.49 2pzf s LYS 447 N -3.33 0.33 -0.12 1.99 1.02 -1.26 -0.68 119.74 117.69 2pzf s LYS 447 Ca 0.12 -0.25 0.01 0.00 0.02 0.00 0.00 55.97 55.88 2pzf s LYS 447 Cb -0.02 0.14 0.02 0.00 -0.52 0.00 0.00 37.83 37.44 2pzf s LYS 447 CO 0.03 -0.07 -0.15 0.42 -0.92 0.00 0.00 175.35 174.67 2pzf s ILE 448 N -0.91 1.51 0.52 2.17 1.01 0.94 -4.98 121.20 121.46 2pzf s ILE 448 Ca -0.10 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.78 2pzf s ILE 448 Cb -0.06 -1.40 -0.07 0.00 0.01 0.00 0.00 42.46 40.94 2pzf s ILE 448 CO 0.01 0.45 0.95 -1.61 0.00 0.00 0.00 174.94 174.73 2pzf s GLU 449 N 1.20 3.83 0.16 2.79 0.41 -1.26 -0.74 118.70 125.09 2pzf s GLU 449 Ca -0.02 0.80 -0.34 0.00 -0.41 0.00 0.00 54.97 55.00 2pzf s GLU 449 Cb -0.14 -2.18 -0.14 0.00 -1.78 0.00 0.00 34.13 29.89 2pzf s GLU 449 CO -0.05 -0.29 1.51 -2.13 -0.49 0.00 0.00 175.26 173.81 2pzf n ARG 450 N -1.80 1.94 -0.77 1.61 0.63 0.35 -1.79 116.66 116.83 2pzf n ARG 450 Ca 0.05 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.68 2pzf n ARG 450 Cb 0.54 -2.43 0.00 0.00 0.45 0.00 0.00 32.46 31.02 2pzf n ARG 450 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2pzf n GLY 451 N 3.11 0.81 3.88 5.14 0.00 -1.26 -4.92 105.19 111.95 2pzf n GLY 451 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2pzf n GLY 451 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pzf s GLN 452 N -0.23 3.72 -0.26 1.61 -0.21 -0.74 -4.48 119.66 119.07 2pzf s GLN 452 Ca 0.00 0.39 -0.06 0.00 0.02 0.00 0.00 55.36 55.71 2pzf s GLN 452 Cb 0.00 -2.40 -0.00 0.00 1.00 0.00 0.00 33.01 31.61 2pzf s GLN 452 CO 0.00 -0.06 0.04 -1.17 -2.12 0.00 0.00 175.29 171.99 2pzf s LEU 453 N -4.01 3.50 -0.25 2.90 2.96 -1.26 -1.11 118.68 121.41 2pzf s LEU 453 Ca 0.50 -0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 53.78 2pzf s LEU 453 Cb -0.10 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 2pzf s LEU 453 CO 0.34 -0.11 0.15 -0.22 -1.32 0.00 0.00 176.35 175.19 2pzf s LEU 454 N 1.51 4.01 -0.10 -0.68 2.96 0.17 -1.12 118.68 125.43 2pzf s LEU 454 Ca 0.04 0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 53.84 2pzf s LEU 454 Cb -0.16 -2.08 -0.05 0.00 0.50 0.00 0.00 46.19 44.40 2pzf s LEU 454 CO 0.01 0.04 0.40 0.00 -1.32 0.00 0.00 176.35 175.48 2pzf s ALA 455 N 1.22 3.57 -0.23 5.97 0.00 -0.10 -0.74 121.76 131.45 2pzf s ALA 455 Ca 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 2pzf s ALA 455 Cb -0.14 -2.50 0.01 0.00 0.00 0.00 0.00 23.12 20.50 2pzf s ALA 455 CO 0.06 0.15 -0.07 0.08 0.00 0.00 0.00 175.76 175.97 2pzf s VAL 456 N 0.16 2.94 0.34 0.00 1.01 -0.14 -0.55 120.40 124.16 2pzf s VAL 456 Ca 0.22 -0.84 0.09 0.00 0.00 0.00 0.00 61.98 61.46 2pzf s VAL 456 Cb -0.15 -2.41 -0.07 0.00 0.00 0.00 0.00 36.38 33.75 2pzf s VAL 456 CO 0.09 0.31 -0.09 0.00 0.00 0.00 0.00 175.10 175.41 2pzf s ALA 457 N 1.37 2.92 0.00 5.51 0.00 0.15 -1.35 121.76 130.36 2pzf s ALA 457 Ca 0.03 -2.09 0.00 0.00 0.00 0.00 0.00 51.96 49.90 2pzf s ALA 457 Cb -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2pzf s ALA 457 CO -0.05 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2pzf n GLY 458 N -0.79 3.15 3.92 0.00 0.00 -1.26 -0.60 105.19 109.61 2pzf n GLY 458 Ca -0.05 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 2pzf n GLY 458 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pzf s SER 459 N 0.00 3.68 0.13 1.61 1.04 -1.26 -4.89 113.70 114.01 2pzf s SER 459 Ca 0.00 0.41 -0.34 0.00 0.48 0.00 0.00 55.95 56.50 2pzf s SER 459 Cb 0.00 -0.63 -0.13 0.00 0.10 0.00 0.00 66.02 65.36 2pzf s SER 459 CO 0.00 -2.38 1.64 1.07 0.98 0.00 0.00 173.24 174.54 2pzf n THR 460 N -3.55 0.09 -0.73 2.02 5.66 -1.26 -1.98 114.28 114.53 2pzf n THR 460 Ca 0.13 -0.02 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 2pzf n THR 460 Cb 0.60 -1.63 0.00 0.00 -1.55 0.00 0.00 70.33 67.75 2pzf n THR 460 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2pzf n GLY 461 N 3.61 0.68 0.24 1.09 0.00 -1.26 -4.94 105.19 104.61 2pzf n GLY 461 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 2pzf n GLY 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pzf h ALA 462 N 0.00 1.00 0.00 4.61 0.00 -1.74 -3.43 119.26 119.70 2pzf h ALA 462 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2pzf h ALA 462 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2pzf h ALA 462 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2pzf n GLY 463 N 0.36 1.64 0.19 0.00 0.00 -1.26 -0.87 105.19 105.26 2pzf n GLY 463 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 2pzf n GLY 463 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pzf h LYS 464 N 0.02 -0.40 -0.57 1.61 1.57 -1.91 -0.80 116.57 116.10 2pzf h LYS 464 Ca 0.00 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2pzf h LYS 464 Cb 0.00 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2pzf h LYS 464 CO 0.00 -0.16 0.28 1.15 -0.57 0.00 0.00 179.45 180.15 2pzf h THR 465 N -0.58 1.20 -0.98 -0.16 2.02 -1.99 -2.52 112.91 109.91 2pzf h THR 465 Ca -0.04 -0.56 0.14 0.00 0.77 0.00 0.00 66.41 66.72 2pzf h THR 465 Cb 0.42 0.53 -0.08 0.00 -1.74 0.00 0.00 68.15 67.27 2pzf h THR 465 CO 0.07 0.23 0.62 0.28 0.37 0.00 0.00 175.52 177.08 2pzf h SER 466 N 0.77 0.83 -0.45 4.18 0.02 -1.95 0.15 113.55 117.09 2pzf h SER 466 Ca 0.20 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2pzf h SER 466 Cb 0.10 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2pzf h SER 466 CO -0.03 0.42 0.28 0.25 -1.14 0.00 0.00 176.83 176.61 2pzf h LEU 467 N 0.88 0.54 -0.72 5.07 5.85 -0.72 -0.66 115.31 125.55 2pzf h LEU 467 Ca 0.50 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.20 2pzf h LEU 467 Cb 0.62 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 2pzf h LEU 467 CO -0.27 0.42 0.46 -0.07 -0.34 0.00 0.00 178.44 178.64 2pzf h LEU 468 N 0.61 0.78 -1.43 2.25 3.38 -0.98 -2.49 115.31 117.43 2pzf h LEU 468 Ca 0.16 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.21 2pzf h LEU 468 Cb -0.03 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 2pzf h LEU 468 CO -0.03 0.55 0.47 0.24 0.09 0.00 0.00 178.44 179.76 2pzf h MET 469 N 0.92 0.65 -0.17 1.13 2.86 -0.13 -1.98 114.93 118.20 2pzf h MET 469 Ca 0.28 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 2pzf h MET 469 Cb -0.04 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 2pzf h MET 469 CO -0.09 0.43 -0.04 0.52 1.06 0.00 0.00 176.91 178.79 2pzf h MET 470 N 0.67 0.33 -0.85 1.72 2.86 -0.71 0.24 114.93 119.18 2pzf h MET 470 Ca 0.32 -0.13 0.11 0.00 -2.06 0.00 0.00 59.70 57.94 2pzf h MET 470 Cb 0.38 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 2pzf h MET 470 CO -0.11 0.60 0.55 0.82 1.06 0.00 0.00 176.91 179.84 2pzf h ILE 471 N 0.03 0.92 -0.03 -1.22 2.04 -1.13 -0.47 117.51 117.65 2pzf h ILE 471 Ca 0.04 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2pzf h ILE 471 Cb 0.48 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2pzf h ILE 471 CO 0.02 0.14 0.00 0.23 0.00 0.00 0.00 178.15 178.54 2pzf n MET 472 N -4.53 1.24 -1.04 2.37 2.81 -0.78 -4.92 117.12 112.28 2pzf n MET 472 Ca 0.15 -0.36 -0.01 0.00 -1.81 0.00 0.00 57.70 55.67 2pzf n MET 472 Cb 0.37 -1.43 -0.01 0.00 -0.71 0.00 0.00 33.22 31.44 2pzf n MET 472 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2pzf n GLY 473 N 1.00 0.49 0.08 3.03 0.00 -0.19 -4.90 105.19 104.70 2pzf n GLY 473 Ca 0.19 -0.24 -0.04 0.00 0.00 0.00 0.00 46.02 45.93 2pzf n GLY 473 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2pzf h GLU 474 N 0.57 0.00 -5.16 1.61 4.39 -1.18 -3.42 114.58 111.39 2pzf h GLU 474 Ca -0.03 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.00 2pzf h GLU 474 Cb 0.24 0.00 -0.34 0.00 -0.10 0.00 0.00 28.75 28.55 2pzf h GLU 474 CO 0.04 0.81 -0.86 -1.17 -1.16 0.00 0.00 179.01 176.67 2pzf s LEU 475 N -6.57 2.17 -0.07 1.33 2.96 -1.04 -4.97 118.68 112.49 2pzf s LEU 475 Ca 0.01 -0.60 -0.05 0.00 -0.22 0.00 0.00 54.13 53.28 2pzf s LEU 475 Cb 0.09 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 45.27 2pzf s LEU 475 CO 0.80 0.06 0.14 -1.61 -1.32 0.00 0.00 176.35 174.41 2pzf s GLU 476 N 0.96 3.37 0.47 1.98 2.02 -1.26 -4.17 118.70 122.06 2pzf s GLU 476 Ca -0.03 -0.25 -0.23 0.00 0.02 0.00 0.00 54.97 54.48 2pzf s GLU 476 Cb -0.15 -3.10 -0.07 0.00 0.10 0.00 0.00 34.13 30.91 2pzf s GLU 476 CO -0.05 0.73 1.15 -1.25 0.02 0.00 0.00 175.26 175.86 2pzf s PRO 477 N -1.39 3.73 0.02 0.39 0.04 -1.26 -4.61 135.00 131.93 2pzf s PRO 477 Ca 0.20 1.74 -0.09 0.00 0.04 0.00 0.00 61.00 62.89 2pzf s PRO 477 Cb -0.12 -2.37 -0.31 0.00 0.04 0.00 0.00 34.50 31.74 2pzf s PRO 477 CO 0.10 -0.56 0.93 0.77 0.04 0.00 0.00 177.00 178.27 2pzf h SER 478 N 1.97 0.58 -4.02 6.66 0.02 -1.55 -3.47 113.55 113.73 2pzf h SER 478 Ca -0.49 -0.70 -0.37 0.00 -0.84 0.00 0.00 61.79 59.38 2pzf h SER 478 Cb 1.25 -0.19 -0.17 0.00 0.14 0.00 0.00 62.40 63.43 2pzf h SER 478 CO 0.60 1.57 -0.74 -1.61 -1.14 0.00 0.00 176.83 175.51 2pzf s GLU 479 N -2.61 1.02 0.50 3.45 8.01 -1.16 -5.02 118.70 122.89 2pzf s GLU 479 Ca -0.09 -1.31 0.00 0.00 0.01 0.00 0.00 54.97 53.58 2pzf s GLU 479 Cb 0.06 -0.76 0.00 0.00 -4.31 0.00 0.00 34.13 29.12 2pzf s GLU 479 CO 0.89 0.13 0.00 0.41 0.01 0.00 0.00 175.26 176.69 2pzf n GLY 480 N 0.25 -2.17 2.89 -1.39 0.00 -1.22 -2.35 105.19 101.20 2pzf n GLY 480 Ca -0.13 -1.69 -0.12 0.00 0.00 0.00 0.00 46.02 44.08 2pzf n GLY 480 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pzf s LYS 481 N -0.20 0.08 -0.15 1.61 2.47 -0.40 -4.92 119.74 118.23 2pzf s LYS 481 Ca 0.00 -0.07 0.00 0.00 -1.56 0.00 0.00 55.97 54.34 2pzf s LYS 481 Cb 0.00 -0.05 0.02 0.00 -1.46 0.00 0.00 37.83 36.34 2pzf s LYS 481 CO 0.00 0.01 -0.14 0.42 0.16 0.00 0.00 175.35 175.81 2pzf s ILE 482 N -0.12 1.54 -0.19 5.43 1.01 -1.26 -0.79 121.20 126.82 2pzf s ILE 482 Ca -0.01 -0.62 -0.03 0.00 0.00 0.00 0.00 60.65 60.00 2pzf s ILE 482 Cb -0.01 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 2pzf s ILE 482 CO -0.00 0.45 -0.07 -0.54 0.00 0.00 0.00 174.94 174.77 2pzf s LYS 483 N 1.50 3.40 -0.23 2.79 -0.14 -0.02 -4.99 119.74 122.04 2pzf s LYS 483 Ca 0.05 -0.64 -0.16 0.00 -1.36 0.00 0.00 55.97 53.86 2pzf s LYS 483 Cb -0.13 -2.88 0.07 0.00 -1.68 0.00 0.00 37.83 33.21 2pzf s LYS 483 CO -0.11 -0.04 0.58 -1.58 -0.76 0.00 0.00 175.35 173.45 2pzf s HIS 484 N 1.04 -0.80 -0.13 3.18 5.04 -1.26 -1.88 115.29 120.48 2pzf s HIS 484 Ca 0.00 1.72 -0.01 0.00 -1.54 0.00 0.00 55.06 55.23 2pzf s HIS 484 Cb -0.15 0.40 0.04 0.00 0.04 0.00 0.00 32.58 32.91 2pzf s HIS 484 CO -0.01 -0.41 -0.01 0.45 -2.34 0.00 0.00 174.74 172.43 2pzf s SER 485 N 1.13 2.25 0.00 9.88 0.15 -1.26 -5.11 113.70 120.74 2pzf s SER 485 Ca -0.06 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2pzf s SER 485 Cb -0.06 -0.63 0.00 0.00 -1.71 0.00 0.00 66.02 63.62 2pzf s SER 485 CO -0.11 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2pzf n GLY 486 N 5.04 2.60 3.71 9.45 0.00 -1.26 -5.08 105.19 119.65 2pzf n GLY 486 Ca -0.09 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 2pzf n GLY 486 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2pzf s ARG 487 N -2.05 4.44 -0.17 1.61 3.52 -1.26 -4.89 118.95 120.14 2pzf s ARG 487 Ca 0.00 1.68 -0.08 0.00 -0.13 0.00 0.00 55.73 57.20 2pzf s ARG 487 Cb 0.00 -3.42 -0.05 0.00 -1.56 0.00 0.00 34.95 29.93 2pzf s ARG 487 CO 0.00 -0.26 0.12 0.42 -0.81 0.00 0.00 175.30 174.77 2pzf s ILE 488 N 1.31 5.31 -0.18 4.11 1.01 -1.26 -0.25 121.20 131.26 2pzf s ILE 488 Ca 0.57 0.15 -0.04 0.00 0.00 0.00 0.00 60.65 61.33 2pzf s ILE 488 Cb -0.27 -3.38 -0.02 0.00 0.01 0.00 0.00 42.46 38.80 2pzf s ILE 488 CO 0.27 0.50 -0.04 -0.55 0.00 0.00 0.00 174.94 175.13 2pzf s SER 489 N -0.10 4.63 -0.12 3.58 0.15 0.12 -4.98 113.70 116.99 2pzf s SER 489 Ca 0.10 -0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.56 2pzf s SER 489 Cb -0.11 -1.77 0.00 0.00 -1.71 0.00 0.00 66.02 62.43 2pzf s SER 489 CO 0.00 0.10 -0.23 0.12 1.20 0.00 0.00 173.24 174.43 2pzf s PHE 490 N 0.77 2.62 -0.33 3.44 5.36 -1.26 -0.20 117.98 128.38 2pzf s PHE 490 Ca -0.01 -1.19 -0.05 0.00 -0.96 0.00 0.00 56.93 54.72 2pzf s PHE 490 Cb -0.14 -1.76 0.04 0.00 -0.34 0.00 0.00 43.02 40.81 2pzf s PHE 490 CO 0.02 -0.51 0.07 0.00 -1.46 0.00 0.00 175.22 173.34 2pzf s SER 492 N 1.36 6.69 0.27 0.00 0.15 -1.26 -0.83 113.70 120.08 2pzf s SER 492 Ca -0.03 1.51 0.21 0.00 0.70 0.00 0.00 55.95 58.35 2pzf s SER 492 Cb -0.20 -2.48 1.02 0.00 -1.71 0.00 0.00 66.02 62.66 2pzf s SER 492 CO 0.02 -0.48 1.64 0.00 1.20 0.00 0.00 173.24 175.61 2pzf n GLN 493 N -1.24 0.15 0.07 5.44 6.02 -1.24 -1.85 117.38 124.73 2pzf n GLN 493 Ca 0.06 0.54 0.13 0.00 -0.01 0.00 0.00 57.00 57.72 2pzf n GLN 493 Cb 0.54 -1.89 0.43 0.00 1.02 0.00 0.00 30.24 30.34 2pzf n GLN 493 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2pzf n PHE 494 N -2.19 0.64 -3.89 1.08 3.01 -1.26 -4.98 117.46 109.87 2pzf n PHE 494 Ca 0.00 0.18 -0.39 0.00 1.01 0.00 0.00 57.45 58.26 2pzf n PHE 494 Cb 0.11 -0.78 0.03 0.00 -0.01 0.00 0.00 39.48 38.83 2pzf n PHE 494 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2pzf n SER 495 N -2.03 -4.72 -4.76 4.37 7.64 -0.77 -4.82 113.62 108.52 2pzf n SER 495 Ca 0.06 -1.15 -0.41 0.00 1.01 0.00 0.00 58.87 58.37 2pzf n SER 495 Cb 0.41 -2.38 -0.01 0.00 -1.01 0.00 0.00 64.21 61.21 2pzf n SER 495 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2pzf s TRP 496 N -3.46 2.71 -0.13 1.43 0.52 -1.26 -4.85 118.94 113.90 2pzf s TRP 496 Ca 0.45 0.90 0.02 0.00 0.02 0.00 0.00 56.10 57.49 2pzf s TRP 496 Cb -0.21 -4.05 0.00 0.00 -1.15 0.00 0.00 33.47 28.06 2pzf s TRP 496 CO 0.92 -3.40 -0.20 0.42 0.02 0.00 0.00 176.95 174.71 2pzf s ILE 497 N -0.34 2.33 0.20 2.03 -1.09 -1.26 -4.68 121.20 118.39 2pzf s ILE 497 Ca 0.60 -0.91 -0.04 0.00 -2.23 0.00 0.00 60.65 58.07 2pzf s ILE 497 Cb -0.47 -1.93 -0.05 0.00 -1.58 0.00 0.00 42.46 38.42 2pzf s ILE 497 CO 0.52 0.54 0.44 -0.04 -1.23 0.00 0.00 174.94 175.18 2pzf s MET 498 N 0.58 3.62 0.12 2.79 -1.94 -1.26 -1.89 119.30 121.32 2pzf s MET 498 Ca -0.11 -0.09 -0.31 0.00 -1.71 0.00 0.00 55.69 53.47 2pzf s MET 498 Cb -0.16 -2.77 -0.09 0.00 2.01 0.00 0.00 34.83 33.81 2pzf s MET 498 CO 0.03 0.37 1.66 -2.14 -0.01 0.00 0.00 175.02 174.94 2pzf s PRO 499 N -3.07 4.19 0.00 2.03 0.02 -1.26 -4.63 135.00 132.27 2pzf s PRO 499 Ca 0.42 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.85 2pzf s PRO 499 Cb -0.11 -3.43 0.00 0.00 0.02 0.00 0.00 34.50 30.98 2pzf s PRO 499 CO 0.27 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 2pzf n GLY 500 N 3.97 0.84 3.75 0.52 0.00 -0.64 -4.97 105.19 108.66 2pzf n GLY 500 Ca 0.16 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 2pzf n GLY 500 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pzf s THR 501 N -1.42 2.22 0.15 2.61 -4.23 -1.26 0.15 115.64 113.87 2pzf s THR 501 Ca 0.00 0.07 -0.17 0.00 -1.18 0.00 0.00 61.69 60.42 2pzf s THR 501 Cb 0.00 -2.73 0.01 0.00 1.34 0.00 0.00 72.50 71.12 2pzf s THR 501 CO 0.00 -0.09 1.75 0.40 -0.54 0.00 0.00 174.62 176.13 2pzf h ILE 502 N -1.55 0.90 -0.15 2.99 2.04 -1.23 -1.23 117.51 119.28 2pzf h ILE 502 Ca -0.51 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.28 2pzf h ILE 502 Cb 1.32 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2pzf h ILE 502 CO 0.60 0.05 0.05 0.50 0.00 0.00 0.00 178.15 179.35 2pzf h LYS 503 N 0.25 0.13 -0.97 2.37 3.64 -1.71 -2.40 116.57 117.88 2pzf h LYS 503 Ca 0.15 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2pzf h LYS 503 Cb 0.13 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.86 2pzf h LYS 503 CO -0.16 0.08 0.63 0.93 -2.27 0.00 0.00 179.45 178.66 2pzf h GLU 504 N 0.13 1.17 -0.13 1.90 5.08 -1.81 -0.15 114.58 120.77 2pzf h GLU 504 Ca 0.07 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2pzf h GLU 504 Cb 0.04 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 2pzf h GLU 504 CO -0.07 0.78 0.08 -0.91 -1.00 0.00 0.00 179.01 177.89 2pzf h ASN 505 N 1.21 0.15 0.08 1.42 2.35 -0.95 -2.41 115.58 117.42 2pzf h ASN 505 Ca 0.39 -0.01 -0.28 0.00 -0.55 0.00 0.00 56.30 55.86 2pzf h ASN 505 Cb 0.04 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2pzf h ASN 505 CO -0.13 0.12 -1.48 0.40 -1.65 0.00 0.00 177.43 174.68 2pzf h ILE 506 N 0.18 0.91 0.00 2.81 2.04 -0.84 -3.43 117.51 119.17 2pzf h ILE 506 Ca 0.05 -2.31 -0.24 0.00 1.00 0.00 0.00 64.86 63.35 2pzf h ILE 506 Cb -0.00 2.53 -0.05 0.00 -0.74 0.00 0.00 36.82 38.56 2pzf h ILE 506 CO -0.01 0.63 -2.03 2.30 0.00 0.00 0.00 178.15 179.04 2pzf n ILE 507 N -3.98 1.09 0.00 -0.67 -5.35 -0.15 -4.40 119.36 105.91 2pzf n ILE 507 Ca -0.29 -0.75 0.00 0.00 -0.27 0.00 0.00 62.75 61.45 2pzf n ILE 507 Cb 0.86 -0.49 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 2pzf n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pzf n GLY 509 N 1.56 1.09 0.14 3.28 0.00 -0.91 -3.49 105.19 106.86 2pzf n GLY 509 Ca -0.21 0.48 -0.21 0.00 0.00 0.00 0.00 46.02 46.08 2pzf n GLY 509 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2pzf n VAL 510 N 0.00 1.76 -3.81 1.61 3.14 -1.26 -4.88 118.33 114.89 2pzf n VAL 510 Ca 0.00 -0.65 -0.36 0.00 -2.96 0.00 0.00 64.34 60.37 2pzf n VAL 510 Cb 0.00 -1.70 -0.13 0.00 -1.06 0.00 0.00 33.84 30.94 2pzf n VAL 510 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2pzf s SER 511 N -6.99 4.82 -0.30 6.55 0.01 -1.23 -5.08 113.70 111.48 2pzf s SER 511 Ca -0.23 -0.34 -0.19 0.00 1.31 0.00 0.00 55.95 56.49 2pzf s SER 511 Cb 0.07 -1.85 -0.01 0.00 0.21 0.00 0.00 66.02 64.44 2pzf s SER 511 CO 0.76 -0.05 0.58 -0.47 0.41 0.00 0.00 173.24 174.46 2pzf s TYR 512 N 1.55 3.22 -0.31 2.43 5.04 -1.26 -4.91 117.35 123.11 2pzf s TYR 512 Ca 0.06 0.53 0.02 0.00 -2.44 0.00 0.00 57.07 55.24 2pzf s TYR 512 Cb -0.15 -2.90 0.09 0.00 0.35 0.00 0.00 41.96 39.35 2pzf s TYR 512 CO 0.01 -0.43 0.05 0.34 -1.34 0.00 0.00 175.55 174.18 2pzf s ASP 513 N 1.63 4.35 0.24 4.32 -1.08 -1.26 -5.02 116.67 119.85 2pzf s ASP 513 Ca 0.23 -1.79 -0.06 0.00 -0.52 0.00 0.00 52.55 50.41 2pzf s ASP 513 Cb -0.15 -1.28 0.25 0.00 -1.46 0.00 0.00 42.92 40.28 2pzf s ASP 513 CO 0.11 -0.36 1.86 1.05 0.52 0.00 0.00 175.17 178.35 2pzf h GLU 514 N 7.84 1.20 -0.27 4.34 -0.00 -1.99 0.45 114.58 126.15 2pzf h GLU 514 Ca -0.10 -0.15 -0.07 0.00 -0.00 0.00 0.00 59.36 59.04 2pzf h GLU 514 Cb 1.03 -0.23 -0.01 0.00 -0.00 0.00 0.00 28.75 29.54 2pzf h GLU 514 CO 0.48 0.89 -0.10 -0.92 -0.00 0.00 0.00 179.01 179.37 2pzf h TYR 515 N 1.20 0.62 -0.58 2.06 3.20 -1.99 -1.47 116.97 120.01 2pzf h TYR 515 Ca 0.30 -0.14 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2pzf h TYR 515 Cb 0.06 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2pzf h TYR 515 CO 0.01 0.77 0.13 -0.09 -1.64 0.00 0.00 178.16 177.35 2pzf h ARG 516 N 0.29 0.93 0.24 1.82 2.43 -1.93 -1.70 114.38 116.47 2pzf h ARG 516 Ca 0.07 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 2pzf h ARG 516 Cb 0.59 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2pzf h ARG 516 CO 0.03 0.86 -0.12 -0.92 -1.51 0.00 0.00 179.97 178.32 2pzf h TYR 517 N 0.83 -0.30 -0.92 2.20 3.20 -0.84 -1.15 116.97 119.99 2pzf h TYR 517 Ca 0.18 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.06 2pzf h TYR 517 Cb 0.36 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.68 2pzf h TYR 517 CO 0.03 -0.15 0.60 0.00 -1.64 0.00 0.00 178.16 177.00 2pzf h ARG 518 N -0.38 1.18 -0.41 1.82 2.47 -1.23 0.34 114.38 118.18 2pzf h ARG 518 Ca -0.03 -0.07 -0.12 0.00 -1.26 0.00 0.00 59.98 58.50 2pzf h ARG 518 Cb 0.29 -0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2pzf h ARG 518 CO 0.05 0.78 -0.22 0.66 0.56 0.00 0.00 179.97 181.80 2pzf h SER 519 N 1.21 0.83 -0.29 7.04 4.64 -1.13 -1.96 113.55 123.89 2pzf h SER 519 Ca 0.34 -0.30 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 2pzf h SER 519 Cb -0.09 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.76 2pzf h SER 519 CO -0.08 1.02 -0.12 0.58 -0.87 0.00 0.00 176.83 177.35 2pzf h VAL 520 N 0.71 1.29 -0.65 0.95 2.07 -0.70 -2.17 116.25 117.75 2pzf h VAL 520 Ca 0.10 -1.21 0.09 0.00 0.82 0.00 0.00 66.70 66.49 2pzf h VAL 520 Cb 0.75 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.93 2pzf h VAL 520 CO 0.06 0.38 0.30 0.40 0.02 0.00 0.00 177.57 178.73 2pzf h ILE 521 N 0.34 0.84 -0.25 4.57 1.08 -0.83 0.22 117.51 123.48 2pzf h ILE 521 Ca 0.07 -0.18 -0.04 0.00 -0.39 0.00 0.00 64.86 64.32 2pzf h ILE 521 Cb 0.64 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 2pzf h ILE 521 CO 0.04 0.10 0.02 0.11 -0.69 0.00 0.00 178.15 177.72 2pzf h LYS 522 N 0.53 0.43 -0.05 2.37 1.57 -1.34 -0.59 116.57 119.48 2pzf h LYS 522 Ca 0.32 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.85 2pzf h LYS 522 Cb 0.33 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2pzf h LYS 522 CO -0.26 0.58 -0.51 0.00 -0.57 0.00 0.00 179.45 178.70 2pzf h ALA 523 N 0.83 1.06 -0.24 3.86 0.00 -0.77 -2.14 119.26 121.85 2pzf h ALA 523 Ca 0.07 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2pzf h ALA 523 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2pzf h ALA 523 CO 0.01 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.91 2pzf n GLN 525 N 0.25 -5.17 0.00 0.00 1.13 -0.80 -4.90 117.38 107.89 2pzf n GLN 525 Ca 0.09 0.60 0.05 0.00 -1.94 0.00 0.00 57.00 55.80 2pzf n GLN 525 Cb 0.34 -5.31 -0.02 0.00 0.11 0.00 0.00 30.24 25.35 2pzf n GLN 525 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2pzf n LEU 526 N -4.51 0.98 0.08 1.08 4.77 -0.24 -4.64 117.00 114.51 2pzf n LEU 526 Ca -0.11 -0.68 -0.13 0.00 -0.03 0.00 0.00 56.01 55.06 2pzf n LEU 526 Cb 0.60 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.61 2pzf n LEU 526 CO 0.73 0.20 0.78 -0.33 -1.33 0.00 0.00 177.39 177.44 2pzf h GLU 527 N 0.77 -0.13 -0.38 3.23 5.08 -1.88 -0.93 114.58 120.34 2pzf h GLU 527 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2pzf h GLU 527 Cb 0.31 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2pzf h GLU 527 CO 0.00 0.01 0.25 0.93 -1.00 0.00 0.00 179.01 179.20 2pzf h GLU 528 N -0.24 0.51 -0.25 2.33 5.08 -1.94 -2.07 114.58 118.00 2pzf h GLU 528 Ca -0.01 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2pzf h GLU 528 Cb 0.20 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.26 2pzf h GLU 528 CO 0.02 0.35 -0.30 -0.44 -1.00 0.00 0.00 179.01 177.65 2pzf h ASP 529 N 0.51 -0.96 0.51 1.42 3.32 -1.78 -2.14 116.42 117.31 2pzf h ASP 529 Ca 0.14 0.16 -0.05 0.00 0.02 0.00 0.00 57.03 57.29 2pzf h ASP 529 Cb -0.04 0.43 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2pzf h ASP 529 CO -0.03 -0.32 -0.26 0.16 -1.72 0.00 0.00 179.24 177.07 2pzf h ILE 530 N -0.31 0.86 0.00 0.35 3.07 -1.08 -2.45 117.51 117.95 2pzf h ILE 530 Ca 0.13 -1.01 0.00 0.00 1.55 0.00 0.00 64.86 65.53 2pzf h ILE 530 Cb 0.52 1.60 0.00 0.00 -0.27 0.00 0.00 36.82 38.67 2pzf h ILE 530 CO -0.42 0.25 0.00 -1.20 -1.05 0.00 0.00 178.15 175.73 2pzf n SER 531 N -3.75 0.00 -0.00 2.16 7.64 -0.79 -2.69 113.62 116.19 2pzf n SER 531 Ca -0.01 -0.57 0.08 0.00 1.01 0.00 0.00 58.87 59.37 2pzf n SER 531 Cb 0.36 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.45 2pzf n SER 531 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2pzf n LYS 532 N -0.85 0.96 -3.42 1.43 4.01 -0.92 -4.95 118.16 114.42 2pzf n LYS 532 Ca 0.07 -0.10 -0.38 0.00 -0.51 0.00 0.00 58.31 57.40 2pzf n LYS 532 Cb 0.03 -1.32 -0.06 0.00 -0.51 0.00 0.00 35.03 33.17 2pzf n LYS 532 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2pzf s PHE 533 N -2.87 3.63 0.27 2.13 0.08 -1.09 -4.99 117.98 115.13 2pzf s PHE 533 Ca -0.02 0.94 -0.01 0.00 0.12 0.00 0.00 56.93 57.95 2pzf s PHE 533 Cb 0.10 -2.41 0.60 0.00 -0.57 0.00 0.00 43.02 40.74 2pzf s PHE 533 CO 0.64 0.42 1.65 0.00 -0.10 0.00 0.00 175.22 177.83 2pzf h ALA 534 N 5.64 1.10 -0.67 5.36 0.00 -1.92 0.00 119.26 128.77 2pzf h ALA 534 Ca -0.46 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2pzf h ALA 534 Cb 1.20 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2pzf h ALA 534 CO 0.68 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.90 2pzf n GLU 535 N -5.23 3.64 0.00 0.00 1.02 -1.26 -5.05 120.64 113.76 2pzf n GLU 535 Ca 0.18 -2.88 0.00 0.00 -0.02 0.00 0.00 57.16 54.44 2pzf n GLU 535 Cb 0.59 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 2pzf n GLU 535 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2pzf n LYS 536 N 1.22 0.00 0.00 3.49 -0.00 -0.02 -1.22 118.16 121.63 2pzf n LYS 536 Ca 0.26 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.64 2pzf n LYS 536 Cb 0.87 0.00 0.42 0.00 -0.00 0.00 0.00 35.03 36.32 2pzf n LYS 536 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2pzf n ASP 537 N 2.23 0.00 -0.83 -5.58 5.75 -1.26 -2.55 116.55 114.32 2pzf n ASP 537 Ca 0.00 -1.36 0.10 0.00 -0.01 0.00 0.00 54.79 53.52 2pzf n ASP 537 Cb 0.00 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.37 2pzf n ASP 537 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2pzf n ASN 538 N -0.75 2.46 -4.72 -1.12 3.02 -0.36 -1.92 115.26 111.87 2pzf n ASN 538 Ca 0.11 -1.88 -0.42 0.00 -0.03 0.00 0.00 54.58 52.36 2pzf n ASN 538 Cb 0.05 -0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 2pzf n ASN 538 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2pzf s ILE 539 N -1.58 2.94 -0.00 2.41 1.10 -1.06 -4.83 121.20 120.18 2pzf s ILE 539 Ca 0.34 0.71 -0.25 0.00 -0.51 0.00 0.00 60.65 60.94 2pzf s ILE 539 Cb 0.19 -3.45 -0.05 0.00 0.15 0.00 0.00 42.46 39.30 2pzf s ILE 539 CO 0.27 0.07 0.76 -0.69 -2.11 0.00 0.00 174.94 173.24 2pzf s VAL 540 N 0.77 4.86 0.08 4.00 1.01 -1.26 -2.58 120.40 127.28 2pzf s VAL 540 Ca 0.64 1.60 0.04 0.00 0.00 0.00 0.00 61.98 64.27 2pzf s VAL 540 Cb -0.40 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 2pzf s VAL 540 CO 0.34 0.30 0.02 -0.76 0.00 0.00 0.00 175.10 175.01 2pzf s LEU 541 N 0.37 3.57 0.00 3.92 1.43 0.12 -4.92 118.68 123.16 2pzf s LEU 541 Ca 0.40 -0.12 -0.10 0.00 -1.03 0.00 0.00 54.13 53.28 2pzf s LEU 541 Cb -0.19 -2.28 0.19 0.00 0.03 0.00 0.00 46.19 43.93 2pzf s LEU 541 CO 0.22 0.18 1.17 0.61 0.23 0.00 0.00 176.35 178.75 2pzf n GLY 542 N 0.56 -0.64 3.77 -3.19 0.00 -1.26 -1.62 105.19 102.81 2pzf n GLY 542 Ca -0.10 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 2pzf n GLY 542 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2pzf s GLU 543 N -5.52 4.38 0.00 1.61 2.12 -1.26 -2.35 118.70 117.68 2pzf s GLU 543 Ca 0.70 1.95 0.00 0.00 0.36 0.00 0.00 54.97 57.99 2pzf s GLU 543 Cb -0.03 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.36 2pzf s GLU 543 CO 0.48 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.54 2pzf n GLY 544 N 0.90 2.86 3.08 -1.50 0.00 -0.79 -4.31 105.19 105.42 2pzf n GLY 544 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 2pzf n GLY 544 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pzf n GLY 545 N -1.21 -0.98 0.32 -0.02 0.00 -0.99 -4.70 105.19 97.61 2pzf n GLY 545 Ca 0.00 0.51 0.10 0.00 0.00 0.00 0.00 46.02 46.62 2pzf n GLY 545 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2pzf h ILE 546 N -0.93 0.96 -0.23 -0.61 2.04 -1.82 -1.39 117.51 115.52 2pzf h ILE 546 Ca -0.53 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2pzf h ILE 546 Cb 1.27 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 2pzf h ILE 546 CO 0.39 0.05 0.00 0.35 0.00 0.00 0.00 178.15 178.94 2pzf n THR 547 N -4.48 0.30 -3.88 -0.27 -2.24 -1.26 -4.87 114.28 97.58 2pzf n THR 547 Ca 0.04 -0.38 -0.28 0.00 -2.27 0.00 0.00 64.05 61.16 2pzf n THR 547 Cb 0.24 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.73 2pzf n THR 547 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2pzf s LEU 548 N -1.34 4.32 0.80 3.22 1.43 -0.53 -5.11 118.68 121.47 2pzf s LEU 548 Ca 0.28 0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.55 2pzf s LEU 548 Cb 0.15 -3.00 0.07 0.00 0.03 0.00 0.00 46.19 43.45 2pzf s LEU 548 CO 0.22 0.08 1.10 -0.94 0.23 0.00 0.00 176.35 177.04 2pzf s SER 549 N -2.91 4.19 0.20 2.29 1.04 -1.26 -4.85 113.70 112.40 2pzf s SER 549 Ca 0.36 1.91 -0.11 0.00 0.48 0.00 0.00 55.95 58.59 2pzf s SER 549 Cb -0.12 -2.53 0.25 0.00 0.10 0.00 0.00 66.02 63.72 2pzf s SER 549 CO 0.28 -2.25 1.73 1.23 0.98 0.00 0.00 173.24 175.22 2pzf h GLY 550 N -1.23 0.77 1.65 7.32 0.00 -1.95 -1.96 103.07 107.67 2pzf h GLY 550 Ca -0.44 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 2pzf h GLY 550 CO 0.49 -0.04 -0.37 -1.33 0.00 0.00 0.00 176.54 175.30 2pzf h GLY 551 N 0.34 0.42 0.82 4.60 0.00 -1.93 -2.08 103.07 105.25 2pzf h GLY 551 Ca 0.29 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 2pzf h GLY 551 CO -0.32 0.35 -0.02 1.46 0.00 0.00 0.00 176.54 178.02 2pzf h GLN 552 N 0.33 -0.06 -0.57 4.80 4.20 -1.87 -1.76 115.11 120.17 2pzf h GLN 552 Ca 0.04 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.84 2pzf h GLN 552 Cb 0.80 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.52 2pzf h GLN 552 CO 0.06 0.13 0.18 -0.09 -0.67 0.00 0.00 178.83 178.44 2pzf h ARG 553 N -0.24 0.33 -0.46 1.46 2.43 -1.33 -0.09 114.38 116.49 2pzf h ARG 553 Ca -0.01 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2pzf h ARG 553 Cb 0.22 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2pzf h ARG 553 CO 0.01 0.22 0.29 0.00 -1.51 0.00 0.00 179.97 178.98 2pzf h ALA 554 N 1.41 0.58 -0.25 2.80 0.00 -1.33 -1.82 119.26 120.66 2pzf h ALA 554 Ca 0.29 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 2pzf h ALA 554 Cb 0.38 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2pzf h ALA 554 CO -0.32 -0.00 -0.31 0.00 0.00 0.00 0.00 179.25 178.61 2pzf h ARG 555 N 0.59 0.51 -0.31 0.00 3.08 -0.85 -1.80 114.38 115.60 2pzf h ARG 555 Ca 0.17 -0.22 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 2pzf h ARG 555 Cb -0.03 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 2pzf h ARG 555 CO -0.06 0.76 -0.30 0.82 -1.07 0.00 0.00 179.97 180.13 2pzf h ILE 556 N 0.44 1.30 -0.61 2.04 2.04 -0.81 0.71 117.51 122.61 2pzf h ILE 556 Ca 0.05 -1.46 0.03 0.00 1.00 0.00 0.00 64.86 64.48 2pzf h ILE 556 Cb 0.76 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 2pzf h ILE 556 CO 0.06 0.47 0.37 0.28 0.00 0.00 0.00 178.15 179.33 2pzf h SER 557 N 0.50 0.59 -0.22 1.72 0.02 -1.30 -0.74 113.55 114.11 2pzf h SER 557 Ca 0.05 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2pzf h SER 557 Cb 0.87 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.29 2pzf h SER 557 CO 0.07 0.40 0.06 0.25 -1.14 0.00 0.00 176.83 176.48 2pzf h LEU 558 N 0.72 0.34 -0.79 5.07 5.85 -1.16 -2.61 115.31 122.73 2pzf h LEU 558 Ca 0.25 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.79 2pzf h LEU 558 Cb 0.05 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 2pzf h LEU 558 CO -0.12 0.47 0.50 0.00 -0.34 0.00 0.00 178.44 178.95 2pzf h ALA 559 N 0.88 1.05 -0.52 1.25 0.00 -0.69 -0.56 119.26 120.67 2pzf h ALA 559 Ca 0.07 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.05 2pzf h ALA 559 Cb 0.26 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.73 2pzf h ALA 559 CO -0.00 0.28 0.09 -0.09 0.00 0.00 0.00 179.25 179.53 2pzf h ARG 560 N 0.95 0.21 -0.46 0.00 2.43 -1.05 0.29 114.38 116.75 2pzf h ARG 560 Ca 0.33 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.38 2pzf h ARG 560 Cb 0.06 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2pzf h ARG 560 CO -0.13 0.14 -0.13 0.00 -1.51 0.00 0.00 179.97 178.34 2pzf h ALA 561 N 1.42 0.90 0.07 2.80 0.00 -0.87 -3.02 119.26 120.57 2pzf h ALA 561 Ca 0.26 -0.34 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 2pzf h ALA 561 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2pzf h ALA 561 CO -0.36 0.63 -1.10 0.28 0.00 0.00 0.00 179.25 178.70 2pzf h VAL 562 N 0.76 1.55 -0.77 0.00 2.07 -0.93 -3.27 116.25 115.66 2pzf h VAL 562 Ca 0.12 -3.04 -0.03 0.00 0.82 0.00 0.00 66.70 64.57 2pzf h VAL 562 Cb 0.65 2.81 -0.04 0.00 -1.52 0.00 0.00 31.29 33.19 2pzf h VAL 562 CO 0.05 0.88 0.37 0.22 0.02 0.00 0.00 177.57 179.11 2pzf h TYR 563 N 0.07 1.11 -2.84 1.57 3.20 -0.37 -3.44 116.97 116.27 2pzf h TYR 563 Ca -0.09 -0.05 -0.57 0.00 3.14 0.00 0.00 58.73 61.16 2pzf h TYR 563 Cb 1.82 -0.34 0.08 0.00 1.54 0.00 0.00 36.73 39.83 2pzf h TYR 563 CO 0.04 0.81 0.69 1.17 -1.64 0.00 0.00 178.16 179.23 2pzf n LYS 564 N -4.38 2.22 -2.65 1.82 4.81 -1.15 -4.93 118.16 113.91 2pzf n LYS 564 Ca 0.07 0.79 -0.42 0.00 -0.87 0.00 0.00 58.31 57.88 2pzf n LYS 564 Cb 0.13 -2.48 -0.03 0.00 0.02 0.00 0.00 35.03 32.67 2pzf n LYS 564 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2pzf s ASP 565 N 0.36 6.24 0.32 3.14 3.68 -1.26 -5.00 116.67 124.15 2pzf s ASP 565 Ca 0.67 -0.83 0.06 0.00 2.13 0.00 0.00 52.55 54.58 2pzf s ASP 565 Cb -0.61 -2.52 -0.06 0.00 -1.45 0.00 0.00 42.92 38.28 2pzf s ASP 565 CO 0.49 -1.65 -0.02 0.00 0.13 0.00 0.00 175.17 174.12 2pzf s ALA 566 N 5.03 2.56 -0.20 3.66 0.00 -1.26 -4.98 121.76 126.57 2pzf s ALA 566 Ca 0.33 -2.03 0.22 0.00 0.00 0.00 0.00 51.96 50.48 2pzf s ALA 566 Cb -0.09 0.27 -0.12 0.00 0.00 0.00 0.00 23.12 23.18 2pzf s ALA 566 CO 0.09 -0.12 0.84 -0.25 0.00 0.00 0.00 175.76 176.31 2pzf n ASP 567 N -0.70 0.52 -3.72 0.00 8.00 0.66 -4.89 116.55 116.42 2pzf n ASP 567 Ca -0.05 0.16 -0.13 0.00 0.71 0.00 0.00 54.79 55.48 2pzf n ASP 567 Cb 0.65 1.05 -0.14 0.00 -0.02 0.00 0.00 41.12 42.66 2pzf n ASP 567 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2pzf s LEU 568 N -4.92 0.39 -0.19 0.64 2.96 -0.63 -4.16 118.68 112.77 2pzf s LEU 568 Ca -0.03 0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 54.31 2pzf s LEU 568 Cb 0.12 0.62 -0.02 0.00 0.50 0.00 0.00 46.19 47.41 2pzf s LEU 568 CO 0.84 -0.17 -0.04 -0.31 -1.32 0.00 0.00 176.35 175.35 2pzf s TYR 569 N 1.40 2.98 -0.36 5.38 1.51 -0.34 -0.70 117.35 127.22 2pzf s TYR 569 Ca -0.08 -0.64 -0.05 0.00 -1.01 0.00 0.00 57.07 55.30 2pzf s TYR 569 Cb -0.11 -2.05 0.07 0.00 -0.11 0.00 0.00 41.96 39.76 2pzf s TYR 569 CO -0.08 -0.33 0.13 -0.51 -1.11 0.00 0.00 175.55 173.66 2pzf s LEU 570 N 1.02 4.60 -0.38 -1.29 1.43 0.72 -0.09 118.68 124.69 2pzf s LEU 570 Ca 0.01 -1.46 -0.04 0.00 -1.03 0.00 0.00 54.13 51.61 2pzf s LEU 570 Cb -0.15 -1.84 0.09 0.00 0.03 0.00 0.00 46.19 44.32 2pzf s LEU 570 CO 0.01 -0.40 0.16 -0.76 0.23 0.00 0.00 176.35 175.58 2pzf s LEU 571 N 1.30 4.89 -0.63 1.79 1.43 -0.19 0.08 118.68 127.35 2pzf s LEU 571 Ca 0.01 -1.74 -0.18 0.00 -1.03 0.00 0.00 54.13 51.19 2pzf s LEU 571 Cb -0.21 -1.83 0.12 0.00 0.03 0.00 0.00 46.19 44.30 2pzf s LEU 571 CO -0.00 -0.47 0.71 -0.62 0.23 0.00 0.00 176.35 176.20 2pzf s ASP 572 N 1.72 6.27 -1.23 2.29 -1.08 -0.01 -0.75 116.67 123.88 2pzf s ASP 572 Ca 0.04 -1.66 -0.27 0.00 -0.52 0.00 0.00 52.55 50.15 2pzf s ASP 572 Cb -0.22 -2.28 0.02 0.00 -1.46 0.00 0.00 42.92 38.98 2pzf s ASP 572 CO -0.02 -1.02 0.66 -0.24 0.52 0.00 0.00 175.17 175.06 2pzf n SER 573 N 5.94 -3.94 0.00 -0.34 2.88 -0.99 -3.70 113.62 113.47 2pzf n SER 573 Ca -0.06 -1.20 0.11 0.00 -1.33 0.00 0.00 58.87 56.39 2pzf n SER 573 Cb 0.43 -2.25 0.58 0.00 -0.75 0.00 0.00 64.21 62.22 2pzf n SER 573 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2pzf n PRO 574 N -4.74 0.30 -0.19 -1.46 -0.04 -1.26 -3.78 135.00 123.82 2pzf n PRO 574 Ca -0.13 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.49 2pzf n PRO 574 Cb 0.59 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.74 2pzf n PRO 574 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2pzf n PHE 575 N -1.31 0.51 -0.35 0.54 3.72 -1.26 -4.70 117.46 114.61 2pzf n PHE 575 Ca 0.11 -0.34 0.10 0.00 -0.05 0.00 0.00 57.45 57.27 2pzf n PHE 575 Cb 0.20 -0.01 0.29 0.00 -0.94 0.00 0.00 39.48 39.02 2pzf n PHE 575 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2pzf h GLY 576 N 3.34 1.69 -3.04 1.37 0.00 -1.97 -1.72 103.07 102.74 2pzf h GLY 576 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2pzf h GLY 576 CO 0.00 0.05 0.00 -1.72 0.00 0.00 0.00 176.54 174.87 2pzf n TYR 577 N -4.69 1.58 -3.89 5.60 0.53 -1.26 -4.95 117.16 110.08 2pzf n TYR 577 Ca 0.21 -0.66 -0.33 0.00 -1.02 0.00 0.00 57.90 56.11 2pzf n TYR 577 Cb 0.47 -0.31 -0.05 0.00 -1.03 0.00 0.00 39.34 38.42 2pzf n TYR 577 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 2pzf s LEU 578 N -2.14 4.36 0.81 7.72 1.43 -0.65 -4.13 118.68 126.09 2pzf s LEU 578 Ca 0.51 0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.84 2pzf s LEU 578 Cb 0.35 -2.76 0.08 0.00 0.03 0.00 0.00 46.19 43.89 2pzf s LEU 578 CO 0.21 0.22 1.09 1.51 0.23 0.00 0.00 176.35 179.62 2pzf s ASP 579 N -2.13 4.16 0.32 2.29 1.47 -1.26 -4.80 116.67 116.72 2pzf s ASP 579 Ca 0.30 1.77 0.04 0.00 1.18 0.00 0.00 52.55 55.85 2pzf s ASP 579 Cb -0.13 -2.45 0.65 0.00 -0.34 0.00 0.00 42.92 40.66 2pzf s ASP 579 CO 0.22 -2.25 1.88 -0.37 0.68 0.00 0.00 175.17 175.33 2pzf h VAL 580 N -1.27 0.94 0.08 2.11 -1.51 -1.99 -1.66 116.25 112.95 2pzf h VAL 580 Ca -0.45 -0.30 -0.00 0.00 -1.23 0.00 0.00 66.70 64.71 2pzf h VAL 580 Cb 1.24 -0.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2pzf h VAL 580 CO 0.51 0.16 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.90 2pzf h LEU 581 N 0.88 -0.09 -1.23 4.19 4.07 -1.99 -1.13 115.31 120.00 2pzf h LEU 581 Ca 0.44 -0.36 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2pzf h LEU 581 Cb 0.47 0.02 -0.04 0.00 1.08 0.00 0.00 40.66 42.20 2pzf h LEU 581 CO -0.20 0.32 0.46 0.74 -1.08 0.00 0.00 178.44 178.68 2pzf h THR 582 N -0.53 1.20 -0.13 0.22 2.02 -1.92 -1.67 112.91 112.10 2pzf h THR 582 Ca -0.01 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 2pzf h THR 582 Cb 0.45 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2pzf h THR 582 CO 0.02 0.20 0.04 -0.08 0.37 0.00 0.00 175.52 176.07 2pzf h GLU 583 N 1.00 0.20 -0.32 6.66 4.81 -1.15 -1.46 114.58 124.31 2pzf h GLU 583 Ca 0.27 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.51 2pzf h GLU 583 Cb -0.08 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.22 2pzf h GLU 583 CO -0.05 0.34 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.33 2pzf h LYS 584 N 0.02 0.06 -0.64 1.92 3.64 -1.00 0.53 116.57 121.10 2pzf h LYS 584 Ca 0.04 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 2pzf h LYS 584 Cb 0.23 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.99 2pzf h LYS 584 CO -0.00 0.04 0.39 0.93 -2.27 0.00 0.00 179.45 178.54 2pzf h GLU 585 N 0.07 0.73 0.04 1.90 4.39 -1.09 -0.94 114.58 119.68 2pzf h GLU 585 Ca 0.15 -0.04 -0.26 0.00 0.34 0.00 0.00 59.36 59.55 2pzf h GLU 585 Cb 0.21 -0.16 0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2pzf h GLU 585 CO -0.27 0.48 -1.02 0.82 -1.16 0.00 0.00 179.01 177.85 2pzf h ILE 586 N 0.75 1.31 -0.50 3.13 2.04 -1.08 0.13 117.51 123.30 2pzf h ILE 586 Ca 0.26 -2.28 0.06 0.00 1.00 0.00 0.00 64.86 63.90 2pzf h ILE 586 Cb 0.06 2.52 -0.05 0.00 -0.74 0.00 0.00 36.82 38.61 2pzf h ILE 586 CO -0.12 0.70 0.20 0.15 0.00 0.00 0.00 178.15 179.07 2pzf h PHE 587 N 0.26 0.35 0.08 1.37 3.04 -0.80 0.13 116.94 121.37 2pzf h PHE 587 Ca -0.14 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.83 2pzf h PHE 587 Cb 1.70 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 40.12 2pzf h PHE 587 CO 0.12 0.13 -0.04 0.93 -2.02 0.00 0.00 178.31 177.43 2pzf h GLU 588 N 0.39 -0.10 0.07 1.11 5.08 -1.12 0.71 114.58 120.71 2pzf h GLU 588 Ca 0.23 0.01 -0.25 0.00 -1.00 0.00 0.00 59.36 58.35 2pzf h GLU 588 Cb 0.22 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2pzf h GLU 588 CO -0.22 0.38 -1.11 0.77 -1.00 0.00 0.00 179.01 177.83 2pzf h SER 589 N -0.63 0.47 0.00 1.42 0.02 -0.71 -2.11 113.55 112.02 2pzf h SER 589 Ca -0.01 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2pzf h SER 589 Cb 0.52 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2pzf h SER 589 CO 0.02 1.29 -0.06 0.00 -1.14 0.00 0.00 176.83 176.94 2pzf h VAL 591 N -0.12 1.22 0.15 0.00 2.07 -1.22 -0.68 116.25 117.66 2pzf h VAL 591 Ca 0.00 -0.74 -0.30 0.00 0.82 0.00 0.00 66.70 66.49 2pzf h VAL 591 Cb 0.06 1.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2pzf h VAL 591 CO 0.00 0.25 -1.37 0.00 0.02 0.00 0.00 177.57 176.48 2pzf n LYS 593 N -3.55 0.28 -0.25 0.00 4.01 -0.80 -3.72 118.16 114.13 2pzf n LYS 593 Ca -0.12 0.11 -0.01 0.00 -0.51 0.00 0.00 58.31 57.77 2pzf n LYS 593 Cb 1.05 -0.96 0.10 0.00 -0.51 0.00 0.00 35.03 34.71 2pzf n LYS 593 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 2pzf h LEU 594 N -0.53 0.67 -3.42 -0.35 5.85 -0.83 -2.47 115.31 114.23 2pzf h LEU 594 Ca 0.00 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 2pzf h LEU 594 Cb 0.53 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 2pzf h LEU 594 CO 0.00 0.44 0.12 0.23 -0.34 0.00 0.00 178.44 178.89 2pzf n MET 595 N -4.71 4.07 -0.20 1.25 2.81 -0.29 -4.67 117.12 115.38 2pzf n MET 595 Ca 0.09 -2.83 0.21 0.00 -1.81 0.00 0.00 57.70 53.36 2pzf n MET 595 Cb 0.15 -2.17 0.57 0.00 -0.71 0.00 0.00 33.22 31.06 2pzf n MET 595 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2pzf h ALA 596 N 3.28 2.36 -0.39 3.04 0.00 -1.52 -1.51 119.26 124.52 2pzf h ALA 596 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2pzf h ALA 596 Cb 2.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2pzf h ALA 596 CO 0.56 -0.62 0.00 0.09 0.00 0.00 0.00 179.25 179.28 2pzf n ASN 597 N -4.45 3.39 -4.89 0.00 5.03 -1.26 -4.86 115.26 108.23 2pzf n ASN 597 Ca 0.18 -1.97 -0.34 0.00 0.87 0.00 0.00 54.58 53.32 2pzf n ASN 597 Cb 0.73 -0.25 -0.05 0.00 -1.02 0.00 0.00 39.78 39.19 2pzf n ASN 597 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2pzf s LYS 598 N -1.38 3.51 -0.07 3.52 -0.14 -0.57 -4.11 119.74 120.50 2pzf s LYS 598 Ca 0.37 -0.20 -0.30 0.00 -1.36 0.00 0.00 55.97 54.49 2pzf s LYS 598 Cb 0.22 -3.08 -0.03 0.00 -1.68 0.00 0.00 37.83 33.25 2pzf s LYS 598 CO 0.30 0.66 1.23 0.99 -0.76 0.00 0.00 175.35 177.76 2pzf s THR 599 N -1.32 4.21 -0.02 2.17 2.01 -1.26 -4.11 115.64 117.33 2pzf s THR 599 Ca 0.27 1.53 0.00 0.00 0.31 0.00 0.00 61.69 63.81 2pzf s THR 599 Cb -0.13 -3.99 0.02 0.00 0.01 0.00 0.00 72.50 68.42 2pzf s THR 599 CO 0.17 -0.02 0.00 -0.13 -0.69 0.00 0.00 174.62 173.95 2pzf s ARG 600 N 2.44 0.23 -0.20 4.92 0.52 -0.27 -1.20 118.95 125.38 2pzf s ARG 600 Ca 0.56 0.07 -0.01 0.00 -0.52 0.00 0.00 55.73 55.83 2pzf s ARG 600 Cb -0.25 -0.40 0.01 0.00 0.52 0.00 0.00 34.95 34.83 2pzf s ARG 600 CO 0.21 -0.12 -0.12 0.42 0.02 0.00 0.00 175.30 175.71 2pzf s ILE 601 N 0.88 2.69 -0.25 1.52 1.01 0.87 -0.65 121.20 127.27 2pzf s ILE 601 Ca -0.09 -0.76 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 2pzf s ILE 601 Cb -0.12 -2.20 0.00 0.00 0.01 0.00 0.00 42.46 40.15 2pzf s ILE 601 CO -0.02 0.46 0.01 -0.22 0.00 0.00 0.00 174.94 175.17 2pzf s LEU 602 N 1.37 3.32 -0.49 2.97 2.96 0.08 -1.02 118.68 127.87 2pzf s LEU 602 Ca 0.05 -0.56 -0.29 0.00 -0.22 0.00 0.00 54.13 53.11 2pzf s LEU 602 Cb -0.14 -1.79 0.03 0.00 0.50 0.00 0.00 46.19 44.79 2pzf s LEU 602 CO -0.08 -0.10 1.20 -0.69 -1.32 0.00 0.00 176.35 175.37 2pzf s VAL 603 N 1.47 4.11 -0.09 1.68 1.01 0.07 -0.97 120.40 127.67 2pzf s VAL 603 Ca 0.04 1.10 -0.29 0.00 0.00 0.00 0.00 61.98 62.83 2pzf s VAL 603 Cb -0.16 -4.55 0.07 0.00 0.00 0.00 0.00 36.38 31.74 2pzf s VAL 603 CO -0.01 -1.03 0.67 0.28 0.00 0.00 0.00 175.10 175.01 2pzf s THR 604 N 4.77 0.00 -0.51 3.92 -1.32 -0.46 -2.35 115.64 119.69 2pzf s THR 604 Ca 0.50 -0.02 0.04 0.00 -1.21 0.00 0.00 61.69 61.00 2pzf s THR 604 Cb -0.08 -0.97 0.04 0.00 -1.51 0.00 0.00 72.50 69.98 2pzf s THR 604 CO 0.31 -0.01 0.68 -1.20 -2.21 0.00 0.00 174.62 172.19 2pzf n SER 605 N 1.31 1.46 -4.66 8.08 7.64 -1.26 -3.57 113.62 122.62 2pzf n SER 605 Ca -0.18 -1.26 -0.42 0.00 1.01 0.00 0.00 58.87 58.02 2pzf n SER 605 Cb 0.57 -0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.73 2pzf n SER 605 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2pzf s LYS 606 N -0.42 4.08 0.38 1.43 2.47 -1.26 -4.89 119.74 121.53 2pzf s LYS 606 Ca 0.05 2.43 0.08 0.00 -1.56 0.00 0.00 55.97 56.98 2pzf s LYS 606 Cb 0.04 -4.12 0.83 0.00 -1.46 0.00 0.00 37.83 33.11 2pzf s LYS 606 CO 0.05 -1.00 1.95 0.52 0.16 0.00 0.00 175.35 177.03 2pzf h MET 607 N 10.56 0.64 -0.50 4.03 2.86 -1.99 -0.31 114.93 130.21 2pzf h MET 607 Ca -0.46 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.14 2pzf h MET 607 Cb 1.22 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.71 2pzf h MET 607 CO 0.95 0.42 0.30 0.93 1.06 0.00 0.00 176.91 180.57 2pzf h GLU 608 N 0.66 0.68 0.05 1.72 5.08 -2.00 -1.52 114.58 119.25 2pzf h GLU 608 Ca 0.33 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.42 2pzf h GLU 608 Cb 0.41 -0.15 0.02 0.00 0.50 0.00 0.00 28.75 29.53 2pzf h GLU 608 CO -0.11 0.48 -0.85 0.45 -1.00 0.00 0.00 179.01 177.97 2pzf h HIS 609 N 0.69 0.76 -1.00 4.33 3.86 -1.49 -3.26 115.15 119.05 2pzf h HIS 609 Ca 0.18 -0.45 0.09 0.00 -1.16 0.00 0.00 60.37 59.03 2pzf h HIS 609 Cb -0.02 -0.07 -0.08 0.00 1.06 0.00 0.00 27.41 28.30 2pzf h HIS 609 CO 0.00 1.29 0.64 -0.07 0.86 0.00 0.00 177.93 180.65 2pzf h LEU 610 N 0.01 0.98 -1.33 2.43 3.38 -1.02 -1.35 115.31 118.41 2pzf h LEU 610 Ca -0.12 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.00 2pzf h LEU 610 Cb 1.57 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 42.08 2pzf h LEU 610 CO 0.17 0.57 0.55 0.50 0.09 0.00 0.00 178.44 180.32 2pzf h LYS 611 N 1.08 0.67 -0.01 1.13 3.64 -1.32 -2.42 116.57 119.35 2pzf h LYS 611 Ca 0.46 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 2pzf h LYS 611 Cb 0.33 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2pzf h LYS 611 CO -0.22 0.44 -0.36 1.63 -2.27 0.00 0.00 179.45 178.68 2pzf n LYS 612 N -4.53 0.58 -2.53 1.90 4.01 -0.54 -4.90 118.16 112.14 2pzf n LYS 612 Ca 0.16 -0.35 -0.37 0.00 -0.51 0.00 0.00 58.31 57.24 2pzf n LYS 612 Cb 0.41 -1.49 -0.04 0.00 -0.51 0.00 0.00 35.03 33.40 2pzf n LYS 612 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2pzf s ALA 613 N -2.67 3.11 0.08 7.82 0.00 -0.91 -4.97 121.76 124.22 2pzf s ALA 613 Ca 0.20 0.72 -0.16 0.00 0.00 0.00 0.00 51.96 52.72 2pzf s ALA 613 Cb 0.19 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 19.88 2pzf s ALA 613 CO 0.59 -0.22 1.31 -0.44 0.00 0.00 0.00 175.76 176.99 2pzf h ASP 614 N 2.59 0.74 -4.76 0.00 3.32 -1.44 -3.43 116.42 113.44 2pzf h ASP 614 Ca -0.48 -0.58 -0.24 0.00 0.02 0.00 0.00 57.03 55.75 2pzf h ASP 614 Cb 1.22 -0.22 -0.19 0.00 0.22 0.00 0.00 39.33 40.36 2pzf h ASP 614 CO 0.63 1.20 -0.72 -0.54 -1.72 0.00 0.00 179.24 178.09 2pzf s LYS 615 N -3.91 0.62 -0.03 3.56 -0.14 -0.96 -4.62 119.74 114.25 2pzf s LYS 615 Ca -0.12 -0.97 0.04 0.00 -1.36 0.00 0.00 55.97 53.56 2pzf s LYS 615 Cb 0.07 -0.20 -0.00 0.00 -1.68 0.00 0.00 37.83 36.02 2pzf s LYS 615 CO 0.85 0.01 -0.14 0.42 -0.76 0.00 0.00 175.35 175.72 2pzf s ILE 616 N -2.30 1.18 -0.18 2.17 1.01 0.15 -0.92 121.20 122.31 2pzf s ILE 616 Ca -0.02 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.05 2pzf s ILE 616 Cb -0.04 -1.01 0.04 0.00 0.01 0.00 0.00 42.46 41.46 2pzf s ILE 616 CO -0.02 0.34 -0.11 -0.22 0.00 0.00 0.00 174.94 174.94 2pzf s LEU 617 N 0.01 2.07 -0.30 2.97 2.96 0.29 -1.70 118.68 124.97 2pzf s LEU 617 Ca -0.02 -0.77 -0.12 0.00 -0.22 0.00 0.00 54.13 53.01 2pzf s LEU 617 Cb -0.09 -1.19 -0.04 0.00 0.50 0.00 0.00 46.19 45.37 2pzf s LEU 617 CO 0.01 -0.13 0.21 -0.63 -1.32 0.00 0.00 176.35 174.49 2pzf s ILE 618 N 1.44 5.30 0.20 6.68 1.01 0.64 -0.68 121.20 135.80 2pzf s ILE 618 Ca 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 60.65 60.59 2pzf s ILE 618 Cb -0.15 -3.59 -0.07 0.00 0.01 0.00 0.00 42.46 38.65 2pzf s ILE 618 CO -0.09 0.16 0.56 -0.76 0.00 0.00 0.00 174.94 174.82 2pzf s LEU 619 N 1.76 4.23 -0.11 2.97 1.43 0.23 -0.18 118.68 129.00 2pzf s LEU 619 Ca 0.07 1.00 -0.04 0.00 -1.03 0.00 0.00 54.13 54.14 2pzf s LEU 619 Cb -0.16 -3.55 0.05 0.00 0.03 0.00 0.00 46.19 42.56 2pzf s LEU 619 CO 0.11 -0.01 0.15 -2.28 0.23 0.00 0.00 176.35 174.55 2pzf s HIS 620 N -1.69 -0.13 -1.57 0.29 2.46 0.63 -4.29 115.29 111.00 2pzf s HIS 620 Ca 0.44 0.39 -0.04 0.00 0.47 0.00 0.00 55.06 56.32 2pzf s HIS 620 Cb -0.13 -0.35 0.04 0.00 -0.13 0.00 0.00 32.58 32.01 2pzf s HIS 620 CO 0.20 -0.35 0.11 0.39 -2.47 0.00 0.00 174.74 172.62 2pzf n GLU 621 N 5.32 -0.90 0.00 2.88 1.02 -1.26 -0.36 120.64 127.34 2pzf n GLU 621 Ca -0.05 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2pzf n GLU 621 Cb 0.50 -3.68 0.00 0.00 -0.02 0.00 0.00 31.44 28.23 2pzf n GLU 621 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pzf n GLY 622 N -2.26 2.20 3.96 0.62 0.00 -0.05 -4.96 105.19 104.71 2pzf n GLY 622 Ca -0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 2pzf n GLY 622 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pzf s SER 623 N -2.59 6.32 -0.58 1.61 0.01 0.52 -0.75 113.70 118.24 2pzf s SER 623 Ca 0.00 0.13 -0.28 0.00 1.31 0.00 0.00 55.95 57.11 2pzf s SER 623 Cb 0.00 -1.89 0.02 0.00 0.21 0.00 0.00 66.02 64.37 2pzf s SER 623 CO 0.00 -0.06 1.28 -0.55 0.41 0.00 0.00 173.24 174.32 2pzf s SER 624 N -3.81 6.32 0.12 2.44 0.15 -1.26 -0.27 113.70 117.39 2pzf s SER 624 Ca 0.35 0.15 -0.04 0.00 0.70 0.00 0.00 55.95 57.12 2pzf s SER 624 Cb -0.09 -2.55 -0.13 0.00 -1.71 0.00 0.00 66.02 61.54 2pzf s SER 624 CO 0.29 -1.58 1.27 0.22 1.20 0.00 0.00 173.24 174.65 2pzf h TYR 625 N 10.13 0.54 -2.12 3.44 5.03 -0.87 -3.47 116.97 129.66 2pzf h TYR 625 Ca -0.26 -0.32 -0.04 0.00 2.58 0.00 0.00 58.73 60.69 2pzf h TYR 625 Cb 1.07 -0.05 -0.22 0.00 1.55 0.00 0.00 36.73 39.08 2pzf h TYR 625 CO 1.04 1.16 0.04 0.12 -1.32 0.00 0.00 178.16 179.20 2pzf s PHE 626 N -3.11 -0.81 -0.05 -3.82 5.36 -1.08 -4.98 117.98 109.49 2pzf s PHE 626 Ca -0.05 1.85 -0.01 0.00 -0.96 0.00 0.00 56.93 57.76 2pzf s PHE 626 Cb 0.09 0.34 0.03 0.00 -0.34 0.00 0.00 43.02 43.13 2pzf s PHE 626 CO 0.87 -0.39 0.03 -0.47 -1.46 0.00 0.00 175.22 173.79 2pzf s TYR 627 N 0.69 0.30 -3.85 10.12 5.04 -1.26 -0.26 117.35 128.14 2pzf s TYR 627 Ca -0.03 0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 2pzf s TYR 627 Cb -0.05 -0.55 0.00 0.00 0.35 0.00 0.00 41.96 41.72 2pzf s TYR 627 CO -0.04 -0.21 0.00 0.41 -1.34 0.00 0.00 175.55 174.36 2pzf n GLY 628 N 4.90 -0.60 3.96 8.97 0.00 -0.69 -5.01 105.19 116.72 2pzf n GLY 628 Ca -0.11 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2pzf n GLY 628 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pzf s THR 629 N -3.00 2.44 0.27 2.61 -4.23 -1.26 0.35 115.64 112.81 2pzf s THR 629 Ca 0.00 -0.50 0.04 0.00 -1.18 0.00 0.00 61.69 60.05 2pzf s THR 629 Cb 0.00 -2.94 0.03 0.00 1.34 0.00 0.00 72.50 70.93 2pzf s THR 629 CO 0.00 0.00 1.67 0.15 -0.54 0.00 0.00 174.62 175.90 2pzf h PHE 630 N -0.29 0.40 -0.41 3.99 3.57 -1.84 -2.46 116.94 119.90 2pzf h PHE 630 Ca -0.42 -0.11 -0.03 0.00 3.53 0.00 0.00 57.97 60.93 2pzf h PHE 630 Cb 1.30 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 2pzf h PHE 630 CO 0.25 0.70 0.13 1.03 -2.23 0.00 0.00 178.31 178.18 2pzf h SER 631 N 0.28 0.61 -0.43 0.41 0.87 -1.94 -1.47 113.55 111.88 2pzf h SER 631 Ca 0.03 -0.21 0.08 0.00 -1.23 0.00 0.00 61.79 60.46 2pzf h SER 631 Cb 0.84 -0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.57 2pzf h SER 631 CO 0.07 0.66 -0.00 -0.33 -0.53 0.00 0.00 176.83 176.69 2pzf h GLU 632 N 0.53 0.11 -0.44 2.24 5.08 -1.91 -1.70 114.58 118.48 2pzf h GLU 632 Ca 0.13 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2pzf h GLU 632 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2pzf h GLU 632 CO -0.00 0.07 0.18 1.25 -1.00 0.00 0.00 179.01 179.51 2pzf h LEU 633 N 0.11 0.61 -0.71 1.33 5.85 -1.11 -2.68 115.31 118.71 2pzf h LEU 633 Ca 0.21 -0.17 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 2pzf h LEU 633 Cb 0.30 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2pzf h LEU 633 CO -0.35 0.61 -0.44 1.56 -0.34 0.00 0.00 178.44 179.47 2pzf h GLN 634 N 0.57 0.00 0.00 1.25 1.08 -1.21 -2.91 115.11 113.89 2pzf h GLN 634 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2pzf h GLN 634 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2pzf h GLN 634 CO -0.01 0.44 0.00 0.09 -0.95 0.00 0.00 178.83 178.40 2pzf n ASN 635 N -3.48 0.71 -0.38 1.46 4.13 -0.65 -5.11 115.26 111.95 2pzf n ASN 635 Ca 0.00 0.64 0.14 0.00 1.68 0.00 0.00 54.58 57.04 2pzf n ASN 635 Cb 0.58 -0.80 0.61 0.00 -1.54 0.00 0.00 39.78 38.63 2pzf n ASN 635 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72