#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ouv s HIS 447 N 0.00 3.72 -0.17 7.33 5.65 -1.26 -5.05 115.29 125.51 2ouv s HIS 447 Ca 0.00 1.62 -0.05 0.00 0.25 0.00 0.00 55.06 56.88 2ouv s HIS 447 Cb 0.00 -2.99 -0.03 0.00 -1.18 0.00 0.00 32.58 28.38 2ouv s HIS 447 CO 0.00 0.14 -0.01 -1.64 -0.65 0.00 0.00 174.74 172.58 2ouv s MET 448 N 0.41 3.73 0.57 2.88 1.00 -1.26 -5.10 119.30 121.54 2ouv s MET 448 Ca 0.45 -0.48 -0.17 0.00 0.00 0.00 0.00 55.69 55.49 2ouv s MET 448 Cb -0.21 -3.02 -0.04 0.00 0.00 0.00 0.00 34.83 31.56 2ouv s MET 448 CO 0.26 0.21 1.07 -1.12 0.00 0.00 0.00 175.02 175.44 2ouv s SER 449 N 0.48 5.78 0.20 3.03 0.01 -1.26 -5.06 113.70 116.87 2ouv s SER 449 Ca -0.01 1.93 0.07 0.00 1.31 0.00 0.00 55.95 59.25 2ouv s SER 449 Cb -0.14 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.50 2ouv s SER 449 CO 0.02 -1.17 -0.14 0.27 0.41 0.00 0.00 173.24 172.63 2ouv s ILE 450 N -2.22 1.68 0.72 1.44 -4.36 -1.26 -4.78 121.20 112.41 2ouv s ILE 450 Ca 0.66 -2.19 -0.10 0.00 -0.26 0.00 0.00 60.65 58.76 2ouv s ILE 450 Cb -0.18 -2.02 0.04 0.00 1.25 0.00 0.00 42.46 41.55 2ouv s ILE 450 CO 0.32 -0.61 1.08 0.00 0.24 0.00 0.00 174.94 175.98 2ouv s THR 452 N -3.35 3.71 0.28 0.00 -4.23 -1.26 -4.98 115.64 105.80 2ouv s THR 452 Ca 0.59 -0.52 -0.03 0.00 -1.18 0.00 0.00 61.69 60.54 2ouv s THR 452 Cb -0.11 -3.37 0.23 0.00 1.34 0.00 0.00 72.50 70.59 2ouv s THR 452 CO 0.49 -0.27 1.92 0.28 -0.54 0.00 0.00 174.62 176.50 2ouv h SER 453 N 0.32 0.99 -0.78 3.99 0.02 -2.00 -2.10 113.55 113.98 2ouv h SER 453 Ca -0.45 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.41 2ouv h SER 453 Cb 1.26 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.52 2ouv h SER 453 CO 0.56 0.77 0.38 -0.08 -1.14 0.00 0.00 176.83 177.32 2ouv h GLU 454 N 1.13 1.13 0.21 3.45 4.81 -1.98 -1.39 114.58 121.94 2ouv h GLU 454 Ca 0.29 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2ouv h GLU 454 Cb -0.03 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.15 2ouv h GLU 454 CO -0.05 0.86 -0.10 0.93 -0.73 0.00 0.00 179.01 179.92 2ouv h GLU 455 N 1.12 -0.27 0.00 1.92 5.08 -1.77 -0.88 114.58 119.78 2ouv h GLU 455 Ca 0.27 0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.53 2ouv h GLU 455 Cb 0.10 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2ouv h GLU 455 CO -0.04 -0.07 -0.56 0.11 -1.00 0.00 0.00 179.01 177.46 2ouv h TRP 456 N -0.44 0.00 -0.55 4.33 5.08 -1.48 -2.53 115.95 120.37 2ouv h TRP 456 Ca -0.03 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.83 2ouv h TRP 456 Cb 0.33 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.47 2ouv h TRP 456 CO -0.02 0.56 -0.10 1.96 -1.28 0.00 0.00 178.44 179.56 2ouv h GLN 457 N 0.00 1.02 -0.77 0.12 4.20 -1.19 -1.21 115.11 117.28 2ouv h GLN 457 Ca -0.01 -0.37 -0.05 0.00 0.06 0.00 0.00 58.65 58.28 2ouv h GLN 457 Cb 1.07 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.75 2ouv h GLN 457 CO 0.07 1.06 0.27 0.78 -0.67 0.00 0.00 178.83 180.34 2ouv h GLY 458 N 0.95 1.26 1.00 3.46 0.00 -0.98 -2.54 103.07 106.21 2ouv h GLY 458 Ca 0.14 -0.72 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 2ouv h GLY 458 CO 0.05 0.67 0.15 -2.00 0.00 0.00 0.00 176.54 175.41 2ouv h LEU 459 N 1.13 0.83 -1.91 3.11 5.85 -1.16 -2.63 115.31 120.52 2ouv h LEU 459 Ca 0.25 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2ouv h LEU 459 Cb 0.27 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2ouv h LEU 459 CO -0.01 0.84 0.07 0.24 -0.34 0.00 0.00 178.44 179.24 2ouv h MET 460 N 0.78 0.12 -0.01 1.25 2.86 -0.90 -1.86 114.93 117.17 2ouv h MET 460 Ca 0.18 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2ouv h MET 460 Cb 0.32 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2ouv h MET 460 CO -0.00 0.08 -0.06 1.04 1.06 0.00 0.00 176.91 179.03 2ouv n GLN 461 N -4.52 1.33 -2.56 1.72 1.13 -0.98 -4.92 117.38 108.57 2ouv n GLN 461 Ca -0.01 -0.68 -0.39 0.00 -1.94 0.00 0.00 57.00 53.98 2ouv n GLN 461 Cb 0.10 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.92 2ouv n GLN 461 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2ouv s PHE 462 N -2.14 3.54 -0.07 1.08 5.36 -0.70 -5.05 117.98 120.00 2ouv s PHE 462 Ca 0.36 1.72 0.00 0.00 -0.96 0.00 0.00 56.93 58.05 2ouv s PHE 462 Cb 0.21 -3.15 0.02 0.00 -0.34 0.00 0.00 43.02 39.76 2ouv s PHE 462 CO 0.39 -0.37 -0.04 0.99 -1.46 0.00 0.00 175.22 174.72 2ouv s THR 463 N -1.38 0.65 0.26 0.12 2.01 -1.26 -5.07 115.64 110.98 2ouv s THR 463 Ca 0.49 -0.12 -0.31 0.00 0.31 0.00 0.00 61.69 62.07 2ouv s THR 463 Cb -0.26 -0.70 -0.11 0.00 0.01 0.00 0.00 72.50 71.43 2ouv s THR 463 CO 0.34 0.28 1.62 -0.22 -0.69 0.00 0.00 174.62 175.94 2ouv s LEU 464 N 1.38 4.35 0.28 4.42 2.96 -1.26 -4.90 118.68 125.92 2ouv s LEU 464 Ca -0.03 2.90 -0.30 0.00 -0.22 0.00 0.00 54.13 56.48 2ouv s LEU 464 Cb -0.13 -3.62 -0.12 0.00 0.50 0.00 0.00 46.19 42.81 2ouv s LEU 464 CO -0.03 -0.91 1.56 -2.65 -1.32 0.00 0.00 176.35 172.99 2ouv n PRO 465 N 2.70 2.56 -0.13 0.98 -0.02 -1.26 -4.86 135.00 134.98 2ouv n PRO 465 Ca 0.10 0.91 0.16 0.00 -2.02 0.00 0.00 63.50 62.66 2ouv n PRO 465 Cb 0.37 -2.67 0.55 0.00 -0.02 0.00 0.00 33.50 31.73 2ouv n PRO 465 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2ouv h VAL 466 N 3.28 0.78 0.00 -1.45 3.04 -2.03 -1.42 116.25 118.45 2ouv h VAL 466 Ca -0.47 -0.11 -0.00 0.00 -1.01 0.00 0.00 66.70 65.11 2ouv h VAL 466 Cb 1.24 0.43 -0.00 0.00 -2.01 0.00 0.00 31.29 30.95 2ouv h VAL 466 CO 0.78 0.06 -0.01 0.08 -1.01 0.00 0.00 177.57 177.47 2ouv h ARG 467 N 0.32 0.00 -0.00 4.17 0.11 -2.03 -2.09 114.38 114.86 2ouv h ARG 467 Ca 0.34 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.42 2ouv h ARG 467 Cb 0.88 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.96 2ouv h ARG 467 CO -0.09 0.01 -0.33 1.28 0.10 0.00 0.00 179.97 180.93 2ouv n LEU 468 N -3.12 0.58 0.13 0.08 4.77 -0.54 -4.14 117.00 114.75 2ouv n LEU 468 Ca -0.01 -0.01 0.05 0.00 -0.03 0.00 0.00 56.01 56.00 2ouv n LEU 468 Cb 0.17 -0.23 0.50 0.00 -2.33 0.00 0.00 43.42 41.53 2ouv n LEU 468 CO 0.24 0.12 1.06 0.00 -1.33 0.00 0.00 177.39 177.48 2ouv h LYS 470 N 0.27 0.30 -0.55 0.00 3.64 -1.78 -3.39 116.57 115.07 2ouv h LYS 470 Ca 0.07 -0.52 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 2ouv h LYS 470 Cb 0.06 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 2ouv h LYS 470 CO -0.01 1.25 0.35 0.93 -2.27 0.00 0.00 179.45 179.70 2ouv h GLU 471 N -0.07 0.69 0.00 1.90 4.39 -1.68 -2.82 114.58 116.98 2ouv h GLU 471 Ca -0.35 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.31 2ouv h GLU 471 Cb 1.95 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 30.44 2ouv h GLU 471 CO 0.11 0.46 -0.00 0.97 -1.16 0.00 0.00 179.01 179.38 2ouv h ILE 472 N 0.71 0.19 0.00 3.13 2.10 -1.30 -1.64 117.51 120.70 2ouv h ILE 472 Ca 0.21 -0.03 0.00 0.00 1.08 0.00 0.00 64.86 66.12 2ouv h ILE 472 Cb -0.04 1.02 0.00 0.00 -1.09 0.00 0.00 36.82 36.71 2ouv h ILE 472 CO -0.06 0.00 0.00 -0.33 -1.08 0.00 0.00 178.15 176.68 2ouv h GLU 473 N 0.00 0.00 -6.83 2.19 4.39 -1.68 -3.46 114.58 109.20 2ouv h GLU 473 Ca -0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 2ouv h GLU 473 Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2ouv h GLU 473 CO 0.00 0.00 0.39 -0.51 -1.16 0.00 0.00 179.01 177.73 2ouv s LEU 474 N -5.91 4.48 0.36 1.33 1.43 -0.62 -4.86 118.68 114.89 2ouv s LEU 474 Ca 0.06 2.01 0.03 0.00 -1.03 0.00 0.00 54.13 55.20 2ouv s LEU 474 Cb 0.07 -3.80 0.67 0.00 0.03 0.00 0.00 46.19 43.16 2ouv s LEU 474 CO 0.61 -0.07 2.02 -0.26 0.23 0.00 0.00 176.35 178.88 2ouv h PHE 475 N 3.58 0.76 -0.22 0.29 -1.00 -1.87 -2.32 116.94 116.15 2ouv h PHE 475 Ca -0.46 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.33 2ouv h PHE 475 Cb 1.20 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 40.51 2ouv h PHE 475 CO 0.60 0.47 0.00 -2.39 -1.61 0.00 0.00 178.31 175.38 2ouv n HIS 476 N -4.45 0.29 -1.67 -0.55 1.44 -1.26 -4.90 115.22 104.12 2ouv n HIS 476 Ca 0.06 -0.15 -0.44 0.00 -2.01 0.00 0.00 57.72 55.18 2ouv n HIS 476 Cb 0.05 -0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.14 2ouv n HIS 476 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2ouv n PHE 477 N 0.14 2.14 -3.84 -1.40 7.35 -0.88 -4.49 117.46 116.48 2ouv n PHE 477 Ca 0.07 0.46 -0.36 0.00 -0.76 0.00 0.00 57.45 56.87 2ouv n PHE 477 Cb 0.19 -2.44 -0.13 0.00 0.35 0.00 0.00 39.48 37.44 2ouv n PHE 477 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2ouv s ASP 478 N 0.17 4.77 0.11 -2.13 3.68 -1.26 -4.97 116.67 117.04 2ouv s ASP 478 Ca 0.66 -0.71 0.28 0.00 2.13 0.00 0.00 52.55 54.91 2ouv s ASP 478 Cb -0.64 -1.79 1.02 0.00 -1.45 0.00 0.00 42.92 40.05 2ouv s ASP 478 CO 0.52 -0.14 1.85 2.30 0.13 0.00 0.00 175.17 179.82 2ouv n ILE 479 N 4.79 0.31 -0.33 4.11 -5.35 -1.26 -4.41 119.36 117.22 2ouv n ILE 479 Ca -0.16 -0.15 0.06 0.00 -0.27 0.00 0.00 62.75 62.24 2ouv n ILE 479 Cb 0.48 -0.55 0.14 0.00 -1.74 0.00 0.00 39.64 37.98 2ouv n ILE 479 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ouv n GLY 480 N 1.40 -1.51 0.00 3.28 0.00 -1.26 -1.02 105.19 106.09 2ouv n GLY 480 Ca 0.06 0.97 0.11 0.00 0.00 0.00 0.00 46.02 47.16 2ouv n GLY 480 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ouv n PRO 481 N -5.48 0.67 -2.67 1.61 -0.02 -1.26 -4.09 135.00 123.76 2ouv n PRO 481 Ca 0.15 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.42 2ouv n PRO 481 Cb 0.49 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.46 2ouv n PRO 481 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2ouv n PHE 482 N -1.01 2.67 -0.15 6.00 3.01 -0.18 -4.94 117.46 122.86 2ouv n PHE 482 Ca 0.16 -3.26 -0.04 0.00 1.01 0.00 0.00 57.45 55.33 2ouv n PHE 482 Cb 0.08 -0.26 0.03 0.00 -0.01 0.00 0.00 39.48 39.32 2ouv n PHE 482 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 2ouv h GLU 483 N 2.80 -0.02 0.00 -1.08 4.81 -1.74 0.16 114.58 119.51 2ouv h GLU 483 Ca 0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2ouv h GLU 483 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.30 2ouv h GLU 483 CO 0.72 -0.01 0.00 0.09 -0.73 0.00 0.00 179.01 179.08 2ouv n ASN 484 N -5.36 0.41 -0.21 1.04 3.02 -1.26 -1.74 115.26 111.17 2ouv n ASN 484 Ca 0.04 0.66 0.11 0.00 -0.03 0.00 0.00 54.58 55.35 2ouv n ASN 484 Cb 0.26 -0.72 -0.02 0.00 -0.61 0.00 0.00 39.78 38.69 2ouv n ASN 484 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2ouv n MET 485 N -2.02 0.51 -0.15 3.52 2.81 0.54 -4.64 117.12 117.70 2ouv n MET 485 Ca 0.00 -0.41 -0.03 0.00 -1.81 0.00 0.00 57.70 55.45 2ouv n MET 485 Cb 0.09 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.15 2ouv n MET 485 CO 0.00 0.00 0.00 -1.49 1.51 0.00 0.00 175.97 175.99 2ouv h TRP 486 N 1.01 -0.09 -0.81 2.03 6.55 -0.99 0.33 115.95 123.98 2ouv h TRP 486 Ca 0.00 0.04 -0.03 0.00 0.95 0.00 0.00 58.89 59.85 2ouv h TRP 486 Cb 0.60 0.11 -0.04 0.00 -0.86 0.00 0.00 29.16 28.98 2ouv h TRP 486 CO 0.00 -0.13 0.39 -1.35 -1.05 0.00 0.00 178.44 176.29 2ouv h PRO 487 N 0.08 1.16 -0.40 0.49 0.11 -1.82 -1.79 132.00 129.82 2ouv h PRO 487 Ca 0.24 -0.17 -0.08 0.00 0.11 0.00 0.00 66.00 66.10 2ouv h PRO 487 Cb 0.36 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2ouv h PRO 487 CO -0.42 0.89 -0.07 0.78 -0.21 0.00 0.00 178.00 178.96 2ouv h GLY 488 N 1.17 0.74 1.23 -0.55 0.00 -1.55 -1.59 103.07 102.52 2ouv h GLY 488 Ca 0.28 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 2ouv h GLY 488 CO -0.04 0.48 0.08 -2.22 0.00 0.00 0.00 176.54 174.85 2ouv h ILE 489 N 0.64 1.25 -0.33 2.60 2.04 0.14 -0.95 117.51 122.90 2ouv h ILE 489 Ca 0.12 -0.98 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 2ouv h ILE 489 Cb 0.51 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 2ouv h ILE 489 CO 0.03 0.36 0.01 0.15 0.00 0.00 0.00 178.15 178.69 2ouv h PHE 490 N 0.89 0.62 -0.74 1.37 3.57 -0.84 -1.69 116.94 120.12 2ouv h PHE 490 Ca 0.18 -0.11 0.03 0.00 3.53 0.00 0.00 57.97 61.61 2ouv h PHE 490 Cb 0.41 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 2ouv h PHE 490 CO 0.03 0.69 0.47 0.28 -2.23 0.00 0.00 178.31 177.54 2ouv h VAL 491 N 0.38 1.10 -0.41 1.41 2.07 -1.03 -1.42 116.25 118.35 2ouv h VAL 491 Ca 0.09 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.32 2ouv h VAL 491 Cb 0.43 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2ouv h VAL 491 CO 0.02 0.17 0.24 0.22 0.02 0.00 0.00 177.57 178.24 2ouv h TYR 492 N 0.91 0.46 -0.61 1.57 3.20 -0.95 -0.98 116.97 120.56 2ouv h TYR 492 Ca 0.30 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.12 2ouv h TYR 492 Cb 0.02 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 2ouv h TYR 492 CO -0.04 0.27 0.13 0.52 -1.64 0.00 0.00 178.16 177.40 2ouv h MET 493 N 0.49 0.96 -0.40 1.82 2.86 -0.84 -0.40 114.93 119.43 2ouv h MET 493 Ca 0.16 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2ouv h MET 493 Cb 0.00 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 2ouv h MET 493 CO -0.07 0.87 0.12 0.28 1.06 0.00 0.00 176.91 179.16 2ouv h VAL 494 N 0.92 1.22 -0.78 -2.22 2.07 -0.91 -1.12 116.25 115.43 2ouv h VAL 494 Ca 0.19 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 2ouv h VAL 494 Cb 0.35 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 2ouv h VAL 494 CO 0.00 0.26 0.29 0.45 0.02 0.00 0.00 177.57 178.59 2ouv h HIS 495 N 0.50 1.20 0.00 1.57 -0.00 -0.80 0.39 115.15 118.02 2ouv h HIS 495 Ca 0.13 -0.10 -0.19 0.00 -0.00 0.00 0.00 60.37 60.21 2ouv h HIS 495 Cb 0.28 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 27.31 2ouv h HIS 495 CO 0.01 0.92 -0.86 0.00 -0.00 0.00 0.00 177.93 178.01 2ouv h ARG 496 N 1.14 0.10 0.04 2.45 2.47 -0.97 -0.93 114.38 118.68 2ouv h ARG 496 Ca 0.26 -0.11 -0.23 0.00 -1.26 0.00 0.00 59.98 58.63 2ouv h ARG 496 Cb 0.25 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.58 2ouv h ARG 496 CO -0.02 0.89 -1.21 1.03 0.56 0.00 0.00 179.97 181.23 2ouv h SER 497 N 0.05 0.14 0.19 7.04 0.87 -1.08 -3.41 113.55 117.36 2ouv h SER 497 Ca -0.03 -0.71 -0.34 0.00 -1.23 0.00 0.00 61.79 59.48 2ouv h SER 497 Cb 1.49 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 63.35 2ouv h SER 497 CO 0.12 1.50 -2.10 0.00 -0.53 0.00 0.00 176.83 175.82 2ouv n GLY 499 N 1.80 2.35 0.23 0.00 0.00 -0.35 -4.56 105.19 104.65 2ouv n GLY 499 Ca -0.29 -2.04 0.14 0.00 0.00 0.00 0.00 46.02 43.84 2ouv n GLY 499 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ouv n THR 500 N 0.23 0.00 0.65 2.61 -2.24 -1.25 -3.59 114.28 110.68 2ouv n THR 500 Ca 0.00 -0.12 0.09 0.00 -2.27 0.00 0.00 64.05 61.76 2ouv n THR 500 Cb 0.00 0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.23 2ouv n THR 500 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2ouv n SER 501 N -0.59 0.77 -0.02 3.42 3.41 -1.26 -4.51 113.62 114.85 2ouv n SER 501 Ca 0.16 -0.68 -0.10 0.00 -0.26 0.00 0.00 58.87 58.00 2ouv n SER 501 Cb 0.29 1.26 -0.04 0.00 -0.26 0.00 0.00 64.21 65.47 2ouv n SER 501 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ouv s PHE 503 N -6.19 2.08 -0.12 0.00 0.08 -1.26 -5.04 117.98 107.52 2ouv s PHE 503 Ca -0.13 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.23 2ouv s PHE 503 Cb 0.09 -1.18 -0.04 0.00 -0.57 0.00 0.00 43.02 41.32 2ouv s PHE 503 CO 0.68 0.20 1.53 -1.21 -0.10 0.00 0.00 175.22 176.32 2ouv s GLU 504 N -1.63 4.13 0.25 0.44 2.02 -1.26 -4.89 118.70 117.76 2ouv s GLU 504 Ca 0.10 1.93 -0.10 0.00 0.02 0.00 0.00 54.97 56.93 2ouv s GLU 504 Cb -0.10 -3.93 0.38 0.00 0.10 0.00 0.00 34.13 30.59 2ouv s GLU 504 CO 0.04 -0.88 1.60 1.25 0.02 0.00 0.00 175.26 177.28 2ouv h LEU 505 N 10.34 -0.69 -0.27 1.80 5.85 -1.98 -0.20 115.31 130.16 2ouv h LEU 505 Ca -0.34 0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.62 2ouv h LEU 505 Cb 1.15 0.48 -0.02 0.00 0.37 0.00 0.00 40.66 42.65 2ouv h LEU 505 CO 0.97 -0.26 0.16 -0.08 -0.34 0.00 0.00 178.44 178.89 2ouv h GLU 506 N 0.01 0.33 -0.56 1.25 4.81 -1.98 -0.95 114.58 117.49 2ouv h GLU 506 Ca 0.41 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.58 2ouv h GLU 506 Cb 0.65 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2ouv h GLU 506 CO -0.82 0.22 0.19 0.87 -0.73 0.00 0.00 179.01 178.74 2ouv h LYS 507 N 0.34 0.85 -0.18 1.92 1.57 -1.54 -0.99 116.57 118.53 2ouv h LYS 507 Ca 0.10 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2ouv h LYS 507 Cb -0.02 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2ouv h LYS 507 CO -0.04 0.76 0.12 1.25 -0.57 0.00 0.00 179.45 180.97 2ouv h LEU 508 N 0.77 0.21 -0.86 2.94 5.85 -0.85 0.22 115.31 123.59 2ouv h LEU 508 Ca 0.18 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 2ouv h LEU 508 Cb 0.25 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2ouv h LEU 508 CO -0.01 0.17 0.08 0.00 -0.34 0.00 0.00 178.44 178.34 2ouv h ARG 510 N 0.88 0.51 -0.22 0.00 2.43 -0.85 -1.90 114.38 115.23 2ouv h ARG 510 Ca 0.18 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2ouv h ARG 510 Cb 0.40 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2ouv h ARG 510 CO 0.01 0.62 0.09 0.35 -1.51 0.00 0.00 179.97 179.53 2ouv h PHE 511 N 0.33 0.17 -0.10 2.20 3.57 -0.23 -1.51 116.94 121.37 2ouv h PHE 511 Ca 0.09 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2ouv h PHE 511 Cb 0.37 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2ouv h PHE 511 CO 0.03 0.09 0.05 0.82 -2.23 0.00 0.00 178.31 177.07 2ouv h ILE 512 N 0.21 1.01 0.00 1.41 2.04 -0.95 -0.46 117.51 120.77 2ouv h ILE 512 Ca 0.09 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 2ouv h ILE 512 Cb 0.05 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2ouv h ILE 512 CO -0.08 0.02 -0.23 0.24 0.00 0.00 0.00 178.15 178.10 2ouv h MET 513 N 0.12 0.00 0.06 2.37 2.86 -1.26 -1.98 114.93 117.09 2ouv h MET 513 Ca 0.04 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.39 2ouv h MET 513 Cb -0.01 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.68 2ouv h MET 513 CO -0.02 0.23 -1.14 0.77 1.06 0.00 0.00 176.91 177.81 2ouv h SER 514 N 0.00 0.88 -0.62 1.22 0.02 -0.92 -3.06 113.55 111.06 2ouv h SER 514 Ca -0.00 -0.76 0.04 0.00 -0.84 0.00 0.00 61.79 60.23 2ouv h SER 514 Cb 0.60 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.82 2ouv h SER 514 CO 0.03 1.56 0.36 0.58 -1.14 0.00 0.00 176.83 178.22 2ouv h VAL 515 N 0.33 1.02 -1.00 2.27 2.07 -0.75 -2.00 116.25 118.20 2ouv h VAL 515 Ca -0.16 -0.24 0.10 0.00 0.82 0.00 0.00 66.70 67.22 2ouv h VAL 515 Cb 1.80 0.26 -0.08 0.00 -1.52 0.00 0.00 31.29 31.76 2ouv h VAL 515 CO 0.22 0.13 0.64 0.50 0.02 0.00 0.00 177.57 179.07 2ouv h LYS 516 N 0.70 1.03 0.00 1.57 3.64 -1.36 -0.08 116.57 122.06 2ouv h LYS 516 Ca 0.27 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2ouv h LYS 516 Cb 0.10 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 2ouv h LYS 516 CO -0.14 0.68 0.00 1.63 -2.27 0.00 0.00 179.45 179.35 2ouv n LYS 517 N -4.56 0.53 -0.23 1.90 5.02 -0.76 -2.46 118.16 117.60 2ouv n LYS 517 Ca 0.17 0.04 0.06 0.00 -2.02 0.00 0.00 58.31 56.56 2ouv n LYS 517 Cb 0.28 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.96 2ouv n LYS 517 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ouv n ASN 518 N -1.12 3.09 -4.76 4.39 3.02 -0.05 -4.79 115.26 115.04 2ouv n ASN 518 Ca 0.14 -2.37 -0.33 0.00 -0.03 0.00 0.00 54.58 51.99 2ouv n ASN 518 Cb 0.11 -0.31 -0.07 0.00 -0.61 0.00 0.00 39.78 38.90 2ouv n ASN 518 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2ouv s TYR 519 N -1.66 3.26 0.32 3.10 1.51 -1.03 -1.55 117.35 121.30 2ouv s TYR 519 Ca 0.27 0.20 0.06 0.00 -1.01 0.00 0.00 57.07 56.59 2ouv s TYR 519 Cb 0.18 -1.74 -0.01 0.00 -0.11 0.00 0.00 41.96 40.28 2ouv s TYR 519 CO 0.11 0.54 0.45 1.03 -1.11 0.00 0.00 175.55 176.57 2ouv s ARG 520 N -1.61 3.17 -1.43 -0.62 0.52 -1.26 -4.92 118.95 112.79 2ouv s ARG 520 Ca 0.21 -0.97 -0.12 0.00 -0.52 0.00 0.00 55.73 54.33 2ouv s ARG 520 Cb -0.12 -2.83 0.06 0.00 0.52 0.00 0.00 34.95 32.58 2ouv s ARG 520 CO 0.12 0.12 2.24 0.54 0.02 0.00 0.00 175.30 178.34 2ouv n ARG 521 N -1.61 3.18 -4.11 3.54 1.74 -1.26 -4.57 116.66 113.56 2ouv n ARG 521 Ca -0.02 -2.79 -0.23 0.00 -0.77 0.00 0.00 57.85 54.04 2ouv n ARG 521 Cb 0.58 -3.13 -0.05 0.00 -1.02 0.00 0.00 32.46 28.84 2ouv n ARG 521 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2ouv s VAL 522 N 2.30 4.41 0.26 1.55 -7.23 -1.26 -5.05 120.40 115.39 2ouv s VAL 522 Ca 0.48 -1.33 -0.03 0.00 -1.81 0.00 0.00 61.98 59.29 2ouv s VAL 522 Cb 0.14 -3.34 0.25 0.00 0.56 0.00 0.00 36.38 33.99 2ouv s VAL 522 CO -0.07 -0.28 1.87 -0.65 -0.31 0.00 0.00 175.10 175.67 2ouv h PRO 523 N 1.79 1.07 0.00 4.82 0.11 -1.96 -3.41 132.00 134.41 2ouv h PRO 523 Ca -0.48 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2ouv h PRO 523 Cb 1.23 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2ouv h PRO 523 CO 0.61 0.71 -0.63 0.98 -0.21 0.00 0.00 178.00 179.46 2ouv n TYR 524 N -4.55 -0.06 -1.10 0.65 9.36 -1.26 -4.85 117.16 115.35 2ouv n TYR 524 Ca 0.15 0.01 -0.29 0.00 3.32 0.00 0.00 57.90 61.09 2ouv n TYR 524 Cb 0.19 0.04 -0.06 0.00 -0.63 0.00 0.00 39.34 38.88 2ouv n TYR 524 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2ouv n HIS 525 N -3.13 1.60 -3.93 2.98 -0.00 -1.26 -4.53 115.22 106.95 2ouv n HIS 525 Ca 0.00 -2.44 -0.15 0.00 -0.00 0.00 0.00 57.72 55.13 2ouv n HIS 525 Cb 0.31 -2.09 -0.01 0.00 -0.00 0.00 0.00 29.99 28.21 2ouv n HIS 525 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 2ouv n ASN 526 N 3.42 2.19 -0.25 0.41 0.23 -1.26 -4.64 115.26 115.36 2ouv n ASN 526 Ca 0.62 -2.06 -0.04 0.00 -0.53 0.00 0.00 54.58 52.57 2ouv n ASN 526 Cb 0.37 0.05 0.07 0.00 -2.08 0.00 0.00 39.78 38.18 2ouv n ASN 526 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 2ouv h TRP 527 N 0.76 0.85 -0.32 -2.53 2.91 -1.89 -2.09 115.95 113.64 2ouv h TRP 527 Ca -0.20 0.02 0.02 0.00 1.13 0.00 0.00 58.89 59.87 2ouv h TRP 527 Cb 0.68 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 29.01 2ouv h TRP 527 CO 0.00 0.51 0.16 -0.22 -1.03 0.00 0.00 178.44 177.86 2ouv h LYS 528 N 0.90 0.32 -0.82 2.65 3.64 -1.96 -1.83 116.57 119.47 2ouv h LYS 528 Ca 0.27 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 2ouv h LYS 528 Cb -0.04 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.65 2ouv h LYS 528 CO -0.08 0.21 0.53 1.25 -2.27 0.00 0.00 179.45 179.09 2ouv h HIS 529 N 0.33 0.99 -0.59 1.91 2.76 -1.71 -1.17 115.15 117.67 2ouv h HIS 529 Ca 0.14 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.35 2ouv h HIS 529 Cb 0.05 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.65 2ouv h HIS 529 CO -0.10 0.57 0.37 0.00 -1.30 0.00 0.00 177.93 177.47 2ouv h ALA 530 N 1.34 0.75 -0.18 5.26 0.00 -0.77 0.40 119.26 126.07 2ouv h ALA 530 Ca 0.33 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 2ouv h ALA 530 Cb 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2ouv h ALA 530 CO -0.12 0.13 -0.40 0.28 0.00 0.00 0.00 179.25 179.15 2ouv h VAL 531 N 0.75 1.30 -0.59 0.00 2.07 -0.89 -1.25 116.25 117.64 2ouv h VAL 531 Ca 0.23 -1.54 -0.04 0.00 0.82 0.00 0.00 66.70 66.17 2ouv h VAL 531 Cb -0.03 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2ouv h VAL 531 CO -0.07 0.47 0.23 0.74 0.02 0.00 0.00 177.57 178.96 2ouv h THR 532 N 0.34 1.23 -0.45 2.57 2.02 -0.48 -0.02 112.91 118.12 2ouv h THR 532 Ca 0.03 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.46 2ouv h THR 532 Cb 0.85 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2ouv h THR 532 CO 0.07 0.28 0.17 0.58 0.37 0.00 0.00 175.52 176.99 2ouv h VAL 533 N 0.82 1.21 -0.93 3.16 2.07 -0.65 -2.05 116.25 119.87 2ouv h VAL 533 Ca 0.20 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2ouv h VAL 533 Cb 0.21 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2ouv h VAL 533 CO -0.02 0.24 0.54 0.00 0.02 0.00 0.00 177.57 178.35 2ouv h ALA 534 N 1.02 1.18 -0.65 1.67 0.00 -0.92 -1.78 119.26 119.78 2ouv h ALA 534 Ca 0.15 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2ouv h ALA 534 Cb 0.21 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2ouv h ALA 534 CO -0.01 0.66 0.16 1.25 0.00 0.00 0.00 179.25 181.31 2ouv h HIS 535 N 1.29 1.09 -0.69 0.00 6.17 -0.70 0.09 115.15 122.39 2ouv h HIS 535 Ca 0.33 -0.13 -0.02 0.00 0.71 0.00 0.00 60.37 61.26 2ouv h HIS 535 Cb -0.02 -0.31 -0.03 0.00 2.52 0.00 0.00 27.41 29.57 2ouv h HIS 535 CO 0.01 0.90 0.35 0.00 0.71 0.00 0.00 177.93 179.90 2ouv h MET 537 N 0.95 1.11 -0.36 0.00 -1.53 -0.93 -0.51 114.93 113.66 2ouv h MET 537 Ca 0.24 -0.08 0.04 0.00 -3.44 0.00 0.00 59.70 56.46 2ouv h MET 537 Cb 0.08 -0.24 -0.04 0.00 -0.55 0.00 0.00 31.60 30.85 2ouv h MET 537 CO -0.03 0.75 0.14 -0.92 0.14 0.00 0.00 176.91 176.98 2ouv h TYR 538 N 1.13 0.25 -0.83 1.39 3.20 -0.23 0.14 116.97 122.02 2ouv h TYR 538 Ca 0.30 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 2ouv h TYR 538 Cb -0.10 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.07 2ouv h TYR 538 CO -0.01 0.11 0.38 0.00 -1.64 0.00 0.00 178.16 177.00 2ouv h ALA 539 N 1.22 1.07 -0.20 1.82 0.00 -0.48 0.18 119.26 122.86 2ouv h ALA 539 Ca 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2ouv h ALA 539 Cb 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2ouv h ALA 539 CO -0.16 0.65 0.01 0.82 0.00 0.00 0.00 179.25 180.57 2ouv h ILE 540 N 1.18 1.25 -0.34 0.00 2.04 -0.49 -2.39 117.51 118.75 2ouv h ILE 540 Ca 0.28 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 2ouv h ILE 540 Cb 0.14 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2ouv h ILE 540 CO -0.03 0.26 0.20 -0.07 0.00 0.00 0.00 178.15 178.51 2ouv h LEU 541 N 0.12 0.42 -1.26 1.44 3.38 -0.49 -2.44 115.31 116.48 2ouv h LEU 541 Ca 0.06 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2ouv h LEU 541 Cb 0.38 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2ouv h LEU 541 CO 0.01 0.35 0.15 1.56 0.09 0.00 0.00 178.44 180.61 2ouv h GLN 542 N 0.44 0.66 -0.00 1.13 1.08 -0.95 0.49 115.11 117.96 2ouv h GLN 542 Ca 0.12 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2ouv h GLN 542 Cb 0.02 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.33 2ouv h GLN 542 CO -0.02 0.57 -0.05 0.09 -0.95 0.00 0.00 178.83 178.47 2ouv n ASN 543 N -4.34 0.42 -2.18 1.46 3.02 -0.90 -3.79 115.26 108.95 2ouv n ASN 543 Ca 0.03 -0.77 -0.00 0.00 -0.03 0.00 0.00 54.58 53.81 2ouv n ASN 543 Cb 0.17 -0.07 0.04 0.00 -0.61 0.00 0.00 39.78 39.32 2ouv n ASN 543 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ouv n ASN 544 N -0.85 0.42 0.25 6.41 3.02 -0.85 -4.79 115.26 118.87 2ouv n ASN 544 Ca 0.18 -2.05 0.10 0.00 -0.03 0.00 0.00 54.58 52.77 2ouv n ASN 544 Cb 0.24 -0.08 0.64 0.00 -0.61 0.00 0.00 39.78 39.97 2ouv n ASN 544 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 2ouv h HIS 545 N 1.47 0.00 0.00 3.10 2.07 -0.14 -2.45 115.15 119.20 2ouv h HIS 545 Ca -0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 2ouv h HIS 545 Cb 1.46 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.44 2ouv h HIS 545 CO 0.20 0.15 0.00 0.25 -3.07 0.00 0.00 177.93 175.45 2ouv n THR 546 N -3.94 0.78 0.08 6.12 -2.24 -1.26 -2.94 114.28 110.88 2ouv n THR 546 Ca -0.02 0.17 0.05 0.00 -2.27 0.00 0.00 64.05 61.98 2ouv n THR 546 Cb 0.24 -0.93 -0.03 0.00 -2.10 0.00 0.00 70.33 67.51 2ouv n THR 546 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2ouv h LEU 547 N 0.00 0.00 -9.52 3.22 4.07 -1.82 -3.47 115.31 107.79 2ouv h LEU 547 Ca 0.00 0.00 -0.64 0.00 0.08 0.00 0.00 57.88 57.32 2ouv h LEU 547 Cb 0.34 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 41.97 2ouv h LEU 547 CO 0.00 0.36 -0.64 -0.36 -1.08 0.00 0.00 178.44 176.71 2ouv s PHE 548 N -3.08 3.03 0.65 1.13 0.40 -1.15 -5.12 117.98 113.84 2ouv s PHE 548 Ca -0.01 -0.01 -0.09 0.00 -0.60 0.00 0.00 56.93 56.22 2ouv s PHE 548 Cb 0.09 -1.54 0.01 0.00 0.51 0.00 0.00 43.02 42.08 2ouv s PHE 548 CO 0.79 0.49 1.02 0.95 0.70 0.00 0.00 175.22 179.17 2ouv s THR 549 N -1.38 3.71 0.24 0.64 -4.23 -1.26 -4.90 115.64 108.47 2ouv s THR 549 Ca 0.27 0.36 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 2ouv s THR 549 Cb -0.12 -3.52 0.23 0.00 1.34 0.00 0.00 72.50 70.43 2ouv s THR 549 CO 0.19 -0.64 1.90 0.44 -0.54 0.00 0.00 174.62 175.98 2ouv h ASP 550 N -0.44 1.11 -0.82 3.99 3.32 -2.00 -1.53 116.42 120.05 2ouv h ASP 550 Ca -0.45 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.51 2ouv h ASP 550 Cb 1.25 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 2ouv h ASP 550 CO 0.63 0.83 0.39 -0.07 -1.72 0.00 0.00 179.24 179.30 2ouv h LEU 551 N 1.29 1.09 -0.41 1.55 3.38 -2.00 -2.75 115.31 117.45 2ouv h LEU 551 Ca 0.34 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 2ouv h LEU 551 Cb -0.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.37 2ouv h LEU 551 CO -0.07 0.93 -0.25 -0.33 0.09 0.00 0.00 178.44 178.81 2ouv h GLU 552 N 1.18 0.90 0.34 1.13 5.08 -1.79 -1.23 114.58 120.20 2ouv h GLU 552 Ca 0.28 -0.42 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2ouv h GLU 552 Cb 0.13 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2ouv h GLU 552 CO -0.03 1.07 -0.27 0.00 -1.00 0.00 0.00 179.01 178.78 2ouv h ARG 553 N 0.73 -0.59 -0.55 2.33 3.08 -1.09 0.22 114.38 118.51 2ouv h ARG 553 Ca 0.09 0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.08 2ouv h ARG 553 Cb 0.83 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 2ouv h ARG 553 CO 0.07 -0.39 -0.01 1.57 -1.07 0.00 0.00 179.97 180.13 2ouv h LYS 554 N -0.61 0.98 -0.43 0.04 2.10 -1.55 -2.48 116.57 114.61 2ouv h LYS 554 Ca -0.03 -0.32 -0.01 0.00 -2.00 0.00 0.00 60.65 58.30 2ouv h LYS 554 Cb 0.54 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 31.76 2ouv h LYS 554 CO -0.01 0.99 0.23 0.78 -2.00 0.00 0.00 179.45 179.44 2ouv h GLY 555 N 0.86 0.65 1.30 0.07 0.00 -1.05 -2.65 103.07 102.25 2ouv h GLY 555 Ca 0.15 -0.30 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 2ouv h GLY 555 CO 0.03 0.29 -0.14 1.41 0.00 0.00 0.00 176.54 178.13 2ouv h LEU 556 N 0.56 0.82 -0.57 3.11 3.38 -0.46 -0.08 115.31 122.08 2ouv h LEU 556 Ca 0.15 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 2ouv h LEU 556 Cb 0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2ouv h LEU 556 CO -0.02 0.96 -0.15 -0.07 0.09 0.00 0.00 178.44 179.25 2ouv h LEU 557 N 0.74 1.00 -0.53 1.67 3.38 -1.41 -1.26 115.31 118.89 2ouv h LEU 557 Ca 0.12 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.64 2ouv h LEU 557 Cb 0.64 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2ouv h LEU 557 CO 0.04 1.13 -0.05 0.40 0.09 0.00 0.00 178.44 180.06 2ouv h ILE 558 N 0.87 1.27 -0.61 1.22 1.08 -1.32 -2.24 117.51 117.78 2ouv h ILE 558 Ca 0.13 -1.18 0.00 0.00 -0.39 0.00 0.00 64.86 63.42 2ouv h ILE 558 Cb 0.72 0.95 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 2ouv h ILE 558 CO 0.05 0.42 0.40 0.00 -0.69 0.00 0.00 178.15 178.33 2ouv h ALA 559 N 0.93 0.77 -0.41 1.87 0.00 -0.78 -1.65 119.26 119.99 2ouv h ALA 559 Ca 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2ouv h ALA 559 Cb 0.60 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2ouv h ALA 559 CO 0.04 0.22 0.21 0.00 0.00 0.00 0.00 179.25 179.71 2ouv h LEU 561 N 0.53 0.44 -1.87 0.00 5.85 -1.10 -2.88 115.31 116.28 2ouv h LEU 561 Ca 0.14 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2ouv h LEU 561 Cb 0.09 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.01 2ouv h LEU 561 CO -0.02 0.41 0.00 0.00 -0.34 0.00 0.00 178.44 178.49 2ouv h HIS 563 N 4.45 0.00 0.00 0.00 2.07 -0.10 -2.52 115.15 119.05 2ouv h HIS 563 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 2ouv h HIS 563 Cb 0.95 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.91 2ouv h HIS 563 CO 0.02 0.00 -0.22 0.09 -3.07 0.00 0.00 177.93 174.75 2ouv n ASN 564 N -3.34 1.92 -4.61 3.10 5.03 -1.26 -4.86 115.26 111.23 2ouv n ASN 564 Ca -0.02 -3.18 -0.50 0.00 0.87 0.00 0.00 54.58 51.75 2ouv n ASN 564 Cb 0.17 -0.43 -0.05 0.00 -1.02 0.00 0.00 39.78 38.45 2ouv n ASN 564 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2ouv n LEU 565 N -1.15 2.05 -1.82 3.41 4.77 -0.95 -1.90 117.00 121.41 2ouv n LEU 565 Ca 0.15 1.12 -0.18 0.00 -0.03 0.00 0.00 56.01 57.07 2ouv n LEU 565 Cb 0.68 -1.26 -0.03 0.00 -2.33 0.00 0.00 43.42 40.47 2ouv n LEU 565 CO -0.01 -0.87 -0.21 -0.67 -1.33 0.00 0.00 177.39 174.30 2ouv n ASP 566 N 2.64 -5.22 -4.74 -1.43 2.03 -0.59 -4.46 116.55 104.77 2ouv n ASP 566 Ca 0.17 0.15 -0.41 0.00 0.52 0.00 0.00 54.79 55.22 2ouv n ASP 566 Cb 0.23 -4.30 -0.03 0.00 -0.72 0.00 0.00 41.12 36.30 2ouv n ASP 566 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2ouv s HIS 567 N -2.82 3.39 -2.43 -0.67 2.46 -0.80 -4.92 115.29 109.50 2ouv s HIS 567 Ca 0.00 1.39 0.21 0.00 0.47 0.00 0.00 55.06 57.12 2ouv s HIS 567 Cb 0.00 -3.47 0.26 0.00 -0.13 0.00 0.00 32.58 29.24 2ouv s HIS 567 CO 0.00 -1.34 1.23 0.54 -2.47 0.00 0.00 174.74 172.70 2ouv n ARG 568 N 2.49 2.09 -0.05 2.88 1.74 -1.26 -4.43 116.66 120.12 2ouv n ARG 568 Ca 0.05 -1.92 0.00 0.00 -0.77 0.00 0.00 57.85 55.20 2ouv n ARG 568 Cb 0.44 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 2ouv n ARG 568 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ouv n GLY 569 N 1.23 0.62 3.83 -0.13 0.00 -1.26 -5.01 105.19 104.48 2ouv n GLY 569 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2ouv n GLY 569 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ouv s PHE 570 N -2.08 3.29 0.63 1.61 0.40 -1.26 -4.33 117.98 116.24 2ouv s PHE 570 Ca 0.00 0.09 -0.08 0.00 -0.60 0.00 0.00 56.93 56.35 2ouv s PHE 570 Cb 0.00 -1.63 0.01 0.00 0.51 0.00 0.00 43.02 41.91 2ouv s PHE 570 CO 0.00 0.53 0.97 -1.54 0.70 0.00 0.00 175.22 175.88 2ouv s SER 571 N -2.72 5.55 0.25 1.36 1.04 -1.26 -4.96 113.70 112.95 2ouv s SER 571 Ca 0.32 0.86 -0.01 0.00 0.48 0.00 0.00 55.95 57.60 2ouv s SER 571 Cb -0.12 -1.79 0.31 0.00 0.10 0.00 0.00 66.02 64.53 2ouv s SER 571 CO 0.24 -1.15 1.69 0.78 0.98 0.00 0.00 173.24 175.78 2ouv h ASN 572 N -0.34 0.65 -0.51 7.02 2.35 -1.99 -2.31 115.58 120.45 2ouv h ASN 572 Ca -0.45 -0.21 0.04 0.00 -0.55 0.00 0.00 56.30 55.12 2ouv h ASN 572 Cb 1.25 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 39.41 2ouv h ASN 572 CO 0.62 0.85 0.28 -1.28 -1.65 0.00 0.00 177.43 176.24 2ouv h SER 573 N 0.58 0.42 0.27 5.81 0.87 -1.98 -0.26 113.55 119.26 2ouv h SER 573 Ca 0.09 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 2ouv h SER 573 Cb 0.65 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2ouv h SER 573 CO 0.05 0.29 -0.16 0.22 -0.53 0.00 0.00 176.83 176.70 2ouv h TYR 574 N 0.54 -0.42 -0.92 2.24 3.20 -1.85 0.45 116.97 120.20 2ouv h TYR 574 Ca 0.22 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.11 2ouv h TYR 574 Cb 0.09 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 2ouv h TYR 574 CO -0.09 -0.26 0.60 -0.07 -1.64 0.00 0.00 178.16 176.71 2ouv h LEU 575 N -0.41 1.01 -0.02 2.82 3.38 -1.14 -1.33 115.31 119.61 2ouv h LEU 575 Ca -0.03 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 2ouv h LEU 575 Cb 0.34 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.87 2ouv h LEU 575 CO 0.03 0.70 -0.67 1.56 0.09 0.00 0.00 178.44 180.15 2ouv h GLN 576 N 1.17 0.50 -0.51 1.13 4.20 -0.85 0.10 115.11 120.85 2ouv h GLN 576 Ca 0.36 -0.50 0.05 0.00 0.06 0.00 0.00 58.65 58.62 2ouv h GLN 576 Cb -0.02 0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.87 2ouv h GLN 576 CO -0.10 1.14 0.34 -0.22 -0.67 0.00 0.00 178.83 179.32 2ouv h LYS 577 N 0.05 0.46 -0.31 1.46 3.64 0.19 -2.41 116.57 119.64 2ouv h LYS 577 Ca -0.08 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2ouv h LYS 577 Cb 1.36 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2ouv h LYS 577 CO 0.13 0.30 0.00 1.19 -2.27 0.00 0.00 179.45 178.81 2ouv n PHE 578 N -4.47 1.14 -4.08 1.91 3.72 -0.53 -5.00 117.46 110.14 2ouv n PHE 578 Ca 0.07 -0.88 -0.44 0.00 -0.05 0.00 0.00 57.45 56.14 2ouv n PHE 578 Cb 0.23 -0.35 0.01 0.00 -0.94 0.00 0.00 39.48 38.42 2ouv n PHE 578 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2ouv n ASP 579 N -0.36 -3.61 -4.80 4.37 8.00 -0.86 -4.91 116.55 114.38 2ouv n ASP 579 Ca 0.23 -1.29 -0.35 0.00 0.71 0.00 0.00 54.79 54.09 2ouv n ASP 579 Cb 0.95 -1.76 -0.05 0.00 -0.02 0.00 0.00 41.12 40.24 2ouv n ASP 579 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2ouv s HIS 580 N -3.62 3.27 0.31 1.24 5.65 0.29 -4.91 115.29 117.53 2ouv s HIS 580 Ca 0.44 1.64 0.09 0.00 0.25 0.00 0.00 55.06 57.47 2ouv s HIS 580 Cb -0.24 -3.00 0.88 0.00 -1.18 0.00 0.00 32.58 29.04 2ouv s HIS 580 CO 0.97 -0.40 1.69 -1.35 -0.65 0.00 0.00 174.74 175.00 2ouv h PRO 581 N 2.19 0.41 -0.42 2.88 0.11 -1.90 0.28 132.00 135.53 2ouv h PRO 581 Ca -0.49 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2ouv h PRO 581 Cb 1.20 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2ouv h PRO 581 CO 0.61 0.27 0.11 1.25 -0.21 0.00 0.00 178.00 180.03 2ouv h LEU 582 N 0.42 0.58 -1.39 2.35 5.85 -1.94 -1.06 115.31 120.12 2ouv h LEU 582 Ca 0.64 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 59.22 2ouv h LEU 582 Cb 1.29 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2ouv h LEU 582 CO -0.55 0.57 -0.25 0.00 -0.34 0.00 0.00 178.44 177.88 2ouv h ALA 583 N 1.51 1.17 -0.20 1.25 0.00 -0.67 -0.04 119.26 122.28 2ouv h ALA 583 Ca 0.14 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 2ouv h ALA 583 Cb 0.22 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2ouv h ALA 583 CO -0.00 0.31 -0.61 0.00 0.00 0.00 0.00 179.25 178.94 2ouv h ALA 584 N 1.75 0.54 -0.01 0.00 0.00 -0.70 -2.99 119.26 117.85 2ouv h ALA 584 Ca -0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2ouv h ALA 584 Cb 0.62 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2ouv h ALA 584 CO 0.03 0.69 -0.07 -0.07 0.00 0.00 0.00 179.25 179.84 2ouv h LEU 585 N 0.51 0.08 -7.62 0.00 3.38 -1.04 -3.41 115.31 107.21 2ouv h LEU 585 Ca -0.01 -0.67 -0.66 0.00 0.09 0.00 0.00 57.88 56.63 2ouv h LEU 585 Cb 1.20 -0.02 -0.40 0.00 0.09 0.00 0.00 40.66 41.53 2ouv h LEU 585 CO 0.12 0.74 -0.68 -0.31 0.09 0.00 0.00 178.44 178.41 2ouv s TYR 586 N -3.53 3.60 0.25 1.13 2.02 -0.07 -4.98 117.35 115.77 2ouv s TYR 586 Ca -0.16 -3.00 0.30 0.00 -0.37 0.00 0.00 57.07 53.83 2ouv s TYR 586 Cb 0.01 -2.93 1.35 0.00 -0.40 0.00 0.00 41.96 39.98 2ouv s TYR 586 CO 0.70 -0.90 2.00 0.66 -1.57 0.00 0.00 175.55 176.44 2ouv h SER 587 N 7.35 0.00 -4.49 2.29 4.64 -1.76 -3.37 113.55 118.21 2ouv h SER 587 Ca -0.06 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.89 2ouv h SER 587 Cb 0.99 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.87 2ouv h SER 587 CO 0.58 0.10 -0.76 0.28 -0.87 0.00 0.00 176.83 176.16 2ouv s THR 588 N -3.85 1.00 -1.63 2.95 -1.32 -1.26 -4.77 115.64 106.75 2ouv s THR 588 Ca -0.01 -1.34 -0.13 0.00 -1.21 0.00 0.00 61.69 59.01 2ouv s THR 588 Cb 0.11 -1.06 0.11 0.00 -1.51 0.00 0.00 72.50 70.16 2ouv s THR 588 CO 0.57 -0.31 0.64 -1.20 -2.21 0.00 0.00 174.62 172.11 2ouv n SER 589 N 1.16 -2.23 -0.13 8.08 7.64 -1.26 -4.81 113.62 122.07 2ouv n SER 589 Ca -0.20 -1.04 -0.08 0.00 1.01 0.00 0.00 58.87 58.56 2ouv n SER 589 Cb 0.55 -2.71 -0.06 0.00 -1.01 0.00 0.00 64.21 60.98 2ouv n SER 589 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2ouv h THR 590 N -1.58 0.00 -0.81 0.44 2.02 -1.86 -1.11 112.91 110.00 2ouv h THR 590 Ca -0.61 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.58 2ouv h THR 590 Cb 1.38 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 2ouv h THR 590 CO 0.74 0.00 0.53 0.24 0.37 0.00 0.00 175.52 177.40 2ouv h MET 591 N -0.19 1.07 -0.73 6.66 2.86 -1.90 -2.72 114.93 119.97 2ouv h MET 591 Ca 0.06 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2ouv h MET 591 Cb 0.35 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 2ouv h MET 591 CO -0.43 0.72 0.36 0.93 1.06 0.00 0.00 176.91 179.55 2ouv h GLU 592 N 1.10 1.05 -0.40 1.72 3.07 -1.81 0.11 114.58 119.43 2ouv h GLU 592 Ca 0.30 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 58.96 2ouv h GLU 592 Cb -0.11 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.59 2ouv h GLU 592 CO -0.06 0.82 0.05 1.96 -1.40 0.00 0.00 179.01 180.37 2ouv h GLN 593 N 1.03 0.62 -0.41 2.33 4.20 -1.05 -2.05 115.11 119.77 2ouv h GLN 593 Ca 0.25 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 2ouv h GLN 593 Cb 0.10 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2ouv h GLN 593 CO -0.03 0.60 -0.07 1.25 -0.67 0.00 0.00 178.83 179.92 2ouv h HIS 594 N 0.59 0.85 -0.99 2.96 2.76 -1.02 -2.18 115.15 118.12 2ouv h HIS 594 Ca 0.13 -0.17 0.03 0.00 -2.20 0.00 0.00 60.37 58.15 2ouv h HIS 594 Cb 0.31 -0.21 -0.05 0.00 1.55 0.00 0.00 27.41 29.00 2ouv h HIS 594 CO 0.01 0.87 0.65 0.45 -1.30 0.00 0.00 177.93 178.62 2ouv h HIS 595 N 0.59 1.23 -0.39 5.26 3.86 -0.28 -1.32 115.15 124.09 2ouv h HIS 595 Ca 0.11 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.23 2ouv h HIS 595 Cb 0.58 -0.41 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 2ouv h HIS 595 CO 0.05 0.73 -0.22 0.35 0.86 0.00 0.00 177.93 179.70 2ouv h PHE 596 N 1.29 0.98 -0.65 2.45 3.57 -1.23 -1.73 116.94 121.61 2ouv h PHE 596 Ca 0.38 -0.25 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2ouv h PHE 596 Cb -0.06 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.43 2ouv h PHE 596 CO -0.00 1.02 0.42 0.66 -2.23 0.00 0.00 178.31 178.18 2ouv h SER 597 N 0.65 0.76 -0.37 0.41 4.64 -0.97 -0.51 113.55 118.16 2ouv h SER 597 Ca 0.08 -0.03 -0.10 0.00 -0.47 0.00 0.00 61.79 61.27 2ouv h SER 597 Cb 0.78 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 2ouv h SER 597 CO 0.06 0.57 -0.14 1.56 -0.87 0.00 0.00 176.83 178.01 2ouv h GLN 598 N 0.89 0.83 -0.44 4.77 1.08 -1.02 -1.80 115.11 119.41 2ouv h GLN 598 Ca 0.24 -0.30 -0.06 0.00 -1.45 0.00 0.00 58.65 57.08 2ouv h GLN 598 Cb -0.07 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 2ouv h GLN 598 CO -0.05 0.92 0.06 1.15 -0.95 0.00 0.00 178.83 179.96 2ouv h THR 599 N 0.74 1.25 -0.63 -0.54 2.02 -0.36 -2.31 112.91 113.08 2ouv h THR 599 Ca 0.12 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.35 2ouv h THR 599 Cb 0.65 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2ouv h THR 599 CO 0.05 0.32 0.28 0.58 0.37 0.00 0.00 175.52 177.12 2ouv h VAL 600 N 0.60 1.22 -0.90 3.16 2.07 -0.97 -1.71 116.25 119.73 2ouv h VAL 600 Ca 0.13 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 67.04 2ouv h VAL 600 Cb 0.40 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 2ouv h VAL 600 CO 0.01 0.27 0.58 0.28 0.02 0.00 0.00 177.57 178.73 2ouv h SER 601 N 0.87 0.94 -0.31 0.57 0.02 -1.12 -1.68 113.55 112.85 2ouv h SER 601 Ca 0.21 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 2ouv h SER 601 Cb 0.16 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2ouv h SER 601 CO -0.02 0.63 -0.13 0.40 -1.14 0.00 0.00 176.83 176.57 2ouv h ILE 602 N 1.09 1.29 0.00 3.27 2.04 -1.08 -2.92 117.51 121.20 2ouv h ILE 602 Ca 0.38 -1.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 2ouv h ILE 602 Cb 0.08 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2ouv h ILE 602 CO -0.14 0.39 -0.02 -0.07 0.00 0.00 0.00 178.15 178.31 2ouv h LEU 603 N 0.39 0.00 -1.36 1.44 3.38 -0.74 -1.40 115.31 117.03 2ouv h LEU 603 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2ouv h LEU 603 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2ouv h LEU 603 CO 0.04 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.59 2ouv n GLN 604 N -3.33 1.92 -2.73 1.13 6.02 -0.68 -3.40 117.38 116.31 2ouv n GLN 604 Ca -0.02 -1.35 -0.33 0.00 -0.01 0.00 0.00 57.00 55.28 2ouv n GLN 604 Cb 0.12 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 29.86 2ouv n GLN 604 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2ouv s LEU 605 N -1.89 3.91 0.18 1.08 1.43 -0.53 -4.97 118.68 117.91 2ouv s LEU 605 Ca 0.34 1.77 -0.33 0.00 -1.03 0.00 0.00 54.13 54.89 2ouv s LEU 605 Cb 0.20 -4.54 -0.14 0.00 0.03 0.00 0.00 46.19 41.75 2ouv s LEU 605 CO 0.31 -0.50 1.57 1.21 0.23 0.00 0.00 176.35 179.17 2ouv n GLU 606 N -0.73 2.21 -1.00 1.70 2.13 -1.26 -1.44 120.64 122.24 2ouv n GLU 606 Ca 0.08 0.79 -0.00 0.00 0.66 0.00 0.00 57.16 58.69 2ouv n GLU 606 Cb 0.53 -2.56 -0.00 0.00 0.27 0.00 0.00 31.44 29.69 2ouv n GLU 606 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ouv n GLY 607 N 3.25 0.28 0.30 8.31 0.00 -1.26 -4.85 105.19 111.22 2ouv n GLY 607 Ca 0.16 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.22 2ouv n GLY 607 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ouv n HIS 608 N -2.54 0.00 -2.60 1.61 8.25 -0.52 -4.67 115.22 114.75 2ouv n HIS 608 Ca -0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 2ouv n HIS 608 Cb 0.23 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.32 2ouv n HIS 608 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2ouv s ASN 609 N -1.13 6.63 0.00 0.41 2.47 -1.22 -4.59 114.94 117.51 2ouv s ASN 609 Ca 0.10 -1.84 0.11 0.00 0.42 0.00 0.00 52.86 51.65 2ouv s ASN 609 Cb 0.08 -2.56 0.46 0.00 -1.45 0.00 0.00 41.25 37.78 2ouv s ASN 609 CO 0.20 -1.36 1.33 2.30 -3.72 0.00 0.00 177.10 175.85 2ouv n ILE 610 N 6.58 1.24 -0.49 -5.21 -5.35 -1.26 -2.20 119.36 112.67 2ouv n ILE 610 Ca 0.37 0.31 0.08 0.00 -0.27 0.00 0.00 62.75 63.24 2ouv n ILE 610 Cb 0.49 -1.13 0.23 0.00 -1.74 0.00 0.00 39.64 37.50 2ouv n ILE 610 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2ouv n PHE 611 N -1.49 0.83 0.14 4.28 0.99 -1.26 -4.67 117.46 116.28 2ouv n PHE 611 Ca 0.03 -0.62 0.17 0.00 -0.00 0.00 0.00 57.45 57.03 2ouv n PHE 611 Cb 0.12 -0.14 0.75 0.00 -1.00 0.00 0.00 39.48 39.21 2ouv n PHE 611 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2ouv h SER 612 N 2.56 0.00 1.19 4.37 4.64 -1.85 -1.24 113.55 123.22 2ouv h SER 612 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ouv h SER 612 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2ouv h SER 612 CO 0.10 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.41 2ouv n THR 613 N -4.09 0.61 -2.45 2.95 -2.24 -1.26 -4.83 114.28 102.97 2ouv n THR 613 Ca 0.04 -0.10 -0.32 0.00 -2.27 0.00 0.00 64.05 61.40 2ouv n THR 613 Cb 0.40 -0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 67.85 2ouv n THR 613 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ouv s LEU 614 N -4.29 3.67 0.87 3.22 1.43 -0.47 -5.05 118.68 118.06 2ouv s LEU 614 Ca 0.09 1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 54.69 2ouv s LEU 614 Cb 0.12 -4.52 0.11 0.00 0.03 0.00 0.00 46.19 41.94 2ouv s LEU 614 CO 0.52 -0.59 1.09 -0.94 0.23 0.00 0.00 176.35 176.66 2ouv s SER 615 N -2.89 3.76 0.26 2.29 1.04 -1.26 -4.69 113.70 112.21 2ouv s SER 615 Ca 0.60 1.45 -0.03 0.00 0.48 0.00 0.00 55.95 58.45 2ouv s SER 615 Cb -0.10 -2.14 0.39 0.00 0.10 0.00 0.00 66.02 64.27 2ouv s SER 615 CO 0.28 -2.45 1.87 0.77 0.98 0.00 0.00 173.24 174.70 2ouv h SER 616 N -1.42 0.99 -0.25 7.02 4.64 -1.97 0.21 113.55 122.77 2ouv h SER 616 Ca -0.49 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 2ouv h SER 616 Cb 1.28 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2ouv h SER 616 CO 0.56 0.63 0.11 0.28 -0.87 0.00 0.00 176.83 177.54 2ouv h SER 617 N 1.12 0.34 0.07 4.97 0.02 -2.00 -2.05 113.55 116.03 2ouv h SER 617 Ca 0.42 -0.14 -0.16 0.00 -0.84 0.00 0.00 61.79 61.07 2ouv h SER 617 Cb 0.18 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2ouv h SER 617 CO -0.18 0.38 -0.55 -0.33 -1.14 0.00 0.00 176.83 175.02 2ouv h GLU 618 N 0.27 0.51 -0.42 3.45 5.08 -1.78 -2.14 114.58 119.55 2ouv h GLU 618 Ca 0.09 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2ouv h GLU 618 Cb 0.14 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2ouv h GLU 618 CO -0.01 0.92 0.26 -0.92 -1.00 0.00 0.00 179.01 178.27 2ouv h TYR 619 N 0.39 0.54 -0.69 4.33 3.20 -0.52 0.78 116.97 125.00 2ouv h TYR 619 Ca 0.01 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2ouv h TYR 619 Cb 1.08 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 39.14 2ouv h TYR 619 CO 0.04 0.36 0.35 1.49 -1.64 0.00 0.00 178.16 178.75 2ouv h GLU 620 N 0.56 0.98 -0.23 1.82 4.81 -1.28 -1.80 114.58 119.43 2ouv h GLU 620 Ca 0.15 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 2ouv h GLU 620 Cb -0.04 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 2ouv h GLU 620 CO -0.03 0.74 0.03 1.96 -0.73 0.00 0.00 179.01 180.98 2ouv h GLN 621 N 0.98 0.38 -0.28 1.92 4.20 -0.62 -2.03 115.11 119.67 2ouv h GLN 621 Ca 0.24 -0.11 -0.09 0.00 0.06 0.00 0.00 58.65 58.75 2ouv h GLN 621 Cb 0.08 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2ouv h GLN 621 CO -0.03 0.54 -0.22 -0.24 -0.67 0.00 0.00 178.83 178.20 2ouv h VAL 622 N 0.17 1.26 -0.19 -0.54 3.04 -0.65 -0.43 116.25 118.90 2ouv h VAL 622 Ca 0.07 -1.23 -0.08 0.00 -1.01 0.00 0.00 66.70 64.44 2ouv h VAL 622 Cb 0.35 1.29 -0.01 0.00 -2.01 0.00 0.00 31.29 30.91 2ouv h VAL 622 CO 0.01 0.39 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.64 2ouv h LEU 623 N 0.46 0.35 -0.33 3.16 3.38 -1.25 0.54 115.31 121.62 2ouv h LEU 623 Ca 0.07 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 2ouv h LEU 623 Cb 0.64 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2ouv h LEU 623 CO 0.05 0.61 -0.31 -0.08 0.09 0.00 0.00 178.44 178.79 2ouv h GLU 624 N 0.32 0.79 -0.17 1.13 4.81 -0.69 0.18 114.58 120.95 2ouv h GLU 624 Ca 0.05 -0.41 -0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2ouv h GLU 624 Cb 0.62 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 2ouv h GLU 624 CO 0.04 1.04 0.10 0.82 -0.73 0.00 0.00 179.01 180.29 2ouv h ILE 625 N 0.57 1.09 -0.30 2.32 2.04 -0.69 -0.22 117.51 122.31 2ouv h ILE 625 Ca 0.05 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2ouv h ILE 625 Cb 0.89 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2ouv h ILE 625 CO 0.08 0.08 0.16 0.40 0.00 0.00 0.00 178.15 178.88 2ouv h ILE 626 N 0.19 1.13 -0.35 -0.67 2.04 -0.79 -0.81 117.51 118.24 2ouv h ILE 626 Ca 0.06 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 2ouv h ILE 626 Cb 0.05 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2ouv h ILE 626 CO -0.01 0.13 0.18 -0.09 0.00 0.00 0.00 178.15 178.36 2ouv h ARG 627 N 0.36 0.50 -0.79 2.37 2.43 -0.48 -0.91 114.38 117.86 2ouv h ARG 627 Ca 0.10 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 2ouv h ARG 627 Cb 0.06 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 2ouv h ARG 627 CO -0.02 0.44 0.40 0.87 -1.51 0.00 0.00 179.97 180.15 2ouv h LYS 628 N 0.43 1.12 -0.43 0.20 1.57 -0.91 -0.85 116.57 117.70 2ouv h LYS 628 Ca 0.12 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2ouv h LYS 628 Cb 0.09 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2ouv h LYS 628 CO -0.02 0.85 0.12 0.00 -0.57 0.00 0.00 179.45 179.84 2ouv h ALA 629 N 1.21 0.56 -0.49 3.86 0.00 -0.86 -1.31 119.26 122.23 2ouv h ALA 629 Ca 0.27 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2ouv h ALA 629 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2ouv h ALA 629 CO -0.04 0.23 -0.07 0.82 0.00 0.00 0.00 179.25 180.19 2ouv h ILE 630 N 0.56 1.27 -0.44 0.00 2.04 -0.95 -2.84 117.51 117.15 2ouv h ILE 630 Ca 0.14 -1.19 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 2ouv h ILE 630 Cb 0.29 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2ouv h ILE 630 CO -0.00 0.41 0.09 0.40 0.00 0.00 0.00 178.15 179.05 2ouv h ILE 631 N 0.77 1.20 0.00 -0.67 1.08 -1.04 -2.13 117.51 116.71 2ouv h ILE 631 Ca 0.13 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 2ouv h ILE 631 Cb 0.61 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 35.13 2ouv h ILE 631 CO 0.04 0.26 0.00 0.00 -0.69 0.00 0.00 178.15 177.76 2ouv h ALA 632 N 1.46 1.00 0.00 1.87 0.00 -0.98 -1.67 119.26 120.94 2ouv h ALA 632 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ouv h ALA 632 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ouv h ALA 632 CO -0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 2ouv n THR 633 N -2.98 0.00 -2.55 0.00 -2.24 -0.80 -4.54 114.28 101.17 2ouv n THR 633 Ca -0.02 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 2ouv n THR 633 Cb 0.12 -0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 67.74 2ouv n THR 633 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ouv s ASP 634 N -1.94 6.31 0.55 3.42 2.15 -0.63 -4.87 116.67 121.65 2ouv s ASP 634 Ca 0.34 -0.08 0.31 0.00 0.43 0.00 0.00 52.55 53.56 2ouv s ASP 634 Cb 0.16 -2.56 1.47 0.00 -0.30 0.00 0.00 42.92 41.69 2ouv s ASP 634 CO 0.26 -1.64 1.87 0.25 -0.17 0.00 0.00 175.17 175.74 2ouv h LEU 635 N 12.47 0.00 -1.96 -1.34 5.85 -1.89 0.07 115.31 128.50 2ouv h LEU 635 Ca -0.26 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.49 2ouv h LEU 635 Cb 1.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 2ouv h LEU 635 CO 1.22 0.00 0.11 0.00 -0.34 0.00 0.00 178.44 179.43 2ouv h ALA 636 N 1.49 2.09 0.00 1.25 0.00 -1.93 -1.29 119.26 120.86 2ouv h ALA 636 Ca 0.39 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.25 2ouv h ALA 636 Cb 1.68 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 2ouv h ALA 636 CO -0.00 -0.13 -0.61 -0.07 0.00 0.00 0.00 179.25 178.43 2ouv h LEU 637 N 0.05 0.00 -0.30 0.00 3.38 -1.32 -3.37 115.31 113.75 2ouv h LEU 637 Ca 0.07 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.06 2ouv h LEU 637 Cb 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2ouv h LEU 637 CO -0.01 0.18 0.15 0.22 0.09 0.00 0.00 178.44 179.08 2ouv h TYR 638 N 0.00 0.27 -0.42 1.13 3.20 -1.23 -2.23 116.97 117.70 2ouv h TYR 638 Ca -0.02 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.94 2ouv h TYR 638 Cb 1.16 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.28 2ouv h TYR 638 CO 0.00 0.15 -0.05 0.74 -1.64 0.00 0.00 178.16 177.36 2ouv h PHE 639 N 0.31 -0.12 -0.43 -3.82 -1.00 -1.73 0.12 116.94 110.27 2ouv h PHE 639 Ca 0.13 0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.84 2ouv h PHE 639 Cb 0.04 0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 2ouv h PHE 639 CO -0.10 -0.13 -0.10 0.78 -1.61 0.00 0.00 178.31 177.15 2ouv h GLY 640 N 0.05 0.90 0.96 -1.45 0.00 -1.79 -2.51 103.07 99.24 2ouv h GLY 640 Ca 0.20 -0.74 0.01 0.00 0.00 0.00 0.00 47.33 46.81 2ouv h GLY 640 CO -0.39 0.67 0.25 -0.57 0.00 0.00 0.00 176.54 176.51 2ouv h ASN 641 N 0.66 0.42 -0.71 0.19 -0.00 -0.73 -1.54 115.58 113.87 2ouv h ASN 641 Ca 0.11 -0.00 -0.07 0.00 -0.00 0.00 0.00 56.30 56.34 2ouv h ASN 641 Cb 0.63 -0.10 -0.03 0.00 -0.00 0.00 0.00 38.32 38.82 2ouv h ASN 641 CO 0.04 0.30 0.17 -0.09 -0.00 0.00 0.00 177.43 177.86 2ouv h ARG 642 N 0.51 1.15 -0.44 6.67 2.43 -0.76 -1.60 114.38 122.33 2ouv h ARG 642 Ca 0.15 -0.28 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2ouv h ARG 642 Cb -0.03 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 2ouv h ARG 642 CO -0.05 1.01 0.26 -0.22 -1.51 0.00 0.00 179.97 179.46 2ouv h LYS 643 N 1.08 0.59 -0.35 0.20 3.64 -1.17 -0.50 116.57 120.07 2ouv h LYS 643 Ca 0.22 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2ouv h LYS 643 Cb 0.38 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 2ouv h LYS 643 CO 0.00 0.44 0.20 1.96 -2.27 0.00 0.00 179.45 179.78 2ouv h GLN 644 N 0.58 0.48 -0.87 1.90 1.08 -1.05 -2.34 115.11 114.88 2ouv h GLN 644 Ca 0.16 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2ouv h GLN 644 Cb -0.00 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.29 2ouv h GLN 644 CO -0.03 0.38 0.53 -0.07 -0.95 0.00 0.00 178.83 178.69 2ouv h LEU 645 N 0.45 1.05 -0.66 1.46 3.38 -0.99 -1.29 115.31 118.70 2ouv h LEU 645 Ca 0.12 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2ouv h LEU 645 Cb 0.03 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2ouv h LEU 645 CO -0.02 0.80 0.32 -0.08 0.09 0.00 0.00 178.44 179.55 2ouv h GLU 646 N 1.20 0.95 -0.54 1.13 4.81 -0.86 -0.04 114.58 121.24 2ouv h GLU 646 Ca 0.31 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 2ouv h GLU 646 Cb -0.06 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.14 2ouv h GLU 646 CO -0.06 0.76 -0.07 0.93 -0.73 0.00 0.00 179.01 179.83 2ouv h GLU 647 N 0.92 1.00 -0.39 1.92 5.08 -1.08 -0.67 114.58 121.36 2ouv h GLU 647 Ca 0.23 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 2ouv h GLU 647 Cb 0.12 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2ouv h GLU 647 CO -0.03 1.04 -0.12 0.52 -1.00 0.00 0.00 179.01 179.42 2ouv h MET 648 N 0.87 0.69 0.16 2.33 2.86 -0.97 -1.32 114.93 119.55 2ouv h MET 648 Ca 0.14 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2ouv h MET 648 Cb 0.63 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2ouv h MET 648 CO 0.04 0.79 -0.08 -0.92 1.06 0.00 0.00 176.91 177.80 2ouv h TYR 649 N 0.62 -0.20 -0.91 -0.22 3.20 -0.78 0.37 116.97 119.06 2ouv h TYR 649 Ca 0.11 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.00 2ouv h TYR 649 Cb 0.57 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.85 2ouv h TYR 649 CO 0.03 0.15 0.59 1.96 -1.64 0.00 0.00 178.16 179.25 2ouv h GLN 650 N -0.58 1.13 -0.00 1.82 4.20 -1.04 -2.05 115.11 118.58 2ouv h GLN 650 Ca -0.02 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2ouv h GLN 650 Cb 0.44 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2ouv h GLN 650 CO 0.04 0.75 -0.12 0.25 -0.67 0.00 0.00 178.83 179.07 2ouv n THR 651 N -4.50 0.00 -1.92 -0.54 -2.24 -0.51 -4.92 114.28 99.65 2ouv n THR 651 Ca 0.11 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 61.79 2ouv n THR 651 Cb 0.07 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.00 2ouv n THR 651 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ouv n GLY 652 N 1.44 0.30 0.06 3.38 0.00 -0.55 -4.90 105.19 104.93 2ouv n GLY 652 Ca 0.09 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.71 2ouv n GLY 652 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ouv n SER 653 N 0.23 0.95 -4.65 1.61 3.41 0.01 -4.91 113.62 110.28 2ouv n SER 653 Ca -0.11 -0.82 -0.42 0.00 -0.26 0.00 0.00 58.87 57.26 2ouv n SER 653 Cb 0.51 0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 65.10 2ouv n SER 653 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2ouv s LEU 654 N -2.92 4.22 -0.11 1.04 2.96 -0.96 -4.96 118.68 117.95 2ouv s LEU 654 Ca 0.11 2.34 -0.02 0.00 -0.22 0.00 0.00 54.13 56.34 2ouv s LEU 654 Cb 0.17 -3.53 0.04 0.00 0.50 0.00 0.00 46.19 43.37 2ouv s LEU 654 CO 0.77 -1.16 0.01 0.21 -1.32 0.00 0.00 176.35 174.86 2ouv s ASN 655 N 4.61 2.05 0.00 3.68 3.04 -1.26 -5.01 114.94 122.05 2ouv s ASN 655 Ca 0.84 -0.34 0.10 0.00 0.04 0.00 0.00 52.86 53.50 2ouv s ASN 655 Cb -0.37 -0.52 0.59 0.00 -1.54 0.00 0.00 41.25 39.41 2ouv s ASN 655 CO 0.36 -0.22 1.10 0.18 -3.04 0.00 0.00 177.10 175.48 2ouv n LEU 656 N 5.10 0.00 -0.10 3.21 4.77 -1.26 -1.54 117.00 127.19 2ouv n LEU 656 Ca -0.08 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.02 2ouv n LEU 656 Cb 0.49 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.82 2ouv n LEU 656 CO 0.12 0.00 0.46 0.59 -1.33 0.00 0.00 177.39 177.23 2ouv n ASN 657 N -0.74 0.78 -4.58 -1.43 3.02 -1.26 -4.71 115.26 106.34 2ouv n ASN 657 Ca 0.07 -0.58 -0.40 0.00 -0.03 0.00 0.00 54.58 53.64 2ouv n ASN 657 Cb 0.03 0.29 -0.09 0.00 -0.61 0.00 0.00 39.78 39.41 2ouv n ASN 657 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2ouv s ASN 658 N -2.82 6.28 0.25 6.41 3.84 -0.59 -4.97 114.94 123.35 2ouv s ASN 658 Ca 0.15 0.08 -0.03 0.00 0.21 0.00 0.00 52.86 53.28 2ouv s ASN 658 Cb 0.18 -2.24 0.47 0.00 -0.55 0.00 0.00 41.25 39.11 2ouv s ASN 658 CO 0.65 -0.34 1.79 -0.61 -2.79 0.00 0.00 177.10 175.81 2ouv h GLN 659 N 8.32 0.69 -0.67 0.43 4.15 -1.86 0.40 115.11 126.57 2ouv h GLN 659 Ca -0.30 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.11 2ouv h GLN 659 Cb 1.14 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.64 2ouv h GLN 659 CO 0.71 0.46 0.45 1.03 -1.93 0.00 0.00 178.83 179.54 2ouv h SER 660 N 0.71 0.71 -0.08 -0.69 0.87 -1.93 -0.55 113.55 112.60 2ouv h SER 660 Ca 0.43 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.83 2ouv h SER 660 Cb 0.51 -0.17 0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2ouv h SER 660 CO -0.30 0.50 -0.52 0.45 -0.53 0.00 0.00 176.83 176.42 2ouv h HIS 661 N 0.83 0.68 -0.73 2.24 3.86 -1.23 -2.57 115.15 118.22 2ouv h HIS 661 Ca 0.26 -0.31 0.01 0.00 -1.16 0.00 0.00 60.37 59.17 2ouv h HIS 661 Cb 0.03 -0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.36 2ouv h HIS 661 CO -0.00 1.10 0.48 0.00 0.86 0.00 0.00 177.93 180.36 2ouv h ARG 662 N 0.06 0.97 -0.60 2.45 3.08 -0.83 -1.34 114.38 118.17 2ouv h ARG 662 Ca -0.04 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 59.98 2ouv h ARG 662 Cb 1.18 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.97 2ouv h ARG 662 CO 0.11 0.65 0.35 -0.44 -1.07 0.00 0.00 179.97 179.56 2ouv h ASP 663 N 0.99 0.54 -0.43 7.04 3.32 -1.11 0.09 116.42 126.85 2ouv h ASP 663 Ca 0.27 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.29 2ouv h ASP 663 Cb -0.10 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2ouv h ASP 663 CO -0.06 0.37 0.13 0.03 -1.72 0.00 0.00 179.24 177.99 2ouv h ARG 664 N 0.67 0.68 -0.46 3.56 3.08 -1.00 0.71 114.38 121.62 2ouv h ARG 664 Ca 0.25 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 2ouv h ARG 664 Cb 0.09 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2ouv h ARG 664 CO -0.13 0.67 0.21 0.28 -1.07 0.00 0.00 179.97 179.93 2ouv h VAL 665 N 0.56 1.19 -0.66 2.04 2.07 -0.90 -0.78 116.25 119.78 2ouv h VAL 665 Ca 0.14 -0.56 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2ouv h VAL 665 Cb 0.28 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2ouv h VAL 665 CO -0.00 0.21 0.27 0.40 0.02 0.00 0.00 177.57 178.47 2ouv h ILE 666 N 0.61 1.23 -0.61 4.57 2.04 -0.81 -1.16 117.51 123.37 2ouv h ILE 666 Ca 0.16 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 2ouv h ILE 666 Cb 0.14 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 2ouv h ILE 666 CO -0.02 0.29 0.34 1.23 0.00 0.00 0.00 178.15 179.99 2ouv h GLY 667 N 1.03 0.91 1.49 5.37 0.00 -0.23 -0.55 103.07 111.09 2ouv h GLY 667 Ca 0.22 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 2ouv h GLY 667 CO -0.02 0.39 -0.11 -2.00 0.00 0.00 0.00 176.54 174.80 2ouv h LEU 668 N 0.83 0.60 -0.79 3.11 5.85 -0.61 -2.15 115.31 122.14 2ouv h LEU 668 Ca 0.22 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 2ouv h LEU 668 Cb 0.03 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 2ouv h LEU 668 CO -0.04 0.74 0.42 0.24 -0.34 0.00 0.00 178.44 179.46 2ouv h MET 669 N 0.57 1.12 -0.75 1.25 2.86 -0.57 -0.48 114.93 118.92 2ouv h MET 669 Ca 0.10 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2ouv h MET 669 Cb 0.52 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 2ouv h MET 669 CO 0.03 0.84 0.39 0.52 1.06 0.00 0.00 176.91 179.75 2ouv h MET 670 N 1.11 1.07 -0.19 1.72 2.86 -0.52 -0.01 114.93 120.97 2ouv h MET 670 Ca 0.28 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2ouv h MET 670 Cb 0.06 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2ouv h MET 670 CO -0.04 0.81 0.07 1.15 1.06 0.00 0.00 176.91 179.96 2ouv h THR 671 N 1.05 1.16 -0.97 2.22 2.02 -0.96 -0.13 112.91 117.30 2ouv h THR 671 Ca 0.26 -0.49 0.07 0.00 0.77 0.00 0.00 66.41 67.02 2ouv h THR 671 Cb 0.07 1.14 -0.07 0.00 -1.74 0.00 0.00 68.15 67.56 2ouv h THR 671 CO -0.04 0.16 0.63 0.00 0.37 0.00 0.00 175.52 176.63 2ouv h ALA 672 N 0.91 1.46 -0.22 6.16 0.00 -0.71 -1.56 119.26 125.30 2ouv h ALA 672 Ca 0.06 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.75 2ouv h ALA 672 Cb 0.18 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2ouv h ALA 672 CO -0.00 0.39 -0.65 0.00 0.00 0.00 0.00 179.25 178.98 2ouv h ASP 674 N 0.58 0.49 -0.41 0.00 3.58 -0.41 -2.66 116.42 117.59 2ouv h ASP 674 Ca -0.02 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.38 2ouv h ASP 674 Cb 1.28 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.20 2ouv h ASP 674 CO 0.14 0.47 0.00 0.18 -2.88 0.00 0.00 179.24 177.15 2ouv n LEU 675 N -4.37 3.04 0.00 2.28 4.77 -0.65 -4.66 117.00 117.42 2ouv n LEU 675 Ca 0.02 -1.37 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 2ouv n LEU 675 Cb 0.16 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2ouv n LEU 675 CO 0.37 0.69 0.47 0.00 -1.33 0.00 0.00 177.39 177.59 2ouv h SER 677 N 0.00 0.00 0.00 0.00 4.64 -1.85 -0.59 113.55 115.75 2ouv h SER 677 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ouv h SER 677 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2ouv h SER 677 CO 0.00 0.06 0.00 1.33 -0.87 0.00 0.00 176.83 177.35 2ouv n VAL 678 N -3.79 0.00 -0.54 0.95 0.24 -0.87 -3.28 118.33 111.04 2ouv n VAL 678 Ca -0.02 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.34 2ouv n VAL 678 Cb 0.16 -0.53 0.16 0.00 -1.47 0.00 0.00 33.84 32.15 2ouv n VAL 678 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2ouv n THR 679 N -0.99 1.55 -2.70 3.34 -2.24 -0.23 -3.77 114.28 109.24 2ouv n THR 679 Ca 0.22 -1.47 -0.23 0.00 -2.27 0.00 0.00 64.05 60.30 2ouv n THR 679 Cb 0.10 0.15 0.11 0.00 -2.10 0.00 0.00 70.33 68.58 2ouv n THR 679 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ouv s LYS 680 N -1.87 1.71 0.58 -0.78 -0.14 -1.21 -4.44 119.74 113.60 2ouv s LYS 680 Ca 0.26 -1.30 -0.17 0.00 -1.36 0.00 0.00 55.97 53.40 2ouv s LYS 680 Cb 0.19 -2.39 -0.04 0.00 -1.68 0.00 0.00 37.83 33.91 2ouv s LYS 680 CO 0.09 -1.41 1.09 -0.51 -0.76 0.00 0.00 175.35 173.85 2ouv s LEU 681 N -5.08 3.59 0.23 3.17 1.43 -1.26 -4.68 118.68 116.09 2ouv s LEU 681 Ca 0.66 2.00 -0.09 0.00 -1.03 0.00 0.00 54.13 55.68 2ouv s LEU 681 Cb -0.05 -4.56 0.37 0.00 0.03 0.00 0.00 46.19 41.99 2ouv s LEU 681 CO 0.44 -1.27 1.65 -0.25 0.23 0.00 0.00 176.35 177.15 2ouv h TRP 682 N 0.71 -0.04 -0.38 0.29 -0.00 -1.97 0.09 115.95 114.64 2ouv h TRP 682 Ca -0.48 0.05 0.11 0.00 -0.00 0.00 0.00 58.89 58.57 2ouv h TRP 682 Cb 1.24 0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 30.51 2ouv h TRP 682 CO 0.55 -0.20 0.29 -1.35 -0.00 0.00 0.00 178.44 177.72 2ouv h PRO 683 N 0.11 0.00 0.00 2.65 0.11 -2.00 0.83 132.00 133.70 2ouv h PRO 683 Ca 0.37 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.37 2ouv h PRO 683 Cb 0.63 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.72 2ouv h PRO 683 CO -0.60 0.00 -0.61 0.28 -0.21 0.00 0.00 178.00 176.86 2ouv h VAL 684 N 0.00 1.26 -0.96 3.15 2.07 -1.41 -3.37 116.25 116.99 2ouv h VAL 684 Ca 0.18 -2.17 0.02 0.00 0.82 0.00 0.00 66.70 65.54 2ouv h VAL 684 Cb 0.75 2.61 -0.05 0.00 -1.52 0.00 0.00 31.29 33.08 2ouv h VAL 684 CO -0.00 0.43 0.63 0.74 0.02 0.00 0.00 177.57 179.39 2ouv h THR 685 N -1.00 1.21 -0.66 2.57 2.02 -0.78 -2.52 112.91 113.75 2ouv h THR 685 Ca -0.16 -0.43 0.09 0.00 0.77 0.00 0.00 66.41 66.68 2ouv h THR 685 Cb 1.09 -0.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 2ouv h THR 685 CO -0.10 0.23 0.44 0.50 0.37 0.00 0.00 175.52 176.96 2ouv h LYS 686 N 1.26 0.51 0.00 6.66 3.64 -1.02 -1.26 116.57 126.37 2ouv h LYS 686 Ca 0.36 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2ouv h LYS 686 Cb -0.09 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2ouv h LYS 686 CO -0.09 0.34 0.00 -0.07 -2.27 0.00 0.00 179.45 177.36 2ouv h LEU 687 N 0.53 0.00 -3.17 5.20 3.38 -1.61 -3.00 115.31 116.65 2ouv h LEU 687 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2ouv h LEU 687 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2ouv h LEU 687 CO -0.10 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.78 2ouv n THR 688 N -2.33 1.91 -0.31 0.22 -2.24 -0.47 -4.66 114.28 106.39 2ouv n THR 688 Ca 0.02 -1.21 0.23 0.00 -2.27 0.00 0.00 64.05 60.83 2ouv n THR 688 Cb 0.26 0.10 0.53 0.00 -2.10 0.00 0.00 70.33 69.12 2ouv n THR 688 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ouv h ALA 689 N 4.19 2.29 -0.00 6.98 0.00 -1.61 -1.81 119.26 129.30 2ouv h ALA 689 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ouv h ALA 689 Cb 1.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2ouv h ALA 689 CO 0.25 -0.67 -0.15 0.09 0.00 0.00 0.00 179.25 178.78 2ouv n ASN 690 N -4.57 0.17 -0.18 0.00 3.02 -1.26 -4.28 115.26 108.17 2ouv n ASN 690 Ca 0.24 0.19 -0.01 0.00 -0.03 0.00 0.00 54.58 54.97 2ouv n ASN 690 Cb 0.87 -0.25 0.08 0.00 -0.61 0.00 0.00 39.78 39.87 2ouv n ASN 690 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2ouv h ASP 691 N 0.04 0.11 0.39 6.41 3.32 -1.69 -1.39 116.42 123.60 2ouv h ASP 691 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2ouv h ASP 691 Cb 0.48 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2ouv h ASP 691 CO 0.00 0.08 0.00 2.30 -1.72 0.00 0.00 179.24 179.90 2ouv n ILE 692 N -5.05 1.22 0.89 0.35 -5.35 -1.26 -1.89 119.36 108.28 2ouv n ILE 692 Ca 0.07 0.31 0.10 0.00 -0.27 0.00 0.00 62.75 62.96 2ouv n ILE 692 Cb 0.25 -1.14 -0.02 0.00 -1.74 0.00 0.00 39.64 37.00 2ouv n ILE 692 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2ouv n TYR 693 N -1.55 0.00 -0.19 4.28 4.02 -0.55 -4.62 117.16 118.56 2ouv n TYR 693 Ca 0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.91 2ouv n TYR 693 Cb 0.13 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 39.53 2ouv n TYR 693 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2ouv h ALA 694 N 3.37 0.51 -0.42 -0.72 0.00 -1.13 -0.39 119.26 120.48 2ouv h ALA 694 Ca 0.00 0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2ouv h ALA 694 Cb 0.65 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2ouv h ALA 694 CO 0.00 -0.40 -0.14 0.93 0.00 0.00 0.00 179.25 179.63 2ouv h GLU 695 N 0.08 0.84 -0.28 0.00 5.08 -1.81 -1.10 114.58 117.39 2ouv h GLU 695 Ca 0.29 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2ouv h GLU 695 Cb 0.46 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2ouv h GLU 695 CO -0.51 0.97 0.18 0.74 -1.00 0.00 0.00 179.01 179.39 2ouv h PHE 696 N 0.66 0.36 0.00 4.33 0.04 -1.73 -1.94 116.94 118.65 2ouv h PHE 696 Ca 0.10 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.80 2ouv h PHE 696 Cb 0.69 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 2ouv h PHE 696 CO 0.05 0.24 -0.36 -1.49 -0.60 0.00 0.00 178.31 176.15 2ouv h TRP 697 N 0.37 0.00 -0.41 -0.55 6.55 -1.01 -1.19 115.95 119.71 2ouv h TRP 697 Ca 0.10 0.00 -0.14 0.00 0.95 0.00 0.00 58.89 59.80 2ouv h TRP 697 Cb -0.02 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.27 2ouv h TRP 697 CO -0.05 0.36 -0.30 0.00 -1.05 0.00 0.00 178.44 177.40 2ouv h ALA 698 N 1.64 0.69 -0.36 1.49 0.00 -0.82 0.19 119.26 122.09 2ouv h ALA 698 Ca -0.00 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 2ouv h ALA 698 Cb 0.75 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2ouv h ALA 698 CO 0.05 0.67 -0.03 1.49 0.00 0.00 0.00 179.25 181.43 2ouv h GLU 699 N 0.76 0.66 -0.70 0.00 4.81 -1.00 -2.50 114.58 116.61 2ouv h GLU 699 Ca 0.08 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2ouv h GLU 699 Cb 0.87 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 2ouv h GLU 699 CO 0.08 0.79 0.45 0.78 -0.73 0.00 0.00 179.01 180.37 2ouv h GLY 700 N 0.47 0.99 1.20 1.92 0.00 -1.03 -1.80 103.07 104.82 2ouv h GLY 700 Ca 0.10 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 2ouv h GLY 700 CO 0.02 0.37 0.27 -0.55 0.00 0.00 0.00 176.54 176.66 2ouv h ASP 701 N 0.95 0.93 -0.10 0.19 3.32 -0.68 -0.49 116.42 120.55 2ouv h ASP 701 Ca 0.25 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 2ouv h ASP 701 Cb -0.09 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 2ouv h ASP 701 CO -0.05 0.83 -0.24 -0.33 -1.72 0.00 0.00 179.24 177.73 2ouv h GLU 702 N 1.00 0.54 -0.47 3.56 4.39 -0.92 -1.77 114.58 120.91 2ouv h GLU 702 Ca 0.23 -0.20 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 2ouv h GLU 702 Cb 0.19 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2ouv h GLU 702 CO -0.02 0.74 -0.12 0.52 -1.16 0.00 0.00 179.01 178.97 2ouv h MET 703 N 0.48 0.90 -0.67 2.33 2.86 -0.72 -2.82 114.93 117.29 2ouv h MET 703 Ca 0.07 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2ouv h MET 703 Cb 0.67 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.25 2ouv h MET 703 CO 0.05 1.00 0.43 0.87 1.06 0.00 0.00 176.91 180.32 2ouv h LYS 704 N 0.75 0.88 0.00 1.72 1.57 -0.71 -0.30 116.57 120.48 2ouv h LYS 704 Ca 0.12 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2ouv h LYS 704 Cb 0.67 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2ouv h LYS 704 CO 0.05 0.59 0.00 0.87 -0.57 0.00 0.00 179.45 180.39 2ouv h LYS 705 N 0.91 0.00 -0.28 3.15 1.57 -1.08 0.38 116.57 121.21 2ouv h LYS 705 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2ouv h LYS 705 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 2ouv h LYS 705 CO -0.05 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.11 2ouv n LEU 706 N -2.84 2.26 0.00 2.94 4.77 -0.20 -4.90 117.00 119.03 2ouv n LEU 706 Ca -0.00 -1.00 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 2ouv n LEU 706 Cb 0.20 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2ouv n LEU 706 CO 0.22 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 2ouv n GLY 707 N 1.24 0.44 3.44 -0.72 0.00 0.12 -5.04 105.19 104.67 2ouv n GLY 707 Ca 0.17 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 2ouv n GLY 707 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ouv s ILE 708 N -2.00 3.90 -0.37 -0.61 1.01 -0.72 -4.99 121.20 117.41 2ouv s ILE 708 Ca 0.00 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.03 2ouv s ILE 708 Cb 0.00 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.73 2ouv s ILE 708 CO 0.00 0.43 1.19 -1.58 0.00 0.00 0.00 174.94 174.98 2ouv s GLN 709 N 1.00 3.87 0.87 2.79 2.00 -1.26 -2.69 119.66 126.24 2ouv s GLN 709 Ca 0.01 0.94 -0.11 0.00 -2.00 0.00 0.00 55.36 54.20 2ouv s GLN 709 Cb -0.14 -3.86 0.11 0.00 0.80 0.00 0.00 33.01 29.92 2ouv s GLN 709 CO 0.02 -1.18 1.09 -1.25 -0.50 0.00 0.00 175.29 173.47 2ouv s PRO 710 N 4.17 1.48 0.69 1.67 0.04 -1.26 -5.00 135.00 136.79 2ouv s PRO 710 Ca 0.50 0.86 -0.16 0.00 0.04 0.00 0.00 61.00 62.24 2ouv s PRO 710 Cb -0.12 -1.83 0.02 0.00 0.04 0.00 0.00 34.50 32.61 2ouv s PRO 710 CO 0.24 -2.10 1.23 0.96 0.04 0.00 0.00 177.00 177.38 2ouv s ILE 711 N -2.95 2.26 0.29 0.56 -4.36 -1.26 -4.76 121.20 110.98 2ouv s ILE 711 Ca 0.63 0.14 0.02 0.00 -0.26 0.00 0.00 60.65 61.17 2ouv s ILE 711 Cb -0.18 -2.84 0.33 0.00 1.25 0.00 0.00 42.46 41.02 2ouv s ILE 711 CO 0.57 -0.06 1.63 -0.65 0.24 0.00 0.00 174.94 176.67 2ouv h PRO 712 N 0.07 0.14 0.00 0.37 0.11 -1.94 -1.47 132.00 129.28 2ouv h PRO 712 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ouv h PRO 712 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2ouv h PRO 712 CO 0.51 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 2ouv h MET 713 N 0.14 0.00 -0.32 1.05 -0.00 -1.94 -1.51 114.93 112.35 2ouv h MET 713 Ca 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.26 2ouv h MET 713 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.74 2ouv h MET 713 CO -0.72 0.00 0.00 -1.33 -0.00 0.00 0.00 176.91 174.86 2ouv n MET 714 N -2.63 2.27 -3.45 -0.10 2.81 -0.56 -4.63 117.12 110.83 2ouv n MET 714 Ca -0.01 -1.97 -0.43 0.00 -1.81 0.00 0.00 57.70 53.49 2ouv n MET 714 Cb 0.11 -1.34 -0.10 0.00 -0.71 0.00 0.00 33.22 31.19 2ouv n MET 714 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2ouv s ASP 715 N -1.08 6.12 0.30 7.83 -1.08 -0.57 -3.57 116.67 124.61 2ouv s ASP 715 Ca 0.27 -0.79 0.23 0.00 -0.52 0.00 0.00 52.55 51.74 2ouv s ASP 715 Cb 0.15 -2.17 1.09 0.00 -1.46 0.00 0.00 42.92 40.54 2ouv s ASP 715 CO 0.20 -0.43 1.69 -2.11 0.52 0.00 0.00 175.17 175.04 2ouv n ARG 716 N 5.21 0.17 0.06 4.34 1.85 -1.26 -1.41 116.66 125.63 2ouv n ARG 716 Ca -0.11 0.55 0.12 0.00 -1.00 0.00 0.00 57.85 57.41 2ouv n ARG 716 Cb 0.47 -1.93 0.47 0.00 -1.05 0.00 0.00 32.46 30.43 2ouv n ARG 716 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2ouv n ASP 717 N -2.26 0.43 -4.27 2.89 8.00 -1.26 -4.41 116.55 115.67 2ouv n ASP 717 Ca 0.00 0.56 -0.44 0.00 0.71 0.00 0.00 54.79 55.61 2ouv n ASP 717 Cb 0.12 -0.67 -0.05 0.00 -0.02 0.00 0.00 41.12 40.51 2ouv n ASP 717 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2ouv s LYS 718 N -3.09 3.14 0.00 -1.24 -0.14 -0.50 -4.88 119.74 113.03 2ouv s LYS 718 Ca 0.10 -2.18 0.07 0.00 -1.36 0.00 0.00 55.97 52.60 2ouv s LYS 718 Cb 0.13 -4.23 0.10 0.00 -1.68 0.00 0.00 37.83 32.16 2ouv s LYS 718 CO 0.50 -1.27 0.87 1.63 -0.76 0.00 0.00 175.35 176.31 2ouv n LYS 719 N 4.37 0.97 0.21 1.68 5.02 -1.26 -4.69 118.16 124.46 2ouv n LYS 719 Ca 0.03 -1.22 0.11 0.00 -2.02 0.00 0.00 58.31 55.21 2ouv n LYS 719 Cb 0.43 -1.14 0.68 0.00 -0.02 0.00 0.00 35.03 34.98 2ouv n LYS 719 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2ouv h ASP 720 N 1.29 0.00 -0.49 4.39 3.32 -1.97 -2.17 116.42 120.79 2ouv h ASP 720 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ouv h ASP 720 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2ouv h ASP 720 CO 0.00 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.90 2ouv n GLU 721 N -4.42 2.32 -0.26 3.56 4.71 -1.26 -4.46 120.64 120.83 2ouv n GLU 721 Ca -0.00 -2.03 0.00 0.00 -0.01 0.00 0.00 57.16 55.12 2ouv n GLU 721 Cb 0.20 -1.46 0.13 0.00 -1.01 0.00 0.00 31.44 29.29 2ouv n GLU 721 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2ouv h VAL 722 N 3.55 0.96 -0.76 2.62 2.07 -1.71 -0.56 116.25 122.41 2ouv h VAL 722 Ca 0.00 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2ouv h VAL 722 Cb 0.80 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2ouv h VAL 722 CO 0.00 0.14 0.40 -0.65 0.02 0.00 0.00 177.57 177.48 2ouv h PRO 723 N 0.77 1.07 -0.27 1.57 0.11 -1.82 -0.74 132.00 132.69 2ouv h PRO 723 Ca 0.34 -0.13 -0.11 0.00 0.11 0.00 0.00 66.00 66.21 2ouv h PRO 723 Cb 0.24 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2ouv h PRO 723 CO -0.20 0.80 -0.30 1.96 -0.21 0.00 0.00 178.00 180.04 2ouv h GLN 724 N 1.07 0.55 -0.77 1.05 4.20 -1.69 -1.74 115.11 117.77 2ouv h GLN 724 Ca 0.27 -0.24 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 2ouv h GLN 724 Cb 0.06 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2ouv h GLN 724 CO -0.04 0.80 0.31 0.78 -0.67 0.00 0.00 178.83 180.00 2ouv h GLY 725 N 1.03 1.24 0.95 3.46 0.00 -0.38 -1.28 103.07 108.10 2ouv h GLY 725 Ca 0.06 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 2ouv h GLY 725 CO 0.06 0.64 -0.01 1.46 0.00 0.00 0.00 176.54 178.70 2ouv h GLN 726 N 1.12 -0.02 -0.76 4.80 1.08 -0.71 -0.01 115.11 120.61 2ouv h GLN 726 Ca 0.26 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.54 2ouv h GLN 726 Cb 0.22 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.59 2ouv h GLN 726 CO -0.02 0.04 0.42 1.25 -0.95 0.00 0.00 178.83 179.57 2ouv h LEU 727 N -0.07 0.62 -0.50 1.46 5.85 -1.04 0.34 115.31 121.96 2ouv h LEU 727 Ca -0.00 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2ouv h LEU 727 Cb 0.07 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2ouv h LEU 727 CO 0.00 0.37 0.19 1.23 -0.34 0.00 0.00 178.44 179.90 2ouv h GLY 728 N 0.75 0.81 1.05 3.75 0.00 -0.92 -2.21 103.07 106.29 2ouv h GLY 728 Ca 0.35 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 2ouv h GLY 728 CO -0.22 0.42 0.31 -2.75 0.00 0.00 0.00 176.54 174.30 2ouv h PHE 729 N 0.67 1.20 -0.51 5.60 3.57 0.02 -0.52 116.94 126.97 2ouv h PHE 729 Ca 0.17 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 2ouv h PHE 729 Cb 0.21 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.57 2ouv h PHE 729 CO 0.01 0.91 0.14 1.88 -2.23 0.00 0.00 178.31 179.01 2ouv h TYR 730 N 1.14 0.85 -0.12 0.41 -1.99 -0.80 0.02 116.97 116.48 2ouv h TYR 730 Ca 0.26 -0.10 -0.20 0.00 2.00 0.00 0.00 58.73 60.69 2ouv h TYR 730 Cb 0.22 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2ouv h TYR 730 CO 0.02 0.74 -0.74 -0.91 -0.00 0.00 0.00 178.16 177.27 2ouv h ASN 731 N 0.70 0.70 0.69 3.88 2.35 -1.18 0.20 115.58 122.93 2ouv h ASN 731 Ca 0.16 -0.45 -0.26 0.00 -0.55 0.00 0.00 56.30 55.20 2ouv h ASN 731 Cb 0.31 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2ouv h ASN 731 CO -0.00 1.22 -1.37 0.00 -1.65 0.00 0.00 177.43 175.63 2ouv h ALA 732 N 0.77 0.49 0.00 -0.83 0.00 -1.09 -3.42 119.26 115.18 2ouv h ALA 732 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.71 2ouv h ALA 732 Cb 1.34 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2ouv h ALA 732 CO 0.14 1.35 -0.14 0.28 0.00 0.00 0.00 179.25 180.88 2ouv n VAL 733 N -3.26 1.03 0.14 0.00 0.31 -0.05 -4.81 118.33 111.69 2ouv n VAL 733 Ca -0.10 0.34 -0.14 0.00 -0.01 0.00 0.00 64.34 64.43 2ouv n VAL 733 Cb 1.00 -1.55 -0.08 0.00 -0.91 0.00 0.00 33.84 32.30 2ouv n VAL 733 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ouv h ALA 734 N 0.00 -0.31 -0.23 3.52 0.00 -1.37 -2.59 119.26 118.28 2ouv h ALA 734 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.84 2ouv h ALA 734 Cb 0.14 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2ouv h ALA 734 CO 0.00 -0.63 0.05 0.82 0.00 0.00 0.00 179.25 179.50 2ouv h ILE 735 N -0.40 0.90 -0.98 0.00 1.08 -0.86 -1.80 117.51 115.45 2ouv h ILE 735 Ca -0.03 -0.05 0.02 0.00 -0.39 0.00 0.00 64.86 64.41 2ouv h ILE 735 Cb 0.31 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 34.75 2ouv h ILE 735 CO 0.05 0.03 0.64 -0.65 -0.69 0.00 0.00 178.15 177.53 2ouv h PRO 736 N 0.15 1.24 0.64 2.37 0.11 -1.78 -0.31 132.00 134.42 2ouv h PRO 736 Ca 0.11 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.12 2ouv h PRO 736 Cb 0.10 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 30.92 2ouv h PRO 736 CO -0.13 0.82 -0.43 0.00 -0.21 0.00 0.00 178.00 178.05 2ouv h TYR 738 N -1.02 0.00 -0.01 0.00 -1.99 -1.23 -1.17 116.97 111.55 2ouv h TYR 738 Ca -0.08 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.65 2ouv h TYR 738 Cb 0.84 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.57 2ouv h TYR 738 CO -0.13 0.18 -0.01 1.15 -0.00 0.00 0.00 178.16 179.35 2ouv h THR 739 N 0.00 1.34 -0.47 -2.88 2.02 -0.83 -0.72 112.91 111.37 2ouv h THR 739 Ca -0.00 -1.02 -0.11 0.00 0.77 0.00 0.00 66.41 66.06 2ouv h THR 739 Cb 0.60 2.01 -0.02 0.00 -1.74 0.00 0.00 68.15 69.00 2ouv h THR 739 CO 0.02 0.27 -0.13 0.74 0.37 0.00 0.00 175.52 176.79 2ouv h THR 740 N -0.40 1.26 -0.77 3.16 2.02 -1.19 -2.25 112.91 114.74 2ouv h THR 740 Ca 0.00 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 65.93 2ouv h THR 740 Cb 0.44 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 2ouv h THR 740 CO 0.00 0.43 0.43 0.25 0.37 0.00 0.00 175.52 177.00 2ouv h LEU 741 N 0.78 0.96 -1.26 2.58 5.85 -1.17 -2.15 115.31 120.91 2ouv h LEU 741 Ca 0.12 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2ouv h LEU 741 Cb 0.65 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2ouv h LEU 741 CO 0.05 0.78 -0.27 0.74 -0.34 0.00 0.00 178.44 179.39 2ouv h THR 742 N 1.07 1.23 -0.28 1.05 2.02 -0.89 0.27 112.91 117.40 2ouv h THR 742 Ca 0.27 -1.10 -0.17 0.00 0.77 0.00 0.00 66.41 66.18 2ouv h THR 742 Cb 0.03 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 2ouv h THR 742 CO -0.04 0.33 -0.50 1.56 0.37 0.00 0.00 175.52 177.23 2ouv h GLN 743 N 0.14 0.77 0.25 6.66 4.20 -0.89 -2.40 115.11 123.84 2ouv h GLN 743 Ca 0.02 -0.46 -0.34 0.00 0.06 0.00 0.00 58.65 57.93 2ouv h GLN 743 Cb 0.57 0.04 0.04 0.00 0.30 0.00 0.00 27.48 28.43 2ouv h GLN 743 CO 0.04 1.09 -1.48 0.82 -0.67 0.00 0.00 178.83 178.63 2ouv h ILE 744 N 0.61 1.29 -2.97 2.54 2.04 -1.13 -3.40 117.51 116.48 2ouv h ILE 744 Ca 0.03 -2.72 -0.62 0.00 1.00 0.00 0.00 64.86 62.55 2ouv h ILE 744 Cb 1.08 3.04 -0.41 0.00 -0.74 0.00 0.00 36.82 39.79 2ouv h ILE 744 CO 0.11 0.81 -0.70 -0.76 0.00 0.00 0.00 178.15 177.62 2ouv s LEU 745 N -7.58 3.58 0.40 1.44 1.43 0.93 -5.00 118.68 113.89 2ouv s LEU 745 Ca -0.09 -3.28 0.20 0.00 -1.03 0.00 0.00 54.13 49.94 2ouv s LEU 745 Cb 0.04 -1.26 1.16 0.00 0.03 0.00 0.00 46.19 46.16 2ouv s LEU 745 CO 0.95 -0.17 1.72 -0.65 0.23 0.00 0.00 176.35 178.43 2ouv h PRO 746 N 5.94 0.32 0.00 1.29 0.11 -1.65 -0.94 132.00 137.07 2ouv h PRO 746 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2ouv h PRO 746 Cb 0.85 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2ouv h PRO 746 CO 0.59 0.21 0.00 -2.30 -0.21 0.00 0.00 178.00 176.29 2ouv n PRO 747 N -4.70 0.14 -0.06 1.05 -0.02 -1.26 -1.59 135.00 128.56 2ouv n PRO 747 Ca 0.29 0.58 0.10 0.00 -2.02 0.00 0.00 63.50 62.44 2ouv n PRO 747 Cb 1.01 -1.90 0.40 0.00 -0.02 0.00 0.00 33.50 32.99 2ouv n PRO 747 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ouv n THR 748 N -2.19 0.16 -0.35 3.45 -2.24 -0.36 -4.38 114.28 108.37 2ouv n THR 748 Ca -0.00 -0.25 0.25 0.00 -2.27 0.00 0.00 64.05 61.78 2ouv n THR 748 Cb 0.08 0.17 0.50 0.00 -2.10 0.00 0.00 70.33 68.98 2ouv n THR 748 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2ouv h GLU 749 N 1.52 0.33 -0.46 -0.78 4.81 -1.48 -0.66 114.58 117.87 2ouv h GLU 749 Ca 0.00 -0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.34 2ouv h GLU 749 Cb 0.34 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2ouv h GLU 749 CO 0.00 0.22 0.36 -1.35 -0.73 0.00 0.00 179.01 177.51 2ouv h PRO 750 N 0.34 0.00 -0.33 0.92 0.11 -1.86 -1.03 132.00 130.15 2ouv h PRO 750 Ca 0.69 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.76 2ouv h PRO 750 Cb 1.72 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.81 2ouv h PRO 750 CO -0.45 0.00 0.04 -0.07 -0.21 0.00 0.00 178.00 177.30 2ouv h LEU 751 N 0.00 0.53 -0.59 2.35 3.38 -1.47 -1.37 115.31 118.14 2ouv h LEU 751 Ca 0.22 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2ouv h LEU 751 Cb 0.93 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2ouv h LEU 751 CO -0.00 0.67 0.09 0.25 0.09 0.00 0.00 178.44 179.54 2ouv h LEU 752 N 0.37 0.95 -0.22 1.67 5.85 -1.34 -1.41 115.31 121.18 2ouv h LEU 752 Ca 0.10 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.55 2ouv h LEU 752 Cb 0.38 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2ouv h LEU 752 CO 0.01 0.97 0.14 0.50 -0.34 0.00 0.00 178.44 179.73 2ouv h LYS 753 N 0.89 0.30 -0.49 1.25 3.64 -1.24 -0.35 116.57 120.56 2ouv h LYS 753 Ca 0.18 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.48 2ouv h LYS 753 Cb 0.43 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 2ouv h LYS 753 CO 0.01 0.21 0.05 0.00 -2.27 0.00 0.00 179.45 177.46 2ouv h ALA 754 N 1.06 1.17 -0.27 5.00 0.00 -1.15 -0.75 119.26 124.32 2ouv h ALA 754 Ca 0.08 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2ouv h ALA 754 Cb -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2ouv h ALA 754 CO -0.02 0.55 0.06 0.00 0.00 0.00 0.00 179.25 179.84 2ouv h ARG 756 N 0.27 0.85 -0.40 0.00 3.08 -0.80 -0.89 114.38 116.50 2ouv h ARG 756 Ca 0.08 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2ouv h ARG 756 Cb 0.31 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2ouv h ARG 756 CO 0.00 0.76 0.15 -0.44 -1.07 0.00 0.00 179.97 179.37 2ouv h ASP 757 N 0.83 0.56 0.12 7.04 3.32 -0.88 -2.47 116.42 124.93 2ouv h ASP 757 Ca 0.18 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 2ouv h ASP 757 Cb 0.28 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2ouv h ASP 757 CO -0.00 0.59 -0.29 0.78 -1.72 0.00 0.00 179.24 178.59 2ouv h ASN 758 N 0.49 0.27 -0.67 6.45 2.35 -0.96 -2.55 115.58 120.96 2ouv h ASN 758 Ca 0.13 -0.09 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 2ouv h ASN 758 Cb 0.21 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 2ouv h ASN 758 CO -0.01 0.56 0.45 0.25 -1.65 0.00 0.00 177.43 177.03 2ouv h LEU 759 N 0.24 0.77 -1.29 1.61 6.46 -0.85 -1.00 115.31 121.25 2ouv h LEU 759 Ca 0.03 -0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.74 2ouv h LEU 759 Cb 0.64 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.36 2ouv h LEU 759 CO 0.05 0.56 0.09 0.28 -0.62 0.00 0.00 178.44 178.79 2ouv h SER 760 N 0.91 0.52 -0.42 1.25 0.02 -1.06 -2.03 113.55 112.74 2ouv h SER 760 Ca 0.25 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.98 2ouv h SER 760 Cb -0.11 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2ouv h SER 760 CO -0.05 0.53 -0.27 1.56 -1.14 0.00 0.00 176.83 177.45 2ouv h GLN 761 N 0.56 0.95 -0.26 3.45 1.08 -0.96 -2.48 115.11 117.44 2ouv h GLN 761 Ca 0.13 -0.43 -0.06 0.00 -1.45 0.00 0.00 58.65 56.83 2ouv h GLN 761 Cb 0.22 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 2ouv h GLN 761 CO -0.00 1.10 -0.12 -1.49 -0.95 0.00 0.00 178.83 177.37 2ouv h TRP 762 N 0.80 0.46 -0.75 2.96 4.06 -0.74 -1.97 115.95 120.76 2ouv h TRP 762 Ca 0.09 -0.06 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 2ouv h TRP 762 Cb 0.85 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.85 2ouv h TRP 762 CO 0.05 0.54 0.38 0.93 -3.56 0.00 0.00 178.44 176.78 2ouv h GLU 763 N 0.40 1.07 -0.61 0.49 5.08 -1.08 -1.04 114.58 118.90 2ouv h GLU 763 Ca 0.08 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2ouv h GLU 763 Cb 0.45 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2ouv h GLU 763 CO 0.03 0.83 0.29 0.87 -1.00 0.00 0.00 179.01 180.02 2ouv h LYS 764 N 1.05 0.88 -0.73 2.33 1.57 -0.96 -0.43 116.57 120.29 2ouv h LYS 764 Ca 0.26 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 2ouv h LYS 764 Cb 0.10 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 2ouv h LYS 764 CO -0.04 0.72 0.35 0.28 -0.57 0.00 0.00 179.45 180.20 2ouv h VAL 765 N 0.84 1.24 -0.54 0.50 2.07 -0.98 0.14 116.25 119.50 2ouv h VAL 765 Ca 0.21 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 2ouv h VAL 765 Cb 0.13 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 2ouv h VAL 765 CO -0.03 0.28 0.13 0.40 0.02 0.00 0.00 177.57 178.37 2ouv h ILE 766 N 1.02 1.24 0.00 4.57 2.04 -0.77 -2.15 117.51 123.46 2ouv h ILE 766 Ca 0.25 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2ouv h ILE 766 Cb 0.11 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2ouv h ILE 766 CO -0.03 0.32 0.00 0.54 0.00 0.00 0.00 178.15 178.98 2ouv n ARG 767 N -4.41 0.37 -0.88 2.37 1.74 -0.21 -4.85 116.66 110.79 2ouv n ARG 767 Ca 0.02 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 2ouv n ARG 767 Cb 0.23 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2ouv n ARG 767 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ouv n GLY 768 N 0.37 0.52 0.02 -0.13 0.00 -0.81 -4.91 105.19 100.26 2ouv n GLY 768 Ca 0.11 -0.37 0.13 0.00 0.00 0.00 0.00 46.02 45.88 2ouv n GLY 768 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ouv n GLU 769 N -2.88 0.08 -3.90 1.61 1.02 0.43 -4.85 120.64 112.15 2ouv n GLU 769 Ca 0.00 0.04 -0.11 0.00 -0.02 0.00 0.00 57.16 57.07 2ouv n GLU 769 Cb 0.00 -1.56 -0.11 0.00 -0.02 0.00 0.00 31.44 29.74 2ouv n GLU 769 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2ouv s GLU 770 N -3.04 0.33 0.47 3.49 2.12 -1.10 -4.92 118.70 116.05 2ouv s GLU 770 Ca 0.11 -0.34 -0.23 0.00 0.36 0.00 0.00 54.97 54.88 2ouv s GLU 770 Cb 0.17 0.13 -0.07 0.00 0.26 0.00 0.00 34.13 34.62 2ouv s GLU 770 CO 0.63 -0.07 1.17 0.95 -0.54 0.00 0.00 175.26 177.40 2ouv s THR 771 N -1.04 3.09 0.71 -1.70 -4.23 -1.26 -4.40 115.64 106.81 2ouv s THR 771 Ca -0.11 0.81 -0.11 0.00 -1.18 0.00 0.00 61.69 61.09 2ouv s THR 771 Cb -0.07 -3.40 0.02 0.00 1.34 0.00 0.00 72.50 70.39 2ouv s THR 771 CO 0.00 -0.02 1.08 0.00 -0.54 0.00 0.00 174.62 175.14 2ouv s ALA 772 N -1.56 2.77 -1.80 3.99 0.00 -1.26 -4.93 121.76 118.97 2ouv s ALA 772 Ca 0.64 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.39 2ouv s ALA 772 Cb -0.28 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2ouv s ALA 772 CO 0.34 -1.19 0.45 0.25 0.00 0.00 0.00 175.76 175.61