#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pzf s LEU 387 N 0.00 2.75 0.20 1.04 1.43 -1.26 -5.11 118.68 117.73 2pzf s LEU 387 Ca 0.00 -0.37 -0.21 0.00 -1.03 0.00 0.00 54.13 52.51 2pzf s LEU 387 Cb 0.00 -1.65 -0.08 0.00 0.03 0.00 0.00 46.19 44.49 2pzf s LEU 387 CO 0.00 0.08 0.73 0.28 0.23 0.00 0.00 176.35 177.67 2pzf s THR 388 N 0.86 4.52 -0.21 5.49 -1.32 -1.26 -5.00 115.64 118.72 2pzf s THR 388 Ca -0.03 1.41 0.20 0.00 -1.21 0.00 0.00 61.69 62.06 2pzf s THR 388 Cb -0.15 -3.94 0.48 0.00 -1.51 0.00 0.00 72.50 67.38 2pzf s THR 388 CO 0.00 0.32 1.14 1.07 -2.21 0.00 0.00 174.62 174.95 2pzf n THR 389 N 1.05 1.27 -2.12 5.08 5.66 -1.26 -5.09 114.28 118.87 2pzf n THR 389 Ca -0.04 -2.75 -0.42 0.00 -3.05 0.00 0.00 64.05 57.79 2pzf n THR 389 Cb 0.50 0.73 -0.03 0.00 -1.55 0.00 0.00 70.33 69.98 2pzf n THR 389 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2pzf s THR 390 N -3.09 3.10 -0.24 1.09 2.01 -1.26 -0.80 115.64 116.45 2pzf s THR 390 Ca 0.33 0.82 -0.01 0.00 0.31 0.00 0.00 61.69 63.14 2pzf s THR 390 Cb 0.35 -3.52 -0.15 0.00 0.01 0.00 0.00 72.50 69.19 2pzf s THR 390 CO -0.06 0.08 -0.23 -0.62 -0.69 0.00 0.00 174.62 173.10 2pzf n GLU 391 N 3.60 0.59 -4.41 4.92 -0.58 0.20 -4.83 120.64 120.13 2pzf n GLU 391 Ca 0.11 0.16 -0.21 0.00 -0.42 0.00 0.00 57.16 56.79 2pzf n GLU 391 Cb 0.41 -1.47 -0.16 0.00 -0.57 0.00 0.00 31.44 29.66 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 -2.48 0.83 -0.06 2.62 1.01 -0.98 -4.17 120.40 117.18 2pzf s VAL 392 Ca -0.33 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.31 2pzf s VAL 392 Cb 0.09 -0.76 0.02 0.00 0.00 0.00 0.00 36.38 35.74 2pzf s VAL 392 CO 0.53 0.27 -0.07 -0.69 0.00 0.00 0.00 175.10 175.14 2pzf s VAL 393 N 0.39 0.75 -0.13 2.92 1.01 0.39 -0.50 120.40 125.22 2pzf s VAL 393 Ca -0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 2pzf s VAL 393 Cb -0.11 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 2pzf s VAL 393 CO 0.01 0.28 -0.10 -0.04 0.00 0.00 0.00 175.10 175.25 2pzf s MET 394 N 0.96 3.43 -0.22 2.72 -1.94 0.04 -0.26 119.30 124.03 2pzf s MET 394 Ca -0.10 -0.63 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 2pzf s MET 394 Cb -0.15 -2.71 0.05 0.00 2.01 0.00 0.00 34.83 34.04 2pzf s MET 394 CO 0.00 0.25 -0.06 -1.21 -0.01 0.00 0.00 175.02 174.00 2pzf s GLU 395 N 0.28 1.61 -1.51 2.03 2.02 0.03 -1.89 118.70 121.26 2pzf s GLU 395 Ca -0.07 -0.88 -0.08 0.00 0.02 0.00 0.00 54.97 53.96 2pzf s GLU 395 Cb -0.15 -2.46 0.06 0.00 0.10 0.00 0.00 34.13 31.68 2pzf s GLU 395 CO 0.05 -0.55 0.66 -1.71 0.02 0.00 0.00 175.26 173.73 2pzf n ASN 396 N 4.72 -2.15 -4.68 -0.19 4.05 -1.10 -1.19 115.26 114.72 2pzf n ASN 396 Ca -0.12 -0.95 -0.41 0.00 0.45 0.00 0.00 54.58 53.55 2pzf n ASN 396 Cb 0.45 -3.22 -0.04 0.00 1.23 0.00 0.00 39.78 38.20 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 -3.61 4.94 0.04 3.44 1.01 -0.46 -3.09 120.40 122.68 2pzf s VAL 397 Ca 0.35 1.53 0.07 0.00 0.00 0.00 0.00 61.98 63.93 2pzf s VAL 397 Cb -0.19 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 2pzf s VAL 397 CO 0.88 0.10 -0.19 -0.89 0.00 0.00 0.00 175.10 175.01 2pzf s THR 398 N 1.72 1.52 -0.03 3.92 2.01 -0.71 -0.81 115.64 123.27 2pzf s THR 398 Ca 0.37 -1.14 -0.19 0.00 0.31 0.00 0.00 61.69 61.04 2pzf s THR 398 Cb -0.17 -1.33 0.04 0.00 0.01 0.00 0.00 72.50 71.05 2pzf s THR 398 CO 0.14 0.16 0.41 0.00 -0.69 0.00 0.00 174.62 174.64 2pzf s ALA 399 N -0.80 -1.06 -0.04 7.40 0.00 -0.50 0.52 121.76 127.28 2pzf s ALA 399 Ca 0.06 0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.68 2pzf s ALA 399 Cb -0.08 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2pzf s ALA 399 CO 0.02 -0.29 -0.19 -0.06 0.00 0.00 0.00 175.76 175.23 2pzf s PHE 400 N -1.26 1.89 -1.40 0.00 0.40 -1.26 -1.64 117.98 114.71 2pzf s PHE 400 Ca -0.13 -0.53 0.23 0.00 -0.60 0.00 0.00 56.93 55.91 2pzf s PHE 400 Cb -0.04 -1.26 1.17 0.00 0.51 0.00 0.00 43.02 43.40 2pzf s PHE 400 CO 0.06 -0.16 1.77 0.91 0.70 0.00 0.00 175.22 178.50 2pzf n TRP 401 N 3.02 0.00 -2.66 0.36 7.02 -1.26 -4.90 117.44 119.01 2pzf n TRP 401 Ca -0.17 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.27 2pzf n TRP 401 Cb 0.53 -0.30 0.11 0.00 -2.42 0.00 0.00 31.31 29.23 2pzf n TRP 401 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2pzf n GLY 404 N 0.71 -1.48 0.00 6.99 0.00 -1.26 -5.17 105.19 104.99 2pzf n GLY 404 Ca 0.11 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.99 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 0.65 -0.86 3.87 -0.02 0.00 -1.26 -5.15 105.19 102.43 2pzf n GLY 437 Ca -0.04 0.61 -0.36 0.00 0.00 0.00 0.00 46.02 46.23 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 0.99 5.40 0.26 2.61 -1.32 -1.26 -5.08 115.64 117.24 2pzf s THR 438 Ca 0.00 0.06 -0.29 0.00 -1.21 0.00 0.00 61.69 60.24 2pzf s THR 438 Cb 0.00 -3.40 -0.09 0.00 -1.51 0.00 0.00 72.50 67.50 2pzf s THR 438 CO 0.00 0.53 1.24 -2.16 -2.21 0.00 0.00 174.62 172.02 2pzf s PRO 439 N -1.30 4.45 0.14 7.08 0.04 -1.26 -4.69 135.00 139.46 2pzf s PRO 439 Ca 0.19 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.29 2pzf s PRO 439 Cb -0.12 -3.16 -0.12 0.00 0.04 0.00 0.00 34.50 31.14 2pzf s PRO 439 CO 0.08 -0.10 1.31 -0.24 0.04 0.00 0.00 177.00 178.10 2pzf h VAL 440 N 3.36 1.60 -3.80 -0.36 3.04 -1.68 -3.45 116.25 114.97 2pzf h VAL 440 Ca -0.46 -3.04 -0.38 0.00 -1.01 0.00 0.00 66.70 61.81 2pzf h VAL 440 Cb 1.22 2.70 -0.30 0.00 -2.01 0.00 0.00 31.29 32.90 2pzf h VAL 440 CO 0.71 0.88 -0.77 -0.76 -1.01 0.00 0.00 177.57 176.61 2pzf s LEU 441 N -7.05 1.78 -0.02 3.16 1.43 -1.16 -4.02 118.68 112.80 2pzf s LEU 441 Ca -0.01 -0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2pzf s LEU 441 Cb 0.10 -0.40 0.03 0.00 0.03 0.00 0.00 46.19 45.95 2pzf s LEU 441 CO 0.83 0.04 0.03 -0.54 0.23 0.00 0.00 176.35 176.94 2pzf s LYS 442 N 0.20 -0.03 -1.38 1.70 -0.14 0.59 -1.41 119.74 119.27 2pzf s LYS 442 Ca -0.02 0.19 -0.03 0.00 -1.36 0.00 0.00 55.97 54.75 2pzf s LYS 442 Cb -0.07 -0.24 0.02 0.00 -1.68 0.00 0.00 37.83 35.86 2pzf s LYS 442 CO -0.00 -0.17 0.69 -0.25 -0.76 0.00 0.00 175.35 174.86 2pzf n ASP 443 N 4.17 -1.69 -4.68 2.83 10.43 -0.27 -4.45 116.55 122.89 2pzf n ASP 443 Ca -0.28 -0.86 -0.41 0.00 2.57 0.00 0.00 54.79 55.81 2pzf n ASP 443 Cb 0.50 -3.76 -0.04 0.00 1.84 0.00 0.00 41.12 39.67 2pzf n ASP 443 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2pzf s ILE 444 N -3.66 4.89 -0.08 0.53 -1.09 0.01 -4.71 121.20 117.11 2pzf s ILE 444 Ca 0.15 1.70 0.02 0.00 -2.23 0.00 0.00 60.65 60.28 2pzf s ILE 444 Cb -0.07 -4.16 0.02 0.00 -1.58 0.00 0.00 42.46 36.66 2pzf s ILE 444 CO 0.84 0.07 -0.11 0.20 -1.23 0.00 0.00 174.94 174.70 2pzf s ASN 445 N 1.08 1.87 0.08 3.58 0.01 -1.26 -1.35 114.94 118.95 2pzf s ASN 445 Ca 0.41 -0.30 -0.26 0.00 -0.71 0.00 0.00 52.86 51.99 2pzf s ASN 445 Cb -0.17 -0.84 0.08 0.00 0.41 0.00 0.00 41.25 40.73 2pzf s ASN 445 CO 0.15 0.00 0.88 0.72 -1.51 0.00 0.00 177.10 177.35 2pzf s PHE 446 N 0.88 -0.27 0.04 2.20 -0.12 -0.79 -4.98 117.98 114.93 2pzf s PHE 446 Ca -0.10 0.05 0.01 0.00 -0.05 0.00 0.00 56.93 56.84 2pzf s PHE 446 Cb -0.15 0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 2pzf s PHE 446 CO 0.01 -0.71 -0.06 0.15 -0.05 0.00 0.00 175.22 174.56 2pzf s LYS 447 N -3.27 0.49 -0.04 1.99 -0.14 -1.26 -0.78 119.74 116.72 2pzf s LYS 447 Ca 0.08 -0.76 0.01 0.00 -1.36 0.00 0.00 55.97 53.94 2pzf s LYS 447 Cb -0.01 -0.16 0.02 0.00 -1.68 0.00 0.00 37.83 36.00 2pzf s LYS 447 CO -0.04 0.01 -0.06 -1.50 -0.76 0.00 0.00 175.35 173.00 2pzf s ILE 448 N -1.60 0.60 0.36 2.17 2.07 0.34 -4.98 121.20 120.16 2pzf s ILE 448 Ca -0.10 -0.19 -0.02 0.00 -1.41 0.00 0.00 60.65 58.94 2pzf s ILE 448 Cb -0.09 -0.60 -0.04 0.00 0.13 0.00 0.00 42.46 41.87 2pzf s ILE 448 CO -0.01 0.23 0.59 -1.61 -1.91 0.00 0.00 174.94 172.23 2pzf s GLU 449 N 0.73 3.53 0.30 3.50 0.41 -1.26 0.59 118.70 126.50 2pzf s GLU 449 Ca -0.10 -0.16 -0.30 0.00 -0.41 0.00 0.00 54.97 54.00 2pzf s GLU 449 Cb -0.13 -2.61 -0.12 0.00 -1.78 0.00 0.00 34.13 29.48 2pzf s GLU 449 CO 0.01 0.10 1.45 -2.13 -0.49 0.00 0.00 175.26 174.20 2pzf n ARG 450 N -1.66 2.34 -0.84 1.61 0.63 0.02 -1.96 116.66 116.80 2pzf n ARG 450 Ca -0.03 0.83 0.00 0.00 -0.92 0.00 0.00 57.85 57.73 2pzf n ARG 450 Cb 0.55 -2.51 0.00 0.00 0.45 0.00 0.00 32.46 30.95 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 1.64 1.17 3.86 5.14 0.00 -1.26 -4.91 105.19 110.82 2pzf n GLY 451 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.06 3.92 -0.25 1.61 -0.21 -0.83 -4.33 119.66 119.50 2pzf s GLN 452 Ca 0.00 0.64 -0.06 0.00 0.02 0.00 0.00 55.36 55.96 2pzf s GLN 452 Cb 0.00 -2.36 -0.02 0.00 1.00 0.00 0.00 33.01 31.63 2pzf s GLN 452 CO 0.00 0.02 0.05 -1.17 -2.12 0.00 0.00 175.29 172.06 2pzf s LEU 453 N -3.48 3.39 -0.21 2.90 2.96 -1.26 -0.90 118.68 122.08 2pzf s LEU 453 Ca 0.54 -0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 54.04 2pzf s LEU 453 Cb -0.10 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 2pzf s LEU 453 CO 0.25 -0.06 0.07 -0.22 -1.32 0.00 0.00 176.35 175.07 2pzf s LEU 454 N 1.57 3.66 -0.17 -0.68 2.96 -0.43 -0.82 118.68 124.77 2pzf s LEU 454 Ca 0.06 -0.04 -0.16 0.00 -0.22 0.00 0.00 54.13 53.77 2pzf s LEU 454 Cb -0.15 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 2pzf s LEU 454 CO 0.02 0.08 0.38 0.00 -1.32 0.00 0.00 176.35 175.51 2pzf s ALA 455 N 0.95 3.55 -0.24 5.97 0.00 -0.33 -0.75 121.76 130.90 2pzf s ALA 455 Ca 0.04 -0.43 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 2pzf s ALA 455 Cb -0.14 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.41 2pzf s ALA 455 CO 0.03 -0.11 0.01 0.08 0.00 0.00 0.00 175.76 175.77 2pzf s VAL 456 N 0.89 3.83 0.30 0.00 1.01 0.14 -0.91 120.40 125.66 2pzf s VAL 456 Ca 0.20 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.90 2pzf s VAL 456 Cb -0.14 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.41 2pzf s VAL 456 CO 0.07 0.38 -0.06 0.00 0.00 0.00 0.00 175.10 175.49 2pzf s ALA 457 N 1.54 2.51 0.00 5.51 0.00 0.27 -1.70 121.76 129.90 2pzf s ALA 457 Ca 0.06 -1.97 0.00 0.00 0.00 0.00 0.00 51.96 50.05 2pzf s ALA 457 Cb -0.15 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2pzf s ALA 457 CO 0.00 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2pzf n GLY 458 N -0.65 3.81 3.78 0.00 0.00 -1.26 -0.50 105.19 110.37 2pzf n GLY 458 Ca -0.05 -1.34 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 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 3.65 0.14 1.61 1.04 -1.26 -4.87 113.70 114.01 2pzf s SER 459 Ca 0.00 1.05 -0.35 0.00 0.48 0.00 0.00 55.95 57.13 2pzf s SER 459 Cb 0.00 -1.66 -0.15 0.00 0.10 0.00 0.00 66.02 64.31 2pzf s SER 459 CO 0.00 -2.47 1.45 1.07 0.98 0.00 0.00 173.24 174.27 2pzf n THR 460 N -3.72 0.16 -0.77 2.02 5.66 -1.26 -2.03 114.28 114.34 2pzf n THR 460 Ca 0.07 -0.04 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 2pzf n THR 460 Cb 0.58 -1.24 0.00 0.00 -1.55 0.00 0.00 70.33 68.13 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 2.88 0.80 0.23 1.09 0.00 -1.26 -4.94 105.19 104.00 2pzf n GLY 461 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 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 1.22 0.00 4.61 0.00 -1.75 -3.44 119.26 119.91 2pzf h ALA 462 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2pzf h ALA 462 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2pzf h ALA 462 CO 0.00 0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.94 2pzf n GLY 463 N -0.37 1.59 0.07 0.00 0.00 -1.26 -0.64 105.19 104.58 2pzf n GLY 463 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 -0.05 -0.61 1.61 1.57 -1.91 -0.04 116.57 117.15 2pzf h LYS 464 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2pzf h LYS 464 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2pzf h LYS 464 CO 0.00 0.27 0.07 1.15 -0.57 0.00 0.00 179.45 180.37 2pzf h THR 465 N -0.37 1.26 -0.86 -0.16 2.02 -1.99 -2.62 112.91 110.17 2pzf h THR 465 Ca -0.01 -1.03 0.05 0.00 0.77 0.00 0.00 66.41 66.20 2pzf h THR 465 Cb 0.34 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 2pzf h THR 465 CO 0.01 0.38 0.56 0.28 0.37 0.00 0.00 175.52 177.12 2pzf h SER 466 N 0.94 0.88 -0.23 4.18 0.02 -1.93 0.17 113.55 117.58 2pzf h SER 466 Ca 0.18 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2pzf h SER 466 Cb 0.45 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2pzf h SER 466 CO 0.02 0.59 0.14 0.25 -1.14 0.00 0.00 176.83 176.68 2pzf h LEU 467 N 1.01 0.27 -0.64 5.07 5.85 -0.65 -1.12 115.31 125.10 2pzf h LEU 467 Ca 0.36 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.06 2pzf h LEU 467 Cb 0.13 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2pzf h LEU 467 CO -0.12 0.23 0.40 -0.07 -0.34 0.00 0.00 178.44 178.54 2pzf h LEU 468 N 0.29 0.65 -1.40 2.25 3.38 -1.05 -2.14 115.31 117.30 2pzf h LEU 468 Ca 0.08 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.18 2pzf h LEU 468 Cb 0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2pzf h LEU 468 CO -0.02 0.45 0.52 0.24 0.09 0.00 0.00 178.44 179.73 2pzf h MET 469 N 0.78 0.60 -0.42 1.13 2.86 -0.21 -1.68 114.93 117.99 2pzf h MET 469 Ca 0.26 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.80 2pzf h MET 469 Cb 0.01 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 2pzf h MET 469 CO -0.10 0.40 0.03 0.52 1.06 0.00 0.00 176.91 178.82 2pzf h MET 470 N 0.62 0.73 -0.68 1.72 2.86 -0.56 -0.87 114.93 118.75 2pzf h MET 470 Ca 0.39 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 2pzf h MET 470 Cb 0.63 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 2pzf h MET 470 CO -0.15 0.79 0.34 0.82 1.06 0.00 0.00 176.91 179.77 2pzf h ILE 471 N 0.57 1.21 -0.00 -1.22 2.04 -1.12 -2.71 117.51 116.29 2pzf h ILE 471 Ca 0.12 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2pzf h ILE 471 Cb 0.44 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2pzf h ILE 471 CO 0.02 0.25 -0.01 0.23 0.00 0.00 0.00 178.15 178.63 2pzf n MET 472 N -4.35 0.72 -0.55 2.37 2.81 -0.68 -4.91 117.12 112.53 2pzf n MET 472 Ca 0.06 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2pzf n MET 472 Cb 0.12 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 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 1.17 0.93 0.20 3.03 0.00 -0.90 -4.92 105.19 104.70 2pzf n GLY 473 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 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 3.65 0.00 -4.10 1.61 4.39 -1.43 -3.42 114.58 115.29 2pzf h GLU 474 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 2pzf h GLU 474 Cb 0.00 0.00 -0.37 0.00 -0.10 0.00 0.00 28.75 28.28 2pzf h GLU 474 CO 0.00 0.16 -0.79 -1.17 -1.16 0.00 0.00 179.01 176.04 2pzf s LEU 475 N -6.32 1.05 0.00 1.33 0.20 -1.10 -4.96 118.68 108.87 2pzf s LEU 475 Ca 0.05 -0.24 -0.07 0.00 0.69 0.00 0.00 54.13 54.56 2pzf s LEU 475 Cb 0.06 -0.73 -0.05 0.00 -0.43 0.00 0.00 46.19 45.05 2pzf s LEU 475 CO 0.68 -0.13 0.28 -1.61 -0.29 0.00 0.00 176.35 175.27 2pzf s GLU 476 N 1.72 3.61 0.40 1.98 2.02 -1.26 -4.17 118.70 123.00 2pzf s GLU 476 Ca 0.04 -0.02 -0.25 0.00 0.02 0.00 0.00 54.97 54.76 2pzf s GLU 476 Cb -0.13 -3.09 -0.08 0.00 0.10 0.00 0.00 34.13 30.93 2pzf s GLU 476 CO -0.07 0.66 1.18 -2.14 0.02 0.00 0.00 175.26 174.91 2pzf s PRO 477 N -1.65 4.06 -0.07 0.39 0.02 -1.26 -4.53 135.00 131.96 2pzf s PRO 477 Ca 0.26 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.18 2pzf s PRO 477 Cb -0.13 -2.69 -0.25 0.00 0.02 0.00 0.00 34.50 31.44 2pzf s PRO 477 CO 0.15 -0.32 0.56 0.77 -0.33 0.00 0.00 177.00 177.82 2pzf h SER 478 N 2.67 0.22 -4.37 2.53 0.02 -0.29 -3.47 113.55 110.85 2pzf h SER 478 Ca -0.49 -0.47 -0.43 0.00 -0.84 0.00 0.00 61.79 59.55 2pzf h SER 478 Cb 1.23 -0.07 -0.21 0.00 0.14 0.00 0.00 62.40 63.49 2pzf h SER 478 CO 0.63 1.42 -0.78 -1.61 -1.14 0.00 0.00 176.83 175.35 2pzf s GLU 479 N -2.58 0.89 0.34 3.45 2.02 -1.05 -4.98 118.70 116.79 2pzf s GLU 479 Ca -0.13 -1.03 0.00 0.00 0.02 0.00 0.00 54.97 53.83 2pzf s GLU 479 Cb 0.07 -0.92 0.00 0.00 0.10 0.00 0.00 34.13 33.38 2pzf s GLU 479 CO 0.80 0.20 0.00 0.41 0.02 0.00 0.00 175.26 176.70 2pzf n GLY 480 N 1.13 -2.46 3.08 -1.39 0.00 -1.18 -1.74 105.19 102.63 2pzf n GLY 480 Ca -0.20 -1.66 -0.20 0.00 0.00 0.00 0.00 46.02 43.96 2pzf n GLY 480 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pzf s LYS 481 N -0.52 0.90 -0.21 1.61 3.01 -0.33 -4.90 119.74 119.30 2pzf s LYS 481 Ca 0.00 -0.49 -0.01 0.00 -1.01 0.00 0.00 55.97 54.46 2pzf s LYS 481 Cb 0.00 -0.87 0.01 0.00 -1.01 0.00 0.00 37.83 35.96 2pzf s LYS 481 CO 0.00 0.23 -0.11 0.42 0.51 0.00 0.00 175.35 176.40 2pzf s ILE 482 N -0.43 2.74 -0.27 2.17 1.01 -1.26 -0.79 121.20 124.38 2pzf s ILE 482 Ca 0.03 -0.74 -0.05 0.00 0.00 0.00 0.00 60.65 59.89 2pzf s ILE 482 Cb -0.05 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.19 2pzf s ILE 482 CO -0.00 0.45 0.03 -0.54 0.00 0.00 0.00 174.94 174.88 2pzf s LYS 483 N 1.38 3.20 -0.24 2.79 -0.14 0.64 -4.97 119.74 122.41 2pzf s LYS 483 Ca 0.05 -0.77 -0.23 0.00 -1.36 0.00 0.00 55.97 53.66 2pzf s LYS 483 Cb -0.14 -3.23 0.06 0.00 -1.68 0.00 0.00 37.83 32.84 2pzf s LYS 483 CO -0.08 -0.35 0.66 -1.58 -0.76 0.00 0.00 175.35 173.24 2pzf s HIS 484 N 1.49 -0.71 -0.06 3.18 5.04 -1.26 -0.46 115.29 122.50 2pzf s HIS 484 Ca 0.04 1.72 -0.02 0.00 -1.54 0.00 0.00 55.06 55.26 2pzf s HIS 484 Cb -0.16 0.25 0.03 0.00 0.04 0.00 0.00 32.58 32.74 2pzf s HIS 484 CO 0.00 -0.36 0.02 0.45 -2.34 0.00 0.00 174.74 172.52 2pzf s SER 485 N 0.26 1.41 0.00 9.88 0.15 -1.26 -5.10 113.70 119.05 2pzf s SER 485 Ca -0.01 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.62 2pzf s SER 485 Cb -0.04 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 2pzf s SER 485 CO 0.01 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2pzf n GLY 486 N 5.20 1.65 3.72 9.45 0.00 -1.26 -5.04 105.19 118.91 2pzf n GLY 486 Ca -0.06 -1.13 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.00 4.61 -0.15 1.61 3.52 -1.26 -4.88 118.95 120.40 2pzf s ARG 487 Ca 0.00 1.55 -0.05 0.00 -0.13 0.00 0.00 55.73 57.09 2pzf s ARG 487 Cb 0.00 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.99 2pzf s ARG 487 CO 0.00 0.06 0.04 0.42 -0.81 0.00 0.00 175.30 175.01 2pzf s ILE 488 N 0.30 4.56 -0.18 4.11 1.01 -1.26 -0.21 121.20 129.53 2pzf s ILE 488 Ca 0.50 -0.13 -0.02 0.00 0.00 0.00 0.00 60.65 61.00 2pzf s ILE 488 Cb -0.25 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.20 2pzf s ILE 488 CO 0.31 0.51 -0.08 -0.55 0.00 0.00 0.00 174.94 175.13 2pzf s SER 489 N -0.01 4.19 -0.15 3.58 0.15 0.69 -4.97 113.70 117.18 2pzf s SER 489 Ca 0.05 -0.36 0.01 0.00 0.70 0.00 0.00 55.95 56.35 2pzf s SER 489 Cb -0.12 -1.69 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 2pzf s SER 489 CO 0.01 0.06 -0.18 0.12 1.20 0.00 0.00 173.24 174.46 2pzf s PHE 490 N 0.99 2.75 -0.44 3.44 5.36 -1.26 0.18 117.98 128.99 2pzf s PHE 490 Ca -0.01 -1.21 -0.12 0.00 -0.96 0.00 0.00 56.93 54.63 2pzf s PHE 490 Cb -0.15 -1.87 0.08 0.00 -0.34 0.00 0.00 43.02 40.74 2pzf s PHE 490 CO -0.00 -0.56 0.32 0.00 -1.46 0.00 0.00 175.22 173.51 2pzf s SER 492 N 2.35 6.16 0.51 0.00 0.15 -1.26 -0.54 113.70 121.06 2pzf s SER 492 Ca 0.03 1.63 -0.21 0.00 0.70 0.00 0.00 55.95 58.10 2pzf s SER 492 Cb -0.24 -2.51 -0.06 0.00 -1.71 0.00 0.00 66.02 61.50 2pzf s SER 492 CO 0.04 -0.91 1.18 -1.10 1.20 0.00 0.00 173.24 173.65 2pzf s GLN 493 N -4.35 3.50 -1.43 5.44 -0.21 -1.24 -3.62 119.66 117.76 2pzf s GLN 493 Ca 0.60 1.78 -0.06 0.00 0.02 0.00 0.00 55.36 57.69 2pzf s GLN 493 Cb -0.12 -2.23 0.04 0.00 1.00 0.00 0.00 33.01 31.70 2pzf s GLN 493 CO 0.39 -0.77 0.75 1.19 -2.12 0.00 0.00 175.29 174.74 2pzf n PHE 494 N -0.89 -1.98 -2.21 0.91 3.72 -1.26 -4.90 117.46 110.85 2pzf n PHE 494 Ca 0.09 0.84 -0.41 0.00 -0.05 0.00 0.00 57.45 57.93 2pzf n PHE 494 Cb 0.49 -4.03 -0.03 0.00 -0.94 0.00 0.00 39.48 34.97 2pzf n PHE 494 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2pzf s SER 495 N -3.93 6.89 0.20 4.37 0.15 -1.24 -4.98 113.70 115.17 2pzf s SER 495 Ca 0.28 2.43 -0.24 0.00 0.70 0.00 0.00 55.95 59.12 2pzf s SER 495 Cb -0.14 -2.62 -0.08 0.00 -1.71 0.00 0.00 66.02 61.47 2pzf s SER 495 CO 0.84 -0.51 0.79 0.86 1.20 0.00 0.00 173.24 176.41 2pzf s TRP 496 N -0.09 3.83 -0.12 3.44 -0.00 -1.26 -4.96 118.94 119.79 2pzf s TRP 496 Ca 0.55 1.60 -0.16 0.00 -0.00 0.00 0.00 56.10 58.10 2pzf s TRP 496 Cb -0.37 -2.75 -0.05 0.00 -0.00 0.00 0.00 33.47 30.30 2pzf s TRP 496 CO 0.40 0.44 0.38 0.42 -0.00 0.00 0.00 176.95 178.59 2pzf s ILE 497 N -1.29 5.22 0.15 5.86 -1.09 -1.26 -4.99 121.20 123.80 2pzf s ILE 497 Ca 0.39 0.75 0.02 0.00 -2.23 0.00 0.00 60.65 59.58 2pzf s ILE 497 Cb -0.21 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 2pzf s ILE 497 CO 0.25 0.40 0.30 -0.04 -1.23 0.00 0.00 174.94 174.61 2pzf s MET 498 N 0.25 3.45 0.32 2.79 -1.94 -1.26 -1.12 119.30 121.80 2pzf s MET 498 Ca 0.21 -0.54 -0.28 0.00 -1.71 0.00 0.00 55.69 53.37 2pzf s MET 498 Cb -0.14 -2.95 -0.13 0.00 2.01 0.00 0.00 34.83 33.62 2pzf s MET 498 CO 0.08 0.51 1.23 -2.30 -0.01 0.00 0.00 175.02 174.53 2pzf n PRO 499 N -0.50 1.93 0.00 2.03 -0.02 -1.26 -4.76 135.00 132.42 2pzf n PRO 499 Ca -0.06 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2pzf n PRO 499 Cb 0.54 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2pzf n PRO 499 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pzf n GLY 500 N 0.98 0.86 3.85 -1.23 0.00 -0.84 -4.95 105.19 103.86 2pzf n GLY 500 Ca 0.06 -2.09 -0.29 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.07 2.23 0.20 2.61 -4.23 -1.26 0.10 115.64 114.23 2pzf s THR 501 Ca 0.00 0.08 -0.10 0.00 -1.18 0.00 0.00 61.69 60.49 2pzf s THR 501 Cb 0.00 -2.97 0.14 0.00 1.34 0.00 0.00 72.50 71.01 2pzf s THR 501 CO 0.00 -0.10 1.79 0.40 -0.54 0.00 0.00 174.62 176.17 2pzf h ILE 502 N -1.17 1.24 -0.13 2.99 2.04 -1.52 -1.04 117.51 119.91 2pzf h ILE 502 Ca -0.48 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 64.73 2pzf h ILE 502 Cb 1.32 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2pzf h ILE 502 CO 0.64 0.28 0.07 0.50 0.00 0.00 0.00 178.15 179.63 2pzf h LYS 503 N 1.03 0.14 -0.69 2.37 3.64 -1.83 -1.45 116.57 119.77 2pzf h LYS 503 Ca 0.25 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2pzf h LYS 503 Cb 0.11 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 2pzf h LYS 503 CO -0.03 0.09 0.34 0.93 -2.27 0.00 0.00 179.45 178.51 2pzf h GLU 504 N 0.14 0.98 0.00 1.90 5.08 -1.83 0.29 114.58 121.15 2pzf h GLU 504 Ca 0.05 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2pzf h GLU 504 Cb 0.00 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 2pzf h GLU 504 CO -0.03 0.75 -0.06 -0.91 -1.00 0.00 0.00 179.01 177.76 2pzf h ASN 505 N 0.98 0.00 0.01 1.42 2.35 -0.72 -1.34 115.58 118.28 2pzf h ASN 505 Ca 0.24 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.78 2pzf h ASN 505 Cb 0.09 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 2pzf h ASN 505 CO -0.03 0.06 -1.14 0.40 -1.65 0.00 0.00 177.43 175.07 2pzf h ILE 506 N 0.00 1.02 0.00 2.81 2.04 -0.08 -3.42 117.51 119.88 2pzf h ILE 506 Ca -0.00 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.64 2pzf h ILE 506 Cb 0.11 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2pzf h ILE 506 CO 0.01 0.39 -0.93 2.30 0.00 0.00 0.00 178.15 179.92 2pzf n ILE 507 N -4.39 0.30 0.00 -0.67 -5.35 0.88 -4.48 119.36 105.65 2pzf n ILE 507 Ca -0.29 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 2pzf n ILE 507 Cb 0.68 -0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.58 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 1.32 1.42 0.07 3.28 0.00 -0.50 -2.52 105.19 108.25 2pzf n GLY 509 Ca 0.02 0.59 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 2pzf n GLY 509 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2pzf h VAL 510 N 0.00 0.86 -3.44 1.61 2.07 -1.93 -3.47 116.25 111.94 2pzf h VAL 510 Ca 0.00 -1.75 -0.61 0.00 0.82 0.00 0.00 66.70 65.17 2pzf h VAL 510 Cb 0.00 1.72 -0.11 0.00 -1.52 0.00 0.00 31.29 31.39 2pzf h VAL 510 CO 0.00 0.29 0.21 -0.55 0.02 0.00 0.00 177.57 177.54 2pzf s SER 511 N -6.10 6.63 -0.20 0.57 0.15 -1.05 -5.04 113.70 108.66 2pzf s SER 511 Ca -0.15 0.77 -0.24 0.00 0.70 0.00 0.00 55.95 57.02 2pzf s SER 511 Cb 0.00 -2.35 -0.01 0.00 -1.71 0.00 0.00 66.02 61.95 2pzf s SER 511 CO 0.41 -0.38 0.79 -0.72 1.20 0.00 0.00 173.24 174.54 2pzf s TYR 512 N 2.50 3.37 -0.32 3.44 1.13 -1.26 -4.87 117.35 121.34 2pzf s TYR 512 Ca 0.28 1.15 0.02 0.00 -1.41 0.00 0.00 57.07 57.10 2pzf s TYR 512 Cb -0.15 -2.99 0.15 0.00 -1.10 0.00 0.00 41.96 37.87 2pzf s TYR 512 CO 0.08 -0.29 0.37 0.34 -2.51 0.00 0.00 175.55 173.54 2pzf s ASP 513 N 1.24 1.03 0.29 -0.18 -1.08 -1.26 -5.06 116.67 111.66 2pzf s ASP 513 Ca 0.35 -0.97 0.01 0.00 -0.52 0.00 0.00 52.55 51.42 2pzf s ASP 513 Cb -0.16 0.74 0.43 0.00 -1.46 0.00 0.00 42.92 42.47 2pzf s ASP 513 CO 0.10 -0.32 1.78 -0.08 0.52 0.00 0.00 175.17 177.17 2pzf h GLU 514 N 7.75 0.64 -0.23 4.34 4.57 -1.99 -0.01 114.58 129.65 2pzf h GLU 514 Ca -0.05 -0.17 -0.03 0.00 -1.18 0.00 0.00 59.36 57.93 2pzf h GLU 514 Cb 1.08 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.59 2pzf h GLU 514 CO 0.26 0.70 0.02 -0.92 -1.18 0.00 0.00 179.01 177.89 2pzf h TYR 515 N 0.59 0.43 -0.33 0.92 3.20 -1.99 -1.51 116.97 118.27 2pzf h TYR 515 Ca 0.11 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 2pzf h TYR 515 Cb 0.47 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2pzf h TYR 515 CO 0.02 0.54 0.03 -0.09 -1.64 0.00 0.00 178.16 177.02 2pzf h ARG 516 N 0.19 0.57 -0.37 1.82 2.43 -1.92 -2.46 114.38 114.63 2pzf h ARG 516 Ca 0.07 -0.17 0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2pzf h ARG 516 Cb 0.35 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 2pzf h ARG 516 CO 0.01 0.67 0.04 -0.92 -1.51 0.00 0.00 179.97 178.26 2pzf h TYR 517 N 0.39 0.05 -0.57 2.20 3.20 -0.96 -1.79 116.97 119.50 2pzf h TYR 517 Ca 0.10 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 2pzf h TYR 517 Cb 0.40 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 2pzf h TYR 517 CO 0.03 -0.03 0.20 0.00 -1.64 0.00 0.00 178.16 176.72 2pzf h ARG 518 N 0.15 0.87 -0.58 1.82 2.47 -1.18 -0.65 114.38 117.28 2pzf h ARG 518 Ca 0.18 -0.17 -0.03 0.00 -1.26 0.00 0.00 59.98 58.70 2pzf h ARG 518 Cb 0.23 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.39 2pzf h ARG 518 CO -0.27 0.77 0.25 0.66 0.56 0.00 0.00 179.97 181.94 2pzf h SER 519 N 0.79 0.75 -0.04 7.04 4.64 -1.21 -0.87 113.55 124.65 2pzf h SER 519 Ca 0.19 -0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 2pzf h SER 519 Cb 0.25 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2pzf h SER 519 CO -0.01 0.67 -0.24 0.58 -0.87 0.00 0.00 176.83 176.96 2pzf h VAL 520 N 0.83 1.46 -0.18 0.95 2.07 -0.97 -1.60 116.25 118.82 2pzf h VAL 520 Ca 0.20 -1.71 -0.08 0.00 0.82 0.00 0.00 66.70 65.93 2pzf h VAL 520 Cb 0.14 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 2pzf h VAL 520 CO -0.02 0.48 -0.26 0.16 0.02 0.00 0.00 177.57 177.95 2pzf h ILE 521 N -0.32 1.25 0.09 4.57 3.07 -1.06 -0.85 117.51 124.27 2pzf h ILE 521 Ca -0.02 -1.19 -0.00 0.00 1.55 0.00 0.00 64.86 65.20 2pzf h ILE 521 Cb 0.90 1.40 0.00 0.00 -0.27 0.00 0.00 36.82 38.85 2pzf h ILE 521 CO 0.05 0.37 -0.05 0.50 -1.05 0.00 0.00 178.15 177.97 2pzf h LYS 522 N 0.29 -0.12 0.00 0.16 3.64 -1.19 0.49 116.57 119.83 2pzf h LYS 522 Ca 0.04 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 2pzf h LYS 522 Cb 0.61 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 2pzf h LYS 522 CO 0.04 0.05 -0.22 0.00 -2.27 0.00 0.00 179.45 177.05 2pzf h ALA 523 N 0.61 1.27 -0.62 5.00 0.00 -0.91 -2.27 119.26 122.34 2pzf h ALA 523 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2pzf h ALA 523 Cb 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2pzf h ALA 523 CO 0.02 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.55 2pzf n GLN 525 N 1.30 -5.38 0.00 0.00 6.02 -0.85 -4.89 117.38 113.58 2pzf n GLN 525 Ca 0.21 0.62 0.10 0.00 -0.01 0.00 0.00 57.00 57.92 2pzf n GLN 525 Cb 0.55 -5.37 -0.01 0.00 1.02 0.00 0.00 30.24 26.43 2pzf n GLN 525 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2pzf n LEU 526 N -4.52 1.91 0.01 1.08 4.77 0.14 -4.58 117.00 115.81 2pzf n LEU 526 Ca -0.11 -0.75 -0.11 0.00 -0.03 0.00 0.00 56.01 55.01 2pzf n LEU 526 Cb 0.60 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2pzf n LEU 526 CO 0.72 0.36 0.88 -0.33 -1.33 0.00 0.00 177.39 177.69 2pzf h GLU 527 N 2.20 0.05 -0.29 3.23 5.08 -1.87 -1.66 114.58 121.32 2pzf h GLU 527 Ca 0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2pzf h GLU 527 Cb 0.71 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2pzf h GLU 527 CO 0.00 0.04 0.12 0.93 -1.00 0.00 0.00 179.01 179.09 2pzf h GLU 528 N 0.05 0.44 -0.91 2.33 4.39 -1.92 0.04 114.58 119.00 2pzf h GLU 528 Ca 0.03 -0.08 0.07 0.00 0.34 0.00 0.00 59.36 59.71 2pzf h GLU 528 Cb 0.01 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.53 2pzf h GLU 528 CO -0.03 0.46 0.59 -0.44 -1.16 0.00 0.00 179.01 178.43 2pzf h ASP 529 N 0.33 0.90 0.10 1.42 3.32 -1.79 -1.64 116.42 119.06 2pzf h ASP 529 Ca 0.10 0.01 -0.24 0.00 0.02 0.00 0.00 57.03 56.92 2pzf h ASP 529 Cb 0.18 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.56 2pzf h ASP 529 CO -0.01 0.58 -0.94 0.40 -1.72 0.00 0.00 179.24 177.55 2pzf h ILE 530 N 1.02 1.32 0.00 0.35 2.04 -1.10 -3.29 117.51 117.85 2pzf h ILE 530 Ca 0.39 -2.25 -0.02 0.00 1.00 0.00 0.00 64.86 63.98 2pzf h ILE 530 Cb 0.21 2.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2pzf h ILE 530 CO -0.15 0.69 -0.10 0.77 0.00 0.00 0.00 178.15 179.36 2pzf h SER 531 N 0.36 0.00 0.19 1.72 4.64 -0.45 -3.05 113.55 116.96 2pzf h SER 531 Ca -0.09 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.97 2pzf h SER 531 Cb 1.58 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.68 2pzf h SER 531 CO 0.18 0.10 -1.03 0.11 -0.87 0.00 0.00 176.83 175.32 2pzf h LYS 532 N 0.00 0.55 -7.17 4.77 6.56 -1.39 -3.46 116.57 116.43 2pzf h LYS 532 Ca -0.00 -0.61 -0.52 0.00 -1.06 0.00 0.00 60.65 58.46 2pzf h LYS 532 Cb 0.58 0.18 0.12 0.00 -0.57 0.00 0.00 32.23 32.54 2pzf h LYS 532 CO 0.01 1.23 0.39 -0.59 -2.06 0.00 0.00 179.45 178.44 2pzf s PHE 533 N -3.23 2.39 0.02 -1.35 -0.00 -1.15 -4.98 117.98 109.67 2pzf s PHE 533 Ca -0.08 1.57 -0.25 0.00 -0.00 0.00 0.00 56.93 58.17 2pzf s PHE 533 Cb 0.08 -3.32 -0.18 0.00 -0.00 0.00 0.00 43.02 39.60 2pzf s PHE 533 CO 0.90 -2.06 1.44 0.00 -0.00 0.00 0.00 175.22 175.50 2pzf h ALA 534 N 0.07 -0.02 -0.09 1.99 0.00 -1.89 -3.08 119.26 116.24 2pzf h ALA 534 Ca -0.48 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2pzf h ALA 534 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2pzf h ALA 534 CO 0.53 -0.37 0.00 -0.85 0.00 0.00 0.00 179.25 178.56 2pzf n GLU 535 N -4.96 1.56 0.00 0.00 0.28 -1.26 -5.02 120.64 111.24 2pzf n GLU 535 Ca -0.08 -0.83 0.00 0.00 -0.16 0.00 0.00 57.16 56.09 2pzf n GLU 535 Cb 0.17 -1.41 0.00 0.00 1.43 0.00 0.00 31.44 31.63 2pzf n GLU 535 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2pzf n LYS 536 N 0.03 0.00 0.00 3.44 4.76 -1.17 -2.15 118.16 123.08 2pzf n LYS 536 Ca 0.17 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.72 2pzf n LYS 536 Cb 0.28 0.00 0.54 0.00 -1.84 0.00 0.00 35.03 34.01 2pzf n LYS 536 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2pzf n ASP 537 N 7.37 0.00 -1.40 4.39 8.00 -1.26 -3.49 116.55 130.16 2pzf n ASP 537 Ca 0.00 0.24 0.07 0.00 0.71 0.00 0.00 54.79 55.80 2pzf n ASP 537 Cb 0.00 -0.40 0.29 0.00 -0.02 0.00 0.00 41.12 41.00 2pzf n ASP 537 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2pzf n ASN 538 N -1.40 4.11 -4.70 -2.24 0.23 -0.91 -2.51 115.26 107.84 2pzf n ASN 538 Ca 0.08 -2.46 -0.42 0.00 -0.53 0.00 0.00 54.58 51.25 2pzf n ASN 538 Cb 0.23 -0.55 -0.03 0.00 -2.08 0.00 0.00 39.78 37.35 2pzf n ASN 538 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2pzf s ILE 539 N -1.95 4.69 -0.12 1.53 1.01 -1.23 -4.89 121.20 120.24 2pzf s ILE 539 Ca 0.41 1.95 -0.26 0.00 0.00 0.00 0.00 60.65 62.74 2pzf s ILE 539 Cb 0.28 -4.25 -0.02 0.00 0.01 0.00 0.00 42.46 38.48 2pzf s ILE 539 CO 0.18 0.08 0.87 -0.69 0.00 0.00 0.00 174.94 175.38 2pzf s VAL 540 N 1.49 4.88 0.13 2.92 1.01 -1.26 -3.29 120.40 126.28 2pzf s VAL 540 Ca 0.52 1.74 -0.02 0.00 0.00 0.00 0.00 61.98 64.22 2pzf s VAL 540 Cb -0.21 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 2pzf s VAL 540 CO 0.24 0.07 0.32 -0.76 0.00 0.00 0.00 175.10 174.96 2pzf s LEU 541 N 1.81 4.29 0.82 3.92 1.43 0.29 -4.91 118.68 126.33 2pzf s LEU 541 Ca 0.42 0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 53.86 2pzf s LEU 541 Cb -0.18 -3.14 0.15 0.00 0.03 0.00 0.00 46.19 43.05 2pzf s LEU 541 CO 0.16 0.07 1.13 -0.83 0.23 0.00 0.00 176.35 177.11 2pzf s GLY 542 N -2.65 1.76 -0.07 -3.19 0.00 -1.26 -1.98 107.32 99.93 2pzf s GLY 542 Ca 0.38 -1.44 -0.30 0.00 0.00 0.00 0.00 44.72 43.37 2pzf s GLY 542 CO 0.27 -0.80 1.65 -0.54 0.00 0.00 0.00 173.10 173.68 2pzf s GLU 543 N -5.46 4.14 0.00 2.90 0.41 -1.26 -1.90 118.70 117.53 2pzf s GLU 543 Ca 0.69 2.14 0.00 0.00 -0.41 0.00 0.00 54.97 57.38 2pzf s GLU 543 Cb -0.05 -3.99 0.00 0.00 -1.78 0.00 0.00 34.13 28.31 2pzf s GLU 543 CO 0.48 -0.89 0.00 0.41 -0.49 0.00 0.00 175.26 174.77 2pzf n GLY 544 N 4.18 3.09 3.57 -1.39 0.00 -0.27 -4.55 105.19 109.81 2pzf n GLY 544 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.26 -0.59 0.25 -0.02 0.00 -0.80 -4.45 105.19 98.32 2pzf n GLY 545 Ca 0.00 0.27 0.16 0.00 0.00 0.00 0.00 46.02 46.45 2pzf n GLY 545 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2pzf h ILE 546 N -1.72 0.00 -0.01 -0.61 3.07 -1.83 -2.61 117.51 113.80 2pzf h ILE 546 Ca -0.62 -0.51 0.00 0.00 1.55 0.00 0.00 64.86 65.28 2pzf h ILE 546 Cb 1.35 1.48 0.00 0.00 -0.27 0.00 0.00 36.82 39.37 2pzf h ILE 546 CO 0.52 0.00 -0.03 0.35 -1.05 0.00 0.00 178.15 177.94 2pzf n THR 547 N -2.96 0.00 -3.67 0.16 -2.24 -1.26 -4.86 114.28 99.45 2pzf n THR 547 Ca 0.01 -0.14 -0.25 0.00 -2.27 0.00 0.00 64.05 61.40 2pzf n THR 547 Cb 0.32 0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.63 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 -2.09 4.19 0.79 3.22 1.43 -0.98 -5.10 118.68 120.13 2pzf s LEU 548 Ca 0.39 0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.73 2pzf s LEU 548 Cb 0.21 -3.14 0.07 0.00 0.03 0.00 0.00 46.19 43.36 2pzf s LEU 548 CO 0.37 -0.11 1.09 -0.94 0.23 0.00 0.00 176.35 176.99 2pzf s SER 549 N -3.56 4.41 0.23 2.29 1.04 -1.26 -4.87 113.70 111.98 2pzf s SER 549 Ca 0.38 1.70 -0.06 0.00 0.48 0.00 0.00 55.95 58.44 2pzf s SER 549 Cb -0.10 -2.42 0.23 0.00 0.10 0.00 0.00 66.02 63.83 2pzf s SER 549 CO 0.31 -2.08 1.83 1.23 0.98 0.00 0.00 173.24 175.51 2pzf h GLY 550 N -1.16 1.26 1.48 7.32 0.00 -1.95 -1.66 103.07 108.36 2pzf h GLY 550 Ca -0.45 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.25 2pzf h GLY 550 CO 0.53 0.60 0.30 -1.33 0.00 0.00 0.00 176.54 176.64 2pzf h GLY 551 N 1.18 0.73 0.74 4.60 0.00 -1.93 -1.41 103.07 106.97 2pzf h GLY 551 Ca 0.28 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 2pzf h GLY 551 CO -0.03 0.29 -0.23 1.46 0.00 0.00 0.00 176.54 178.03 2pzf h GLN 552 N 0.70 0.37 -0.70 4.80 4.20 -1.79 -1.62 115.11 121.07 2pzf h GLN 552 Ca 0.18 -0.24 0.02 0.00 0.06 0.00 0.00 58.65 58.68 2pzf h GLN 552 Cb -0.02 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.75 2pzf h GLN 552 CO -0.03 0.83 0.45 0.00 -0.67 0.00 0.00 178.83 179.40 2pzf h ARG 553 N -0.04 0.86 -0.43 1.46 3.08 -1.23 -0.87 114.38 117.22 2pzf h ARG 553 Ca 0.01 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.02 2pzf h ARG 553 Cb 0.81 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2pzf h ARG 553 CO 0.05 0.57 0.27 0.00 -1.07 0.00 0.00 179.97 179.79 2pzf h ALA 554 N 1.29 0.54 -0.12 0.04 0.00 -1.18 -0.92 119.26 118.90 2pzf h ALA 554 Ca 0.27 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 2pzf h ALA 554 Cb -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2pzf h ALA 554 CO -0.09 -0.03 -0.55 0.00 0.00 0.00 0.00 179.25 178.57 2pzf h ARG 555 N 0.55 0.37 -0.55 0.00 3.08 -1.02 -1.39 114.38 115.42 2pzf h ARG 555 Ca 0.16 -0.23 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 2pzf h ARG 555 Cb -0.03 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2pzf h ARG 555 CO -0.05 0.82 -0.07 0.82 -1.07 0.00 0.00 179.97 180.42 2pzf h ILE 556 N 0.28 1.27 -0.53 2.04 2.04 -1.02 0.39 117.51 121.98 2pzf h ILE 556 Ca 0.00 -1.22 -0.09 0.00 1.00 0.00 0.00 64.86 64.56 2pzf h ILE 556 Cb 1.05 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 2pzf h ILE 556 CO 0.09 0.43 -0.03 0.28 0.00 0.00 0.00 178.15 178.93 2pzf h SER 557 N 0.89 0.90 -0.04 1.72 0.02 -0.98 -0.95 113.55 115.11 2pzf h SER 557 Ca 0.15 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 2pzf h SER 557 Cb 0.63 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2pzf h SER 557 CO 0.04 0.98 -0.02 0.25 -1.14 0.00 0.00 176.83 176.94 2pzf h LEU 558 N 0.85 0.09 -0.95 5.07 5.85 -1.13 -2.71 115.31 122.37 2pzf h LEU 558 Ca 0.15 -0.43 0.15 0.00 0.84 0.00 0.00 57.88 58.60 2pzf h LEU 558 Cb 0.54 -0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.45 2pzf h LEU 558 CO 0.03 0.50 0.56 0.00 -0.34 0.00 0.00 178.44 179.19 2pzf h ALA 559 N 0.60 1.49 -0.27 1.25 0.00 -0.82 0.73 119.26 122.23 2pzf h ALA 559 Ca 0.01 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2pzf h ALA 559 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2pzf h ALA 559 CO 0.01 0.02 0.16 -0.09 0.00 0.00 0.00 179.25 179.35 2pzf h ARG 560 N 0.79 0.33 -0.57 0.00 2.43 -1.14 -0.20 114.38 116.02 2pzf h ARG 560 Ca 0.52 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.61 2pzf h ARG 560 Cb 0.69 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 2pzf h ARG 560 CO -0.34 0.22 0.12 0.00 -1.51 0.00 0.00 179.97 178.46 2pzf h ALA 561 N 1.11 0.75 -0.10 2.80 0.00 -0.91 -2.92 119.26 120.00 2pzf h ALA 561 Ca 0.10 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 2pzf h ALA 561 Cb -0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2pzf h ALA 561 CO -0.04 0.47 -0.68 0.28 0.00 0.00 0.00 179.25 179.28 2pzf h VAL 562 N 0.82 1.37 -0.48 0.00 2.07 -0.79 -3.21 116.25 116.02 2pzf h VAL 562 Ca 0.18 -2.05 -0.07 0.00 0.82 0.00 0.00 66.70 65.58 2pzf h VAL 562 Cb 0.37 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 2pzf h VAL 562 CO 0.01 0.62 0.03 0.22 0.02 0.00 0.00 177.57 178.47 2pzf h TYR 563 N 0.30 0.81 -2.59 1.57 3.20 -0.99 -3.44 116.97 115.83 2pzf h TYR 563 Ca -0.02 -0.10 -0.58 0.00 3.14 0.00 0.00 58.73 61.17 2pzf h TYR 563 Cb 1.24 -0.23 0.07 0.00 1.54 0.00 0.00 36.73 39.36 2pzf h TYR 563 CO 0.04 0.74 0.69 1.17 -1.64 0.00 0.00 178.16 179.16 2pzf n LYS 564 N -4.24 2.12 -2.55 1.82 4.81 -1.11 -4.90 118.16 114.11 2pzf n LYS 564 Ca 0.03 0.76 -0.41 0.00 -0.87 0.00 0.00 58.31 57.81 2pzf n LYS 564 Cb 0.28 -2.46 -0.03 0.00 0.02 0.00 0.00 35.03 32.84 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 0.50 6.16 0.29 3.14 3.68 -1.26 -4.99 116.67 124.18 2pzf s ASP 565 Ca 0.71 -0.45 0.04 0.00 2.13 0.00 0.00 52.55 54.98 2pzf s ASP 565 Cb -0.65 -2.56 -0.06 0.00 -1.45 0.00 0.00 42.92 38.20 2pzf s ASP 565 CO 0.46 -1.84 0.03 0.00 0.13 0.00 0.00 175.17 173.95 2pzf s ALA 566 N 5.75 2.15 -0.11 3.66 0.00 -1.26 -4.99 121.76 126.97 2pzf s ALA 566 Ca 0.35 -1.95 0.21 0.00 0.00 0.00 0.00 51.96 50.58 2pzf s ALA 566 Cb -0.08 0.59 -0.24 0.00 0.00 0.00 0.00 23.12 23.40 2pzf s ALA 566 CO 0.15 -0.28 0.58 -0.25 0.00 0.00 0.00 175.76 175.96 2pzf n ASP 567 N -0.58 0.27 -3.73 0.00 8.00 0.70 -4.91 116.55 116.30 2pzf n ASP 567 Ca -0.03 0.11 -0.17 0.00 0.71 0.00 0.00 54.79 55.41 2pzf n ASP 567 Cb 0.65 1.34 -0.17 0.00 -0.02 0.00 0.00 41.12 42.93 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 -4.96 0.70 -0.23 0.64 2.96 -0.27 -4.11 118.68 113.42 2pzf s LEU 568 Ca -0.06 0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 53.84 2pzf s LEU 568 Cb 0.11 -0.11 -0.02 0.00 0.50 0.00 0.00 46.19 46.68 2pzf s LEU 568 CO 0.86 -0.18 0.02 -0.31 -1.32 0.00 0.00 176.35 175.42 2pzf s TYR 569 N 1.52 3.03 -0.39 5.38 1.51 -0.19 -0.22 117.35 127.99 2pzf s TYR 569 Ca -0.03 -0.60 -0.05 0.00 -1.01 0.00 0.00 57.07 55.38 2pzf s TYR 569 Cb -0.13 -2.16 0.09 0.00 -0.11 0.00 0.00 41.96 39.65 2pzf s TYR 569 CO -0.03 -0.40 0.17 -0.51 -1.11 0.00 0.00 175.55 173.68 2pzf s LEU 570 N 1.44 4.90 -0.48 -1.29 1.43 0.13 -0.77 118.68 124.04 2pzf s LEU 570 Ca 0.05 -1.68 -0.10 0.00 -1.03 0.00 0.00 54.13 51.37 2pzf s LEU 570 Cb -0.15 -1.85 0.12 0.00 0.03 0.00 0.00 46.19 44.34 2pzf s LEU 570 CO 0.01 -0.47 0.37 -0.76 0.23 0.00 0.00 176.35 175.72 2pzf s LEU 571 N 1.26 5.74 -0.71 1.79 1.43 0.61 -0.70 118.68 128.10 2pzf s LEU 571 Ca 0.03 -1.86 -0.17 0.00 -1.03 0.00 0.00 54.13 51.10 2pzf s LEU 571 Cb -0.22 -2.05 0.14 0.00 0.03 0.00 0.00 46.19 44.09 2pzf s LEU 571 CO -0.01 -0.71 0.79 -0.62 0.23 0.00 0.00 176.35 176.02 2pzf s ASP 572 N 2.79 6.41 -1.20 2.29 -1.08 0.30 -1.03 116.67 125.15 2pzf s ASP 572 Ca 0.05 -1.89 -0.27 0.00 -0.52 0.00 0.00 52.55 49.92 2pzf s ASP 572 Cb -0.27 -2.29 0.02 0.00 -1.46 0.00 0.00 42.92 38.92 2pzf s ASP 572 CO 0.00 -0.95 0.70 -1.20 0.52 0.00 0.00 175.17 174.24 2pzf n SER 573 N 5.72 -4.35 0.04 -0.34 7.64 -0.87 -3.63 113.62 117.83 2pzf n SER 573 Ca 0.02 -1.18 0.09 0.00 1.01 0.00 0.00 58.87 58.82 2pzf n SER 573 Cb 0.45 -2.40 0.40 0.00 -1.01 0.00 0.00 64.21 61.64 2pzf n SER 573 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2pzf n PRO 574 N -4.68 0.07 -0.06 1.43 -0.04 -1.26 -3.13 135.00 127.33 2pzf n PRO 574 Ca -0.12 0.27 0.09 0.00 -0.04 0.00 0.00 63.50 63.71 2pzf n PRO 574 Cb 0.58 -1.62 0.11 0.00 -0.04 0.00 0.00 33.50 32.53 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 -1.75 0.17 -0.33 0.54 3.72 -1.26 -4.72 117.46 113.82 2pzf n PHE 575 Ca 0.04 -0.11 0.11 0.00 -0.05 0.00 0.00 57.45 57.44 2pzf n PHE 575 Cb 0.22 -0.00 0.32 0.00 -0.94 0.00 0.00 39.48 39.08 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 3.49 1.54 -2.57 1.37 0.00 -1.94 -1.25 103.07 103.71 2pzf h GLY 576 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 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 -4.65 1.30 -3.72 5.60 4.01 -1.26 -4.92 117.16 113.52 2pzf n TYR 577 Ca 0.20 -0.66 -0.33 0.00 -0.16 0.00 0.00 57.90 56.95 2pzf n TYR 577 Cb 0.49 -0.26 -0.05 0.00 -0.31 0.00 0.00 39.34 39.21 2pzf n TYR 577 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2pzf s LEU 578 N -2.01 4.34 0.85 7.72 1.43 -0.47 -4.25 118.68 126.28 2pzf s LEU 578 Ca 0.46 0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 54.03 2pzf s LEU 578 Cb 0.31 -2.92 0.10 0.00 0.03 0.00 0.00 46.19 43.72 2pzf s LEU 578 CO 0.19 0.18 1.10 1.51 0.23 0.00 0.00 176.35 179.57 2pzf s ASP 579 N -1.97 3.77 0.34 2.29 1.47 -1.26 -4.79 116.67 116.51 2pzf s ASP 579 Ca 0.33 1.82 0.01 0.00 1.18 0.00 0.00 52.55 55.89 2pzf s ASP 579 Cb -0.13 -2.44 0.59 0.00 -0.34 0.00 0.00 42.92 40.59 2pzf s ASP 579 CO 0.20 -2.50 2.00 -0.37 0.68 0.00 0.00 175.17 175.17 2pzf h VAL 580 N -1.45 1.17 0.10 2.11 -1.51 -1.99 -1.36 116.25 113.32 2pzf h VAL 580 Ca -0.46 -0.32 -0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2pzf h VAL 580 Cb 1.26 0.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 2pzf h VAL 580 CO 0.50 0.17 -0.05 0.25 -1.23 0.00 0.00 177.57 177.21 2pzf h LEU 581 N 0.92 -0.11 -0.73 4.19 5.85 -2.00 -2.30 115.31 121.14 2pzf h LEU 581 Ca 0.25 -0.38 0.08 0.00 0.84 0.00 0.00 57.88 58.67 2pzf h LEU 581 Cb -0.11 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 40.89 2pzf h LEU 581 CO -0.05 0.35 0.39 0.74 -0.34 0.00 0.00 178.44 179.52 2pzf h THR 582 N -0.60 0.90 0.03 1.05 2.02 -1.90 -1.45 112.91 112.95 2pzf h THR 582 Ca -0.01 -0.23 0.02 0.00 0.77 0.00 0.00 66.41 66.95 2pzf h THR 582 Cb 0.49 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2pzf h THR 582 CO 0.02 0.12 -0.15 -0.08 0.37 0.00 0.00 175.52 175.81 2pzf h GLU 583 N 0.67 -0.25 -0.43 6.66 4.81 -1.28 -2.07 114.58 122.70 2pzf h GLU 583 Ca 0.35 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.66 2pzf h GLU 583 Cb 0.31 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.69 2pzf h GLU 583 CO -0.24 -0.17 0.11 -0.22 -0.73 0.00 0.00 179.01 177.77 2pzf h LYS 584 N -0.26 0.25 -0.42 1.92 1.63 -0.80 0.19 116.57 119.08 2pzf h LYS 584 Ca 0.04 -0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.71 2pzf h LYS 584 Cb 0.30 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 2pzf h LYS 584 CO -0.12 0.16 -0.19 0.93 -3.45 0.00 0.00 179.45 176.79 2pzf h GLU 585 N 0.26 0.81 0.06 1.90 5.08 -1.20 -2.00 114.58 119.48 2pzf h GLU 585 Ca 0.20 -0.31 -0.25 0.00 -1.00 0.00 0.00 59.36 58.00 2pzf h GLU 585 Cb 0.23 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.44 2pzf h GLU 585 CO -0.24 0.94 -1.07 0.82 -1.00 0.00 0.00 179.01 178.45 2pzf h ILE 586 N 0.71 1.41 -0.49 3.13 2.04 -1.15 0.32 117.51 123.49 2pzf h ILE 586 Ca 0.10 -2.63 0.09 0.00 1.00 0.00 0.00 64.86 63.43 2pzf h ILE 586 Cb 0.71 2.61 -0.07 0.00 -0.74 0.00 0.00 36.82 39.32 2pzf h ILE 586 CO 0.05 0.78 0.07 0.15 0.00 0.00 0.00 178.15 179.20 2pzf h PHE 587 N 0.19 0.10 0.70 1.37 3.04 -0.89 -0.16 116.94 121.29 2pzf h PHE 587 Ca -0.11 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.84 2pzf h PHE 587 Cb 1.74 0.03 0.01 0.00 2.56 0.00 0.00 35.95 40.28 2pzf h PHE 587 CO 0.07 -0.04 -0.34 0.93 -2.02 0.00 0.00 178.31 176.92 2pzf h GLU 588 N 0.20 -0.90 -0.35 1.11 4.39 -1.23 -1.04 114.58 116.76 2pzf h GLU 588 Ca 0.25 0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.89 2pzf h GLU 588 Cb 0.35 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 2pzf h GLU 588 CO -0.35 -0.60 -0.26 0.66 -1.16 0.00 0.00 179.01 177.30 2pzf h SER 589 N -1.13 0.72 0.00 1.42 4.64 -0.93 -1.35 113.55 116.93 2pzf h SER 589 Ca -0.10 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2pzf h SER 589 Cb 0.72 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2pzf h SER 589 CO 0.16 0.95 -0.23 0.00 -0.87 0.00 0.00 176.83 176.84 2pzf h VAL 591 N -0.33 1.25 0.08 0.00 2.07 -1.38 -1.04 116.25 116.90 2pzf h VAL 591 Ca 0.00 -0.93 -0.33 0.00 0.82 0.00 0.00 66.70 66.26 2pzf h VAL 591 Cb 0.23 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2pzf h VAL 591 CO 0.00 0.34 -1.83 0.00 0.02 0.00 0.00 177.57 176.09 2pzf n LYS 593 N -3.33 0.34 -0.29 0.00 5.02 -0.52 -3.87 118.16 115.50 2pzf n LYS 593 Ca -0.25 0.13 0.02 0.00 -2.02 0.00 0.00 58.31 56.19 2pzf n LYS 593 Cb 1.05 -1.08 0.21 0.00 -0.02 0.00 0.00 35.03 35.19 2pzf n LYS 593 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2pzf h LEU 594 N -0.64 0.95 -3.57 -0.35 5.85 -0.87 -2.92 115.31 113.77 2pzf h LEU 594 Ca 0.00 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 2pzf h LEU 594 Cb 0.64 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2pzf h LEU 594 CO 0.00 0.65 0.05 0.23 -0.34 0.00 0.00 178.44 179.03 2pzf n MET 595 N -4.44 4.40 -0.26 1.25 2.81 -0.41 -4.70 117.12 115.77 2pzf n MET 595 Ca 0.12 -3.12 0.19 0.00 -1.81 0.00 0.00 57.70 53.08 2pzf n MET 595 Cb 0.11 -2.20 0.50 0.00 -0.71 0.00 0.00 33.22 30.91 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 3.43 2.17 -0.67 3.04 0.00 -1.62 -1.26 119.26 124.35 2pzf h ALA 596 Ca 0.06 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2pzf h ALA 596 Cb 1.99 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.75 2pzf h ALA 596 CO 0.51 -0.47 0.00 0.09 0.00 0.00 0.00 179.25 179.38 2pzf n ASN 597 N -4.53 3.95 -4.86 0.00 5.03 -1.26 -4.83 115.26 108.76 2pzf n ASN 597 Ca 0.20 -2.07 -0.35 0.00 0.87 0.00 0.00 54.58 53.23 2pzf n ASN 597 Cb 0.70 -0.47 -0.06 0.00 -1.02 0.00 0.00 39.78 38.93 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 -1.13 3.35 -0.22 3.52 -0.14 -0.48 -3.98 119.74 120.66 2pzf s LYS 598 Ca 0.46 -0.25 -0.29 0.00 -1.36 0.00 0.00 55.97 54.53 2pzf s LYS 598 Cb 0.25 -3.09 -0.00 0.00 -1.68 0.00 0.00 37.83 33.31 2pzf s LYS 598 CO 0.30 0.73 1.19 0.99 -0.76 0.00 0.00 175.35 177.80 2pzf s THR 599 N -1.12 4.38 -0.02 2.17 2.01 -1.26 -3.96 115.64 117.84 2pzf s THR 599 Ca 0.19 1.64 0.03 0.00 0.31 0.00 0.00 61.69 63.87 2pzf s THR 599 Cb -0.12 -4.15 -0.00 0.00 0.01 0.00 0.00 72.50 68.24 2pzf s THR 599 CO 0.09 -0.24 -0.12 -0.13 -0.69 0.00 0.00 174.62 173.53 2pzf s ARG 600 N 3.56 1.17 -0.19 4.92 0.52 -0.08 -1.03 118.95 127.83 2pzf s ARG 600 Ca 0.51 -0.43 0.01 0.00 -0.52 0.00 0.00 55.73 55.31 2pzf s ARG 600 Cb -0.18 -1.08 0.03 0.00 0.52 0.00 0.00 34.95 34.23 2pzf s ARG 600 CO 0.14 0.20 -0.18 0.42 0.02 0.00 0.00 175.30 175.90 2pzf s ILE 601 N -0.02 2.05 -0.19 1.52 1.01 0.05 -1.31 121.20 124.31 2pzf s ILE 601 Ca -0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.58 2pzf s ILE 601 Cb -0.08 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.47 2pzf s ILE 601 CO 0.00 0.45 -0.07 -0.22 0.00 0.00 0.00 174.94 175.10 2pzf s LEU 602 N 1.27 2.83 -0.33 2.97 2.96 0.07 -0.29 118.68 128.15 2pzf s LEU 602 Ca 0.03 -0.38 -0.21 0.00 -0.22 0.00 0.00 54.13 53.35 2pzf s LEU 602 Cb -0.14 -1.70 -0.00 0.00 0.50 0.00 0.00 46.19 44.85 2pzf s LEU 602 CO -0.12 0.03 0.66 -0.69 -1.32 0.00 0.00 176.35 174.92 2pzf s VAL 603 N 1.16 4.88 0.01 1.68 1.01 -0.20 0.26 120.40 129.20 2pzf s VAL 603 Ca 0.02 0.76 -0.06 0.00 0.00 0.00 0.00 61.98 62.69 2pzf s VAL 603 Cb -0.14 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 32.17 2pzf s VAL 603 CO -0.02 -0.26 0.11 0.28 0.00 0.00 0.00 175.10 175.21 2pzf s THR 604 N 2.73 0.09 -2.34 3.92 -1.32 -0.69 -2.06 115.64 115.98 2pzf s THR 604 Ca 0.26 -0.73 0.22 0.00 -1.21 0.00 0.00 61.69 60.23 2pzf s THR 604 Cb -0.14 -0.41 0.45 0.00 -1.51 0.00 0.00 72.50 70.89 2pzf s THR 604 CO 0.14 -0.40 1.44 -0.24 -2.21 0.00 0.00 174.62 173.35 2pzf n SER 605 N 1.47 2.95 -4.18 8.08 2.88 -1.26 -4.52 113.62 119.03 2pzf n SER 605 Ca -0.23 -1.93 -0.31 0.00 -1.33 0.00 0.00 58.87 55.07 2pzf n SER 605 Cb 0.55 -0.24 -0.17 0.00 -0.75 0.00 0.00 64.21 63.60 2pzf n SER 605 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2pzf s LYS 606 N -1.51 2.88 0.30 -1.46 -0.14 -1.26 -0.59 119.74 117.96 2pzf s LYS 606 Ca 0.37 -0.82 -0.01 0.00 -1.36 0.00 0.00 55.97 54.15 2pzf s LYS 606 Cb 0.21 -2.23 0.46 0.00 -1.68 0.00 0.00 37.83 34.59 2pzf s LYS 606 CO 0.29 0.12 1.95 1.98 -0.76 0.00 0.00 175.35 178.92 2pzf h MET 607 N 6.89 1.08 -0.94 1.68 1.85 -1.15 -1.44 114.93 122.91 2pzf h MET 607 Ca -0.23 -0.06 0.14 0.00 -0.61 0.00 0.00 59.70 58.93 2pzf h MET 607 Cb 1.22 -0.24 -0.08 0.00 0.43 0.00 0.00 31.60 32.93 2pzf h MET 607 CO 0.49 0.71 0.60 0.93 -0.40 0.00 0.00 176.91 179.24 2pzf h GLU 608 N 1.11 0.77 0.00 0.39 5.08 -1.96 -1.32 114.58 118.66 2pzf h GLU 608 Ca 0.34 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.50 2pzf h GLU 608 Cb -0.02 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 2pzf h GLU 608 CO -0.09 0.51 -0.73 0.45 -1.00 0.00 0.00 179.01 178.15 2pzf h HIS 609 N 0.80 0.00 -0.53 4.33 3.86 -1.65 -3.17 115.15 118.79 2pzf h HIS 609 Ca 0.48 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.57 2pzf h HIS 609 Cb 0.67 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 2pzf h HIS 609 CO -0.00 0.73 -0.12 -0.07 0.86 0.00 0.00 177.93 179.32 2pzf h LEU 610 N 0.00 1.02 -1.50 2.43 3.38 -0.88 -2.84 115.31 116.92 2pzf h LEU 610 Ca -0.01 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.66 2pzf h LEU 610 Cb 1.36 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.80 2pzf h LEU 610 CO 0.09 1.14 0.40 0.11 0.09 0.00 0.00 178.44 180.28 2pzf h LYS 611 N 0.89 0.61 -0.01 1.13 1.79 -1.27 -2.56 116.57 117.15 2pzf h LYS 611 Ca 0.13 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2pzf h LYS 611 Cb 0.69 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2pzf h LYS 611 CO 0.05 0.40 -0.36 1.63 -1.08 0.00 0.00 179.45 180.09 2pzf n LYS 612 N -4.47 0.60 -2.62 3.15 4.01 -1.19 -4.91 118.16 112.73 2pzf n LYS 612 Ca 0.08 -0.37 -0.36 0.00 -0.51 0.00 0.00 58.31 57.16 2pzf n LYS 612 Cb 0.20 -1.49 -0.05 0.00 -0.51 0.00 0.00 35.03 33.18 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 -2.65 3.05 0.22 7.82 0.00 -0.96 -4.97 121.76 124.26 2pzf s ALA 613 Ca 0.20 0.61 0.03 0.00 0.00 0.00 0.00 51.96 52.80 2pzf s ALA 613 Cb 0.19 -3.24 0.19 0.00 0.00 0.00 0.00 23.12 20.26 2pzf s ALA 613 CO 0.58 -0.13 1.52 -0.44 0.00 0.00 0.00 175.76 177.30 2pzf h ASP 614 N 2.31 0.32 -5.11 0.00 3.32 -1.30 -3.43 116.42 112.53 2pzf h ASP 614 Ca -0.48 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.29 2pzf h ASP 614 Cb 1.21 -0.09 -0.15 0.00 0.22 0.00 0.00 39.33 40.51 2pzf h ASP 614 CO 0.62 0.88 -0.31 -0.75 -1.72 0.00 0.00 179.24 177.96 2pzf s LYS 615 N -3.69 0.84 -0.04 3.56 2.47 -0.96 -4.65 119.74 117.26 2pzf s LYS 615 Ca -0.04 -0.77 0.02 0.00 -1.56 0.00 0.00 55.97 53.62 2pzf s LYS 615 Cb 0.12 0.35 0.01 0.00 -1.46 0.00 0.00 37.83 36.85 2pzf s LYS 615 CO 0.81 -0.27 -0.08 0.42 0.16 0.00 0.00 175.35 176.38 2pzf s ILE 616 N -3.34 0.78 -0.20 5.43 1.01 0.14 -1.19 121.20 123.83 2pzf s ILE 616 Ca 0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 60.65 60.36 2pzf s ILE 616 Cb 0.02 -0.74 0.02 0.00 0.01 0.00 0.00 42.46 41.77 2pzf s ILE 616 CO -0.08 0.27 -0.14 -0.22 0.00 0.00 0.00 174.94 174.76 2pzf s LEU 617 N 0.60 2.52 -0.24 2.97 2.96 -0.09 -1.66 118.68 125.75 2pzf s LEU 617 Ca -0.10 -0.69 -0.08 0.00 -0.22 0.00 0.00 54.13 53.04 2pzf s LEU 617 Cb -0.13 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2pzf s LEU 617 CO 0.01 -0.04 0.08 -0.63 -1.32 0.00 0.00 176.35 174.46 2pzf s ILE 618 N 1.32 4.56 0.06 6.68 1.01 0.11 -0.56 121.20 134.37 2pzf s ILE 618 Ca 0.03 -0.09 0.01 0.00 0.00 0.00 0.00 60.65 60.60 2pzf s ILE 618 Cb -0.14 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 2pzf s ILE 618 CO -0.09 0.36 0.13 -0.76 0.00 0.00 0.00 174.94 174.58 2pzf s LEU 619 N 1.30 4.06 -0.20 2.97 1.43 0.34 0.31 118.68 128.89 2pzf s LEU 619 Ca 0.05 0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 53.24 2pzf s LEU 619 Cb -0.15 -2.64 0.10 0.00 0.03 0.00 0.00 46.19 43.53 2pzf s LEU 619 CO 0.04 0.19 0.36 -2.28 0.23 0.00 0.00 176.35 174.89 2pzf s HIS 620 N -1.40 -0.69 -1.50 0.29 2.46 0.16 -4.14 115.29 110.46 2pzf s HIS 620 Ca 0.30 1.04 -0.12 0.00 0.47 0.00 0.00 55.06 56.75 2pzf s HIS 620 Cb -0.12 0.07 0.07 0.00 -0.13 0.00 0.00 32.58 32.47 2pzf s HIS 620 CO 0.23 -0.56 0.97 0.39 -2.47 0.00 0.00 174.74 173.30 2pzf n GLU 621 N 5.37 -5.62 0.00 2.88 1.02 -1.26 -2.37 120.64 120.66 2pzf n GLU 621 Ca -0.06 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2pzf n GLU 621 Cb 0.50 -5.48 0.00 0.00 -0.02 0.00 0.00 31.44 26.44 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 -1.70 1.64 3.56 0.62 0.00 0.19 -4.93 105.19 104.57 2pzf n GLY 622 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 2pzf n GLY 622 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pzf s SER 623 N -2.99 3.69 -0.19 1.61 1.04 -1.00 -0.30 113.70 115.56 2pzf s SER 623 Ca 0.00 -1.25 -0.29 0.00 0.48 0.00 0.00 55.95 54.88 2pzf s SER 623 Cb 0.00 -0.35 -0.01 0.00 0.10 0.00 0.00 66.02 65.76 2pzf s SER 623 CO 0.00 -0.30 1.25 -0.55 0.98 0.00 0.00 173.24 174.62 2pzf s SER 624 N -3.63 6.91 -0.01 7.02 0.15 -1.26 -0.67 113.70 122.21 2pzf s SER 624 Ca 0.33 1.58 0.04 0.00 0.70 0.00 0.00 55.95 58.60 2pzf s SER 624 Cb 0.05 -2.54 -0.25 0.00 -1.71 0.00 0.00 66.02 61.57 2pzf s SER 624 CO 0.17 -0.81 0.79 0.22 1.20 0.00 0.00 173.24 174.81 2pzf h TYR 625 N 8.33 0.22 -2.38 3.44 5.03 -0.47 -3.47 116.97 127.67 2pzf h TYR 625 Ca -0.26 -0.16 -0.07 0.00 2.58 0.00 0.00 58.73 60.82 2pzf h TYR 625 Cb 1.10 -0.01 -0.23 0.00 1.55 0.00 0.00 36.73 39.14 2pzf h TYR 625 CO 0.81 1.24 -0.10 0.12 -1.32 0.00 0.00 178.16 178.91 2pzf s PHE 626 N -2.62 -0.68 -0.04 -3.82 5.36 -1.05 -4.96 117.98 110.17 2pzf s PHE 626 Ca -0.08 1.55 0.01 0.00 -0.96 0.00 0.00 56.93 57.45 2pzf s PHE 626 Cb 0.08 0.29 0.02 0.00 -0.34 0.00 0.00 43.02 43.07 2pzf s PHE 626 CO 0.83 -0.34 -0.03 -0.47 -1.46 0.00 0.00 175.22 173.75 2pzf s TYR 627 N 0.74 0.59 -5.00 10.12 5.04 -1.26 0.10 117.35 127.68 2pzf s TYR 627 Ca -0.04 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 2pzf s TYR 627 Cb -0.05 -0.59 0.00 0.00 0.35 0.00 0.00 41.96 41.67 2pzf s TYR 627 CO -0.05 -0.18 0.00 0.41 -1.34 0.00 0.00 175.55 174.38 2pzf n GLY 628 N 4.17 -1.47 3.95 8.97 0.00 -0.66 -5.00 105.19 115.14 2pzf n GLY 628 Ca -0.24 -1.26 -0.25 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.88 2.23 0.22 2.61 -4.23 -1.26 0.25 115.64 112.58 2pzf s THR 629 Ca 0.00 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 2pzf s THR 629 Cb 0.00 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 2pzf s THR 629 CO 0.00 0.00 1.57 0.15 -0.54 0.00 0.00 174.62 175.80 2pzf h PHE 630 N -0.70 0.55 -0.32 3.99 3.57 -1.83 -1.56 116.94 120.64 2pzf h PHE 630 Ca -0.42 -0.18 0.06 0.00 3.53 0.00 0.00 57.97 60.96 2pzf h PHE 630 Cb 1.29 -0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.86 2pzf h PHE 630 CO -0.04 0.86 -0.08 0.77 -2.23 0.00 0.00 178.31 177.59 2pzf h SER 631 N 0.36 -0.30 -0.86 0.41 0.02 -1.95 0.28 113.55 111.50 2pzf h SER 631 Ca 0.02 0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2pzf h SER 631 Cb 1.00 0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.69 2pzf h SER 631 CO 0.09 -0.11 0.57 -0.33 -1.14 0.00 0.00 176.83 175.92 2pzf h GLU 632 N -0.00 1.14 -0.51 3.45 5.08 -1.89 -0.42 114.58 121.42 2pzf h GLU 632 Ca 0.15 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 2pzf h GLU 632 Cb 0.23 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2pzf h GLU 632 CO -0.33 0.75 0.02 1.25 -1.00 0.00 0.00 179.01 179.71 2pzf h LEU 633 N 1.17 0.86 -0.78 1.33 5.85 -0.96 -3.03 115.31 119.75 2pzf h LEU 633 Ca 0.32 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.81 2pzf h LEU 633 Cb -0.13 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.61 2pzf h LEU 633 CO -0.07 0.94 0.46 1.56 -0.34 0.00 0.00 178.44 181.00 2pzf h GLN 634 N 0.75 0.81 -0.02 1.25 4.20 -0.10 -2.31 115.11 119.69 2pzf h GLN 634 Ca 0.15 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.81 2pzf h GLN 634 Cb 0.49 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 2pzf h GLN 634 CO 0.02 0.54 0.09 -0.91 -0.67 0.00 0.00 178.83 177.90 2pzf h ASN 635 N 0.84 0.00 0.00 1.46 4.21 -0.95 -3.51 115.58 117.62 2pzf h ASN 635 Ca 0.35 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.86 2pzf h ASN 635 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 2pzf h ASN 635 CO -0.18 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.14 2pzf n LEU 636 N -3.22 0.00 0.00 1.61 4.32 -0.87 -5.11 117.00 113.72 2pzf n LEU 636 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 2pzf n LEU 636 Cb 0.16 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 2pzf n LEU 636 CO 0.20 0.00 0.00 -0.90 -1.22 0.00 0.00 177.39 175.47 2pzf n ASP 639 N 0.00 0.00 -0.26 -1.43 5.75 -1.26 -5.09 116.55 114.26 2pzf n ASP 639 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.84 2pzf n ASP 639 Cb 0.00 0.00 0.17 0.00 -1.03 0.00 0.00 41.12 40.26 2pzf n ASP 639 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2pzf h PHE 640 N 0.00 0.02 -0.99 2.11 3.04 -2.01 -1.17 116.94 117.93 2pzf h PHE 640 Ca 0.00 0.05 0.16 0.00 3.98 0.00 0.00 57.97 62.16 2pzf h PHE 640 Cb 0.00 0.11 -0.09 0.00 2.56 0.00 0.00 35.95 38.53 2pzf h PHE 640 CO 0.00 -0.23 0.62 0.66 -2.02 0.00 0.00 178.31 177.34 2pzf h SER 641 N 0.12 0.83 0.39 0.41 4.64 -1.98 0.23 113.55 118.19 2pzf h SER 641 Ca 0.43 0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.78 2pzf h SER 641 Cb 0.77 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 2pzf h SER 641 CO -0.65 0.38 -0.17 -1.28 -0.87 0.00 0.00 176.83 174.23 2pzf h SER 642 N 0.85 0.00 0.49 4.97 0.87 -1.59 -2.39 113.55 116.75 2pzf h SER 642 Ca 0.53 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.79 2pzf h SER 642 Cb 0.71 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.64 2pzf h SER 642 CO -0.31 0.17 -1.62 0.50 -0.53 0.00 0.00 176.83 175.05 2pzf h LYS 643 N 0.00 0.11 0.00 2.24 3.11 -1.00 -3.39 116.57 117.64 2pzf h LYS 643 Ca -0.00 -0.19 -0.16 0.00 -2.81 0.00 0.00 60.65 57.48 2pzf h LYS 643 Cb 0.42 0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 31.70 2pzf h LYS 643 CO 0.02 0.84 -0.78 1.25 -2.81 0.00 0.00 179.45 177.98 2pzf h LEU 644 N 0.03 0.00-10.05 5.20 7.12 -0.80 -3.46 115.31 113.36 2pzf h LEU 644 Ca -0.26 0.00 -0.53 0.00 0.13 0.00 0.00 57.88 57.22 2pzf h LEU 644 Cb 1.99 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 42.10 2pzf h LEU 644 CO 0.11 0.78 -0.15 -0.04 -0.13 0.00 0.00 178.44 179.00 2pzf s MET 645 N -3.16 3.68 0.00 1.25 1.00 -0.93 -4.98 119.30 116.15 2pzf s MET 645 Ca 0.00 0.07 0.27 0.00 0.00 0.00 0.00 55.69 56.03 2pzf s MET 645 Cb 0.11 -2.67 0.75 0.00 0.00 0.00 0.00 34.83 33.03 2pzf s MET 645 CO 0.78 0.27 1.58 0.41 0.00 0.00 0.00 175.02 178.06