#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ouy s MET 448 N 0.00 4.31 0.42 1.57 1.00 -1.26 -5.04 119.30 120.30 2ouy s MET 448 Ca 0.00 0.77 -0.25 0.00 0.00 0.00 0.00 55.69 56.21 2ouy s MET 448 Cb 0.00 -3.52 -0.08 0.00 0.00 0.00 0.00 34.83 31.22 2ouy s MET 448 CO 0.00 -0.13 1.23 -1.12 0.00 0.00 0.00 175.02 175.00 2ouy s SER 449 N 1.02 6.32 -0.06 3.03 0.01 -1.26 -5.02 113.70 117.73 2ouy s SER 449 Ca 0.33 2.48 0.02 0.00 1.31 0.00 0.00 55.95 60.09 2ouy s SER 449 Cb -0.17 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.42 2ouy s SER 449 CO 0.13 -0.83 -0.12 -0.63 0.41 0.00 0.00 173.24 172.20 2ouy s ILE 450 N -1.37 3.24 0.95 1.44 1.01 -1.26 -4.78 121.20 120.43 2ouy s ILE 450 Ca 0.59 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 60.48 2ouy s ILE 450 Cb -0.34 -2.30 0.16 0.00 0.01 0.00 0.00 42.46 40.00 2ouy s ILE 450 CO 0.42 0.59 1.09 0.00 0.00 0.00 0.00 174.94 177.04 2ouy s THR 452 N -2.75 3.72 0.27 0.00 -4.23 -1.26 -4.97 115.64 106.42 2ouy s THR 452 Ca 0.65 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 2ouy s THR 452 Cb -0.21 -3.44 0.09 0.00 1.34 0.00 0.00 72.50 70.28 2ouy s THR 452 CO 0.59 -0.41 1.74 0.77 -0.54 0.00 0.00 174.62 176.77 2ouy h SER 453 N 0.00 0.61 -0.20 3.99 4.64 -2.00 -2.53 113.55 118.07 2ouy h SER 453 Ca -0.45 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 60.65 2ouy h SER 453 Cb 1.26 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 2ouy h SER 453 CO 0.59 0.77 0.01 -0.33 -0.87 0.00 0.00 176.83 177.00 2ouy h GLU 454 N 0.57 0.45 0.39 4.77 3.07 -1.98 -1.04 114.58 120.80 2ouy h GLU 454 Ca 0.10 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 2ouy h GLU 454 Cb 0.56 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 2ouy h GLU 454 CO 0.03 0.47 -0.19 0.93 -1.40 0.00 0.00 179.01 178.86 2ouy h GLU 455 N 0.44 -0.50 -0.24 2.33 5.08 -1.85 -1.93 114.58 117.90 2ouy h GLU 455 Ca 0.10 0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.36 2ouy h GLU 455 Cb 0.27 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2ouy h GLU 455 CO 0.01 -0.19 -0.39 0.11 -1.00 0.00 0.00 179.01 177.55 2ouy h TRP 456 N -0.96 0.66 -0.50 4.33 5.08 -1.50 -2.34 115.95 120.72 2ouy h TRP 456 Ca -0.05 -0.19 -0.05 0.00 1.08 0.00 0.00 58.89 59.68 2ouy h TRP 456 Cb 0.54 -0.14 -0.02 0.00 -3.00 0.00 0.00 29.16 26.53 2ouy h TRP 456 CO 0.03 0.86 0.10 1.96 -1.28 0.00 0.00 178.44 180.11 2ouy h GLN 457 N 0.47 0.77 -0.47 0.12 4.20 -1.28 -2.49 115.11 116.43 2ouy h GLN 457 Ca 0.04 -0.16 -0.10 0.00 0.06 0.00 0.00 58.65 58.49 2ouy h GLN 457 Cb 0.88 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2ouy h GLN 457 CO 0.08 0.71 -0.10 0.78 -0.67 0.00 0.00 178.83 179.62 2ouy h GLY 458 N 0.94 0.97 1.15 3.46 0.00 -1.12 -2.93 103.07 105.55 2ouy h GLY 458 Ca 0.16 -0.80 0.04 0.00 0.00 0.00 0.00 47.33 46.73 2ouy h GLY 458 CO 0.00 0.73 0.47 -2.00 0.00 0.00 0.00 176.54 175.74 2ouy h LEU 459 N 0.74 0.73 -2.26 3.11 5.85 -1.05 -1.34 115.31 121.09 2ouy h LEU 459 Ca 0.12 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.84 2ouy h LEU 459 Cb 0.65 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 2ouy h LEU 459 CO 0.04 0.50 0.04 0.24 -0.34 0.00 0.00 178.44 178.92 2ouy h MET 460 N 0.85 0.00 -0.00 1.25 2.86 -1.26 -1.67 114.93 116.96 2ouy h MET 460 Ca 0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 2ouy h MET 460 Cb 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 2ouy h MET 460 CO -0.09 0.00 -0.30 1.04 1.06 0.00 0.00 176.91 178.63 2ouy n GLN 461 N -4.11 0.49 -2.10 1.72 1.13 -0.51 -4.94 117.38 109.05 2ouy n GLN 461 Ca -0.02 -0.26 -0.40 0.00 -1.94 0.00 0.00 57.00 54.38 2ouy n GLN 461 Cb 0.13 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 28.97 2ouy n GLN 461 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2ouy s PHE 462 N -2.69 3.00 -0.06 1.08 5.36 -0.63 -5.04 117.98 119.00 2ouy s PHE 462 Ca 0.20 1.41 -0.01 0.00 -0.96 0.00 0.00 56.93 57.57 2ouy s PHE 462 Cb 0.19 -3.68 0.03 0.00 -0.34 0.00 0.00 43.02 39.22 2ouy s PHE 462 CO 0.57 -1.90 0.01 0.99 -1.46 0.00 0.00 175.22 173.42 2ouy s THR 463 N -1.17 0.30 0.20 0.12 2.01 -1.26 -5.09 115.64 110.76 2ouy s THR 463 Ca 0.50 0.15 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 2ouy s THR 463 Cb -0.39 -0.46 -0.10 0.00 0.01 0.00 0.00 72.50 71.55 2ouy s THR 463 CO 0.52 0.24 1.57 -0.22 -0.69 0.00 0.00 174.62 176.04 2ouy s LEU 464 N 1.87 4.37 0.40 4.42 2.96 -1.26 -4.94 118.68 126.50 2ouy s LEU 464 Ca 0.03 2.69 -0.27 0.00 -0.22 0.00 0.00 54.13 56.36 2ouy s LEU 464 Cb -0.12 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 42.86 2ouy s LEU 464 CO -0.04 -0.83 1.46 -2.65 -1.32 0.00 0.00 176.35 172.97 2ouy n PRO 465 N 3.49 2.52 -0.26 0.98 -0.02 -1.26 -4.88 135.00 135.58 2ouy n PRO 465 Ca 0.12 0.89 0.05 0.00 -2.02 0.00 0.00 63.50 62.54 2ouy n PRO 465 Cb 0.38 -2.65 0.18 0.00 -0.02 0.00 0.00 33.50 31.39 2ouy n PRO 465 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ouy h VAL 466 N 2.72 0.69 -0.48 -1.45 2.07 -2.02 -1.59 116.25 116.19 2ouy h VAL 466 Ca -0.51 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 66.92 2ouy h VAL 466 Cb 1.25 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 2ouy h VAL 466 CO 0.63 0.09 0.32 0.08 0.02 0.00 0.00 177.57 178.71 2ouy h ARG 467 N 0.47 0.36 0.00 1.57 0.11 -2.04 -2.41 114.38 112.44 2ouy h ARG 467 Ca 0.40 -0.02 -0.13 0.00 0.10 0.00 0.00 59.98 60.33 2ouy h ARG 467 Cb 0.58 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 2ouy h ARG 467 CO -0.38 0.24 -0.63 -0.07 0.10 0.00 0.00 179.97 179.23 2ouy h LEU 468 N 0.37 0.00 -1.47 0.08 3.38 -1.65 -3.24 115.31 112.78 2ouy h LEU 468 Ca 0.21 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.33 2ouy h LEU 468 Cb 0.36 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 2ouy h LEU 468 CO -0.05 0.63 0.53 0.00 0.09 0.00 0.00 178.44 179.64 2ouy h LYS 470 N 0.51 -0.16 -0.45 0.00 3.64 -1.68 -3.35 116.57 115.07 2ouy h LYS 470 Ca 0.40 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.87 2ouy h LYS 470 Cb 0.82 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 2ouy h LYS 470 CO -0.15 0.20 0.31 0.93 -2.27 0.00 0.00 179.45 178.47 2ouy h GLU 471 N -0.97 0.28 0.00 1.90 4.39 -1.53 -2.57 114.58 116.09 2ouy h GLU 471 Ca -0.02 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2ouy h GLU 471 Cb 0.44 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2ouy h GLU 471 CO 0.03 0.19 0.00 0.97 -1.16 0.00 0.00 179.01 179.04 2ouy h ILE 472 N 0.29 0.00 0.00 3.13 2.10 -1.09 -2.71 117.51 119.23 2ouy h ILE 472 Ca 0.21 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.88 2ouy h ILE 472 Cb 0.43 1.18 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 2ouy h ILE 472 CO -0.04 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 176.41 2ouy n GLU 473 N -2.88 0.27 -3.29 2.19 -0.58 -0.97 -4.85 120.64 110.53 2ouy n GLU 473 Ca -0.00 0.23 -0.35 0.00 -0.42 0.00 0.00 57.16 56.61 2ouy n GLU 473 Cb 0.20 -1.82 -0.06 0.00 -0.57 0.00 0.00 31.44 29.19 2ouy n GLU 473 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2ouy s LEU 474 N -4.58 4.32 0.26 -4.62 1.43 -1.02 -4.86 118.68 109.61 2ouy s LEU 474 Ca 0.10 1.16 -0.05 0.00 -1.03 0.00 0.00 54.13 54.32 2ouy s LEU 474 Cb 0.12 -3.39 0.32 0.00 0.03 0.00 0.00 46.19 43.27 2ouy s LEU 474 CO 0.59 0.07 1.92 -0.26 0.23 0.00 0.00 176.35 178.90 2ouy h PHE 475 N 3.43 1.22 0.00 0.29 -1.00 -1.88 -2.72 116.94 116.28 2ouy h PHE 475 Ca -0.48 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.33 2ouy h PHE 475 Cb 1.19 -0.41 0.00 0.00 3.61 0.00 0.00 35.95 40.34 2ouy h PHE 475 CO 0.65 0.74 0.00 -2.39 -1.61 0.00 0.00 178.31 175.69 2ouy n HIS 476 N -4.41 0.00 -1.62 -0.55 1.44 -1.26 -4.89 115.22 103.93 2ouy n HIS 476 Ca 0.12 0.00 -0.48 0.00 -2.01 0.00 0.00 57.72 55.35 2ouy n HIS 476 Cb 0.06 -0.18 -0.04 0.00 0.12 0.00 0.00 29.99 29.94 2ouy n HIS 476 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2ouy n PHE 477 N -1.18 1.75 -3.90 -1.40 7.35 -1.03 -4.59 117.46 114.46 2ouy n PHE 477 Ca 0.13 0.53 -0.35 0.00 -0.76 0.00 0.00 57.45 57.00 2ouy n PHE 477 Cb 0.14 -2.39 -0.14 0.00 0.35 0.00 0.00 39.48 37.45 2ouy n PHE 477 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2ouy s ASP 478 N 0.41 4.53 0.12 -2.13 3.68 -1.26 -4.98 116.67 117.04 2ouy s ASP 478 Ca 0.77 -0.75 0.22 0.00 2.13 0.00 0.00 52.55 54.92 2ouy s ASP 478 Cb -0.81 -1.74 0.87 0.00 -1.45 0.00 0.00 42.92 39.80 2ouy s ASP 478 CO 0.47 -0.13 1.67 2.30 0.13 0.00 0.00 175.17 179.61 2ouy n ILE 479 N 4.74 0.71 -0.31 4.11 -5.35 -1.26 -4.35 119.36 117.66 2ouy n ILE 479 Ca -0.16 0.12 -0.04 0.00 -0.27 0.00 0.00 62.75 62.40 2ouy n ILE 479 Cb 0.48 -0.91 -0.01 0.00 -1.74 0.00 0.00 39.64 37.46 2ouy n ILE 479 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ouy n GLY 480 N 0.45 -1.78 0.35 3.28 0.00 -1.26 -1.11 105.19 105.12 2ouy n GLY 480 Ca 0.04 0.90 0.00 0.00 0.00 0.00 0.00 46.02 46.96 2ouy n GLY 480 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ouy n PRO 481 N -5.09 1.00 -2.49 1.61 -0.04 -1.26 -3.98 135.00 124.75 2ouy n PRO 481 Ca 0.05 -0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 2ouy n PRO 481 Cb 0.27 -1.35 0.03 0.00 -0.04 0.00 0.00 33.50 32.41 2ouy n PRO 481 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2ouy n PHE 482 N -0.15 2.02 -0.22 0.54 3.01 -0.27 -4.96 117.46 117.42 2ouy n PHE 482 Ca 0.00 -2.39 -0.02 0.00 1.01 0.00 0.00 57.45 56.05 2ouy n PHE 482 Cb 0.17 -0.27 0.05 0.00 -0.01 0.00 0.00 39.48 39.42 2ouy n PHE 482 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 2ouy h GLU 483 N 2.52 -0.07 0.00 -1.08 4.81 -1.73 0.12 114.58 119.16 2ouy h GLU 483 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2ouy h GLU 483 Cb 1.30 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2ouy h GLU 483 CO 0.51 -0.05 0.01 -2.95 -0.73 0.00 0.00 179.01 175.80 2ouy h ASN 484 N -0.07 0.00 0.17 1.04 -1.07 -1.96 -2.32 115.58 111.37 2ouy h ASN 484 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.66 2ouy h ASN 484 Cb 0.53 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.78 2ouy h ASN 484 CO -0.70 0.00 -0.67 0.23 0.07 0.00 0.00 177.43 176.36 2ouy n MET 485 N -2.72 0.31 -0.15 4.14 2.81 0.42 -4.60 117.12 117.33 2ouy n MET 485 Ca -0.02 -0.23 -0.04 0.00 -1.81 0.00 0.00 57.70 55.60 2ouy n MET 485 Cb 0.06 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.10 2ouy n MET 485 CO 0.00 0.00 0.00 -1.49 1.51 0.00 0.00 175.97 175.99 2ouy h TRP 486 N 0.56 -0.46 -0.58 2.03 6.55 -1.30 0.40 115.95 123.15 2ouy h TRP 486 Ca 0.00 0.05 0.01 0.00 0.95 0.00 0.00 58.89 59.90 2ouy h TRP 486 Cb 0.54 0.27 -0.03 0.00 -0.86 0.00 0.00 29.16 29.09 2ouy h TRP 486 CO 0.00 -0.27 0.38 -1.35 -1.05 0.00 0.00 178.44 176.14 2ouy h PRO 487 N -0.08 0.75 -0.19 0.49 0.11 -1.82 -1.77 132.00 129.48 2ouy h PRO 487 Ca 0.23 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 2ouy h PRO 487 Cb 0.43 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2ouy h PRO 487 CO -0.53 0.49 -0.21 0.78 -0.21 0.00 0.00 178.00 178.32 2ouy h GLY 488 N 0.77 0.37 1.30 -0.55 0.00 -1.61 -2.13 103.07 101.22 2ouy h GLY 488 Ca 0.22 -0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 2ouy h GLY 488 CO -0.06 0.25 -0.09 -2.22 0.00 0.00 0.00 176.54 174.42 2ouy h ILE 489 N 0.31 1.26 -0.42 2.60 2.04 0.25 -1.34 117.51 122.21 2ouy h ILE 489 Ca 0.05 -1.16 -0.08 0.00 1.00 0.00 0.00 64.86 64.66 2ouy h ILE 489 Cb 0.55 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2ouy h ILE 489 CO 0.04 0.40 -0.07 0.15 0.00 0.00 0.00 178.15 178.67 2ouy h PHE 490 N 0.75 0.87 -0.56 1.37 3.57 -0.86 -1.41 116.94 120.66 2ouy h PHE 490 Ca 0.13 -0.18 0.03 0.00 3.53 0.00 0.00 57.97 61.48 2ouy h PHE 490 Cb 0.58 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 2ouy h PHE 490 CO 0.03 0.89 0.33 0.28 -2.23 0.00 0.00 178.31 177.61 2ouy h VAL 491 N 0.61 1.04 -0.48 1.41 2.07 -1.20 -1.66 116.25 118.03 2ouy h VAL 491 Ca 0.11 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.44 2ouy h VAL 491 Cb 0.59 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 2ouy h VAL 491 CO 0.04 0.12 0.27 0.22 0.02 0.00 0.00 177.57 178.23 2ouy h TYR 492 N 0.65 0.50 -0.57 1.57 3.20 -1.03 -0.57 116.97 120.72 2ouy h TYR 492 Ca 0.23 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.05 2ouy h TYR 492 Cb 0.05 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 2ouy h TYR 492 CO -0.07 0.27 0.09 0.52 -1.64 0.00 0.00 178.16 177.33 2ouy h MET 493 N 0.53 0.95 -0.71 1.82 2.86 -0.86 -0.89 114.93 118.62 2ouy h MET 493 Ca 0.20 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2ouy h MET 493 Cb 0.06 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 2ouy h MET 493 CO -0.11 0.91 0.38 0.28 1.06 0.00 0.00 176.91 179.42 2ouy h VAL 494 N 0.84 1.22 -0.20 -2.22 2.07 -0.98 -0.74 116.25 116.24 2ouy h VAL 494 Ca 0.17 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 2ouy h VAL 494 Cb 0.42 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2ouy h VAL 494 CO 0.01 0.25 0.06 0.45 0.02 0.00 0.00 177.57 178.36 2ouy h HIS 495 N 0.99 0.33 -0.37 1.57 -0.00 -0.79 0.52 115.15 117.41 2ouy h HIS 495 Ca 0.25 -0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.55 2ouy h HIS 495 Cb 0.06 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.36 2ouy h HIS 495 CO -0.00 0.41 0.11 0.00 -0.00 0.00 0.00 177.93 178.45 2ouy h ARG 496 N 0.15 0.58 0.18 2.45 2.47 -1.03 0.29 114.38 119.47 2ouy h ARG 496 Ca 0.07 -0.13 -0.31 0.00 -1.26 0.00 0.00 59.98 58.35 2ouy h ARG 496 Cb 0.24 -0.08 0.02 0.00 -1.65 0.00 0.00 29.97 28.50 2ouy h ARG 496 CO -0.00 0.60 -1.34 1.03 0.56 0.00 0.00 179.97 180.81 2ouy h SER 497 N 0.45 0.69 0.00 7.04 0.87 -1.11 -3.39 113.55 118.09 2ouy h SER 497 Ca 0.12 -0.71 -0.01 0.00 -1.23 0.00 0.00 61.79 59.95 2ouy h SER 497 Cb 0.27 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2ouy h SER 497 CO -0.00 1.55 -1.70 0.00 -0.53 0.00 0.00 176.83 176.14 2ouy n GLY 499 N 1.67 2.98 0.28 0.00 0.00 0.10 -4.55 105.19 105.69 2ouy n GLY 499 Ca -0.04 -1.67 0.04 0.00 0.00 0.00 0.00 46.02 44.35 2ouy n GLY 499 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ouy h THR 500 N 0.00 0.77 -0.54 2.61 2.02 -1.89 -2.65 112.91 113.21 2ouy h THR 500 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2ouy h THR 500 Cb 0.00 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 2ouy h THR 500 CO 0.00 0.10 0.00 -1.20 0.37 0.00 0.00 175.52 174.79 2ouy n SER 501 N -4.90 5.01 -0.17 4.18 7.64 -1.26 -4.52 113.62 119.61 2ouy n SER 501 Ca 0.14 -2.74 -0.08 0.00 1.01 0.00 0.00 58.87 57.20 2ouy n SER 501 Cb 0.36 -0.61 0.01 0.00 -1.01 0.00 0.00 64.21 62.96 2ouy n SER 501 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ouy s PHE 503 N -5.82 2.21 -0.16 0.00 0.08 -1.26 -5.06 117.98 107.96 2ouy s PHE 503 Ca -0.13 -0.39 -0.29 0.00 0.12 0.00 0.00 56.93 56.23 2ouy s PHE 503 Cb 0.12 -1.24 -0.03 0.00 -0.57 0.00 0.00 43.02 41.29 2ouy s PHE 503 CO 0.76 0.25 1.58 -2.00 -0.10 0.00 0.00 175.22 175.70 2ouy s GLU 504 N -1.78 3.97 0.28 0.44 2.12 -1.26 -4.87 118.70 117.60 2ouy s GLU 504 Ca 0.12 1.82 -0.08 0.00 0.36 0.00 0.00 54.97 57.19 2ouy s GLU 504 Cb -0.10 -3.98 0.47 0.00 0.26 0.00 0.00 34.13 30.78 2ouy s GLU 504 CO 0.04 -1.07 1.56 1.25 -0.54 0.00 0.00 175.26 176.50 2ouy h LEU 505 N 10.97 -0.89 -0.10 2.70 5.85 -1.96 -0.95 115.31 130.93 2ouy h LEU 505 Ca -0.34 0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.71 2ouy h LEU 505 Cb 1.15 0.60 -0.05 0.00 0.37 0.00 0.00 40.66 42.74 2ouy h LEU 505 CO 0.98 -0.33 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.23 2ouy h GLU 506 N 0.00 -0.26 -0.83 1.25 3.07 -1.97 -0.31 114.58 115.54 2ouy h GLU 506 Ca 0.48 0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.32 2ouy h GLU 506 Cb 0.75 0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.68 2ouy h GLU 506 CO -1.01 -0.17 0.38 0.87 -1.40 0.00 0.00 179.01 177.68 2ouy h LYS 507 N -0.27 1.21 -0.04 2.33 1.57 -1.40 -0.88 116.57 119.09 2ouy h LYS 507 Ca 0.09 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2ouy h LYS 507 Cb 0.39 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2ouy h LYS 507 CO -0.25 0.94 0.03 1.25 -0.57 0.00 0.00 179.45 180.85 2ouy h LEU 508 N 1.19 0.05 -1.07 2.94 5.85 -0.78 0.13 115.31 123.62 2ouy h LEU 508 Ca 0.28 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 2ouy h LEU 508 Cb 0.15 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2ouy h LEU 508 CO -0.03 0.05 0.08 0.00 -0.34 0.00 0.00 178.44 178.20 2ouy h ARG 510 N 0.72 0.73 0.07 0.00 3.08 -0.85 -2.18 114.38 115.95 2ouy h ARG 510 Ca 0.16 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 2ouy h ARG 510 Cb 0.32 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2ouy h ARG 510 CO 0.00 0.88 -0.03 0.35 -1.07 0.00 0.00 179.97 180.10 2ouy h PHE 511 N 0.54 -0.09 0.10 3.04 3.57 -0.28 -1.28 116.94 122.55 2ouy h PHE 511 Ca 0.10 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2ouy h PHE 511 Cb 0.61 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 2ouy h PHE 511 CO 0.05 -0.03 -0.08 0.82 -2.23 0.00 0.00 178.31 176.83 2ouy h ILE 512 N -0.11 0.82 0.00 1.41 2.04 -0.92 -0.91 117.51 119.83 2ouy h ILE 512 Ca -0.01 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 2ouy h ILE 512 Cb 0.09 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2ouy h ILE 512 CO 0.02 0.00 -0.31 0.24 0.00 0.00 0.00 178.15 178.10 2ouy h MET 513 N -0.20 0.00 -0.04 2.37 2.86 -1.37 -0.76 114.93 117.80 2ouy h MET 513 Ca -0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 2ouy h MET 513 Cb 0.18 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 2ouy h MET 513 CO -0.01 0.31 -0.82 0.77 1.06 0.00 0.00 176.91 178.22 2ouy h SER 514 N 0.00 0.44 -0.04 1.22 0.02 -1.03 -2.22 113.55 111.95 2ouy h SER 514 Ca -0.00 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2ouy h SER 514 Cb 0.55 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 2ouy h SER 514 CO 0.04 1.09 0.02 0.58 -1.14 0.00 0.00 176.83 177.42 2ouy h VAL 515 N 0.22 1.11 -0.58 2.27 2.07 -0.60 -1.52 116.25 119.22 2ouy h VAL 515 Ca -0.05 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 67.23 2ouy h VAL 515 Cb 1.42 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 32.39 2ouy h VAL 515 CO 0.14 0.09 0.23 0.50 0.02 0.00 0.00 177.57 178.54 2ouy h LYS 516 N -0.07 0.40 0.00 1.57 3.64 -1.15 -0.95 116.57 120.01 2ouy h LYS 516 Ca 0.01 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2ouy h LYS 516 Cb 0.13 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2ouy h LYS 516 CO -0.00 0.27 -0.11 -0.22 -2.27 0.00 0.00 179.45 177.12 2ouy h LYS 517 N 0.42 0.00 -0.51 1.90 3.64 -1.03 -2.47 116.57 118.51 2ouy h LYS 517 Ca 0.29 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2ouy h LYS 517 Cb 0.33 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2ouy h LYS 517 CO -0.28 0.11 0.00 0.09 -2.27 0.00 0.00 179.45 177.10 2ouy n ASN 518 N -3.78 2.75 -4.91 4.20 3.02 -0.37 -4.82 115.26 111.35 2ouy n ASN 518 Ca -0.02 -2.05 -0.31 0.00 -0.03 0.00 0.00 54.58 52.16 2ouy n ASN 518 Cb 0.21 -0.35 -0.04 0.00 -0.61 0.00 0.00 39.78 38.98 2ouy n ASN 518 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2ouy s TYR 519 N -1.41 3.49 0.46 3.10 1.51 -0.93 -1.63 117.35 121.93 2ouy s TYR 519 Ca 0.33 0.44 0.06 0.00 -1.01 0.00 0.00 57.07 56.89 2ouy s TYR 519 Cb 0.18 -1.91 0.02 0.00 -0.11 0.00 0.00 41.96 40.14 2ouy s TYR 519 CO 0.21 0.50 0.64 1.03 -1.11 0.00 0.00 175.55 176.82 2ouy s ARG 520 N -2.58 2.73 -1.29 -0.62 1.81 -1.26 -4.91 118.95 112.84 2ouy s ARG 520 Ca 0.38 -1.10 -0.10 0.00 -1.72 0.00 0.00 55.73 53.19 2ouy s ARG 520 Cb -0.12 -2.67 0.16 0.00 -0.45 0.00 0.00 34.95 31.86 2ouy s ARG 520 CO 0.26 -0.42 1.85 0.54 -0.68 0.00 0.00 175.30 176.85 2ouy n ARG 521 N -2.01 3.53 -4.14 3.54 1.74 -1.26 -4.57 116.66 113.49 2ouy n ARG 521 Ca 0.08 -3.49 -0.22 0.00 -0.77 0.00 0.00 57.85 53.44 2ouy n ARG 521 Cb 0.59 -2.97 -0.05 0.00 -1.02 0.00 0.00 32.46 29.00 2ouy n ARG 521 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2ouy s VAL 522 N 0.79 3.84 0.45 1.55 -7.23 -1.26 -5.04 120.40 113.50 2ouy s VAL 522 Ca 0.41 -1.61 0.15 0.00 -1.81 0.00 0.00 61.98 59.12 2ouy s VAL 522 Cb 0.08 -3.14 0.19 0.00 0.56 0.00 0.00 36.38 34.07 2ouy s VAL 522 CO -0.00 -0.32 2.00 -0.65 -0.31 0.00 0.00 175.10 175.82 2ouy h PRO 523 N 1.60 0.00 0.00 4.82 0.11 -1.92 -3.42 132.00 133.19 2ouy h PRO 523 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2ouy h PRO 523 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2ouy h PRO 523 CO 0.61 0.17 -0.37 0.98 -0.21 0.00 0.00 178.00 179.18 2ouy n TYR 524 N -4.32 -0.41 -1.60 0.65 9.36 -1.26 -4.72 117.16 114.86 2ouy n TYR 524 Ca -0.02 0.07 -0.41 0.00 3.32 0.00 0.00 57.90 60.86 2ouy n TYR 524 Cb 0.24 0.20 -0.01 0.00 -0.63 0.00 0.00 39.34 39.14 2ouy n TYR 524 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2ouy n HIS 525 N -3.10 3.21 -4.22 2.98 8.25 -1.26 -4.40 115.22 116.68 2ouy n HIS 525 Ca 0.00 -2.94 -0.10 0.00 -0.26 0.00 0.00 57.72 54.42 2ouy n HIS 525 Cb 0.19 -2.50 -0.02 0.00 1.12 0.00 0.00 29.99 28.77 2ouy n HIS 525 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2ouy n ASN 526 N 5.61 2.07 -0.35 0.41 0.23 -1.26 -4.63 115.26 117.34 2ouy n ASN 526 Ca 0.57 -1.71 0.03 0.00 -0.53 0.00 0.00 54.58 52.95 2ouy n ASN 526 Cb 0.35 0.17 0.18 0.00 -2.08 0.00 0.00 39.78 38.40 2ouy n ASN 526 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 2ouy h TRP 527 N 1.12 1.10 -0.47 -2.53 2.91 -1.89 -1.89 115.95 114.31 2ouy h TRP 527 Ca -0.13 0.03 0.02 0.00 1.13 0.00 0.00 58.89 59.94 2ouy h TRP 527 Cb 0.40 -0.36 -0.03 0.00 -0.51 0.00 0.00 29.16 28.67 2ouy h TRP 527 CO 0.00 0.53 0.29 -0.22 -1.03 0.00 0.00 178.44 178.01 2ouy h LYS 528 N 1.05 0.56 -0.56 2.65 3.64 -1.96 -2.42 116.57 119.53 2ouy h LYS 528 Ca 0.43 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.77 2ouy h LYS 528 Cb 0.25 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 2ouy h LYS 528 CO -0.20 0.37 0.32 1.25 -2.27 0.00 0.00 179.45 178.92 2ouy h HIS 529 N 0.58 0.75 -0.57 1.91 2.76 -1.61 -1.78 115.15 117.19 2ouy h HIS 529 Ca 0.18 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.41 2ouy h HIS 529 Cb -0.01 -0.24 -0.06 0.00 1.55 0.00 0.00 27.41 28.64 2ouy h HIS 529 CO -0.06 0.54 0.25 0.00 -1.30 0.00 0.00 177.93 177.36 2ouy h ALA 530 N 1.15 0.74 -0.14 5.26 0.00 -0.91 -0.29 119.26 125.06 2ouy h ALA 530 Ca 0.20 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 2ouy h ALA 530 Cb 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2ouy h ALA 530 CO -0.03 -0.14 -0.55 0.28 0.00 0.00 0.00 179.25 178.80 2ouy h VAL 531 N 0.46 1.34 -0.52 0.00 2.07 -1.30 -1.56 116.25 116.73 2ouy h VAL 531 Ca 0.28 -1.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.94 2ouy h VAL 531 Cb 0.28 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2ouy h VAL 531 CO -0.24 0.56 0.22 0.74 0.02 0.00 0.00 177.57 178.86 2ouy h THR 532 N 0.33 1.21 -0.37 2.57 2.02 -0.66 -0.22 112.91 117.79 2ouy h THR 532 Ca 0.01 -0.65 -0.14 0.00 0.77 0.00 0.00 66.41 66.40 2ouy h THR 532 Cb 1.07 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2ouy h THR 532 CO 0.10 0.25 -0.33 0.58 0.37 0.00 0.00 175.52 176.48 2ouy h VAL 533 N 0.71 1.28 -0.64 3.16 2.07 -0.96 -2.34 116.25 119.52 2ouy h VAL 533 Ca 0.18 -1.50 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 2ouy h VAL 533 Cb 0.18 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2ouy h VAL 533 CO -0.02 0.50 0.16 0.00 0.02 0.00 0.00 177.57 178.24 2ouy h ALA 534 N 0.91 1.07 -0.46 1.67 0.00 -0.99 -2.32 119.26 119.13 2ouy h ALA 534 Ca 0.07 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2ouy h ALA 534 Cb 0.90 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2ouy h ALA 534 CO 0.08 0.62 -0.13 1.25 0.00 0.00 0.00 179.25 181.07 2ouy h HIS 535 N 0.96 0.95 -0.63 0.00 6.17 -0.81 -0.37 115.15 121.42 2ouy h HIS 535 Ca 0.21 -0.19 -0.03 0.00 0.71 0.00 0.00 60.37 61.07 2ouy h HIS 535 Cb 0.33 -0.24 -0.03 0.00 2.52 0.00 0.00 27.41 29.99 2ouy h HIS 535 CO 0.02 0.93 0.29 0.00 0.71 0.00 0.00 177.93 179.89 2ouy h MET 537 N 0.88 0.90 -0.24 0.00 -1.53 -1.14 -0.63 114.93 113.18 2ouy h MET 537 Ca 0.22 -0.08 0.05 0.00 -3.44 0.00 0.00 59.70 56.44 2ouy h MET 537 Cb 0.14 -0.19 -0.05 0.00 -0.55 0.00 0.00 31.60 30.95 2ouy h MET 537 CO -0.03 0.64 -0.07 -0.92 0.14 0.00 0.00 176.91 176.68 2ouy h TYR 538 N 0.91 -0.16 -0.59 1.39 3.20 -0.44 0.16 116.97 121.45 2ouy h TYR 538 Ca 0.24 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 2ouy h TYR 538 Cb -0.03 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 2ouy h TYR 538 CO -0.02 -0.12 0.25 0.00 -1.64 0.00 0.00 178.16 176.63 2ouy h ALA 539 N 1.21 1.33 -0.21 1.82 0.00 -0.66 0.12 119.26 122.86 2ouy h ALA 539 Ca 0.12 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2ouy h ALA 539 Cb 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2ouy h ALA 539 CO -0.25 0.51 -0.11 0.82 0.00 0.00 0.00 179.25 180.21 2ouy h ILE 540 N 0.84 1.31 -0.58 0.00 2.04 -0.36 -2.49 117.51 118.27 2ouy h ILE 540 Ca 0.20 -1.19 -0.06 0.00 1.00 0.00 0.00 64.86 64.81 2ouy h ILE 540 Cb 0.14 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2ouy h ILE 540 CO -0.02 0.36 0.13 -0.07 0.00 0.00 0.00 178.15 178.55 2ouy h LEU 541 N 0.15 0.89 -1.00 1.44 3.38 -0.35 -2.40 115.31 117.42 2ouy h LEU 541 Ca 0.05 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2ouy h LEU 541 Cb 0.61 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 2ouy h LEU 541 CO 0.03 0.90 0.66 1.56 0.09 0.00 0.00 178.44 181.69 2ouy h GLN 542 N 0.83 1.31 -0.00 1.13 1.08 -0.77 0.40 115.11 119.09 2ouy h GLN 542 Ca 0.18 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2ouy h GLN 542 Cb 0.37 -0.29 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 2ouy h GLN 542 CO 0.00 0.86 -0.02 0.09 -0.95 0.00 0.00 178.83 178.82 2ouy n ASN 543 N -4.40 0.22 -1.89 1.46 3.02 -0.94 -3.50 115.26 109.23 2ouy n ASN 543 Ca 0.12 -0.80 0.01 0.00 -0.03 0.00 0.00 54.58 53.88 2ouy n ASN 543 Cb 0.03 -0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.15 2ouy n ASN 543 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ouy n ASN 544 N -0.94 0.66 -0.37 6.41 3.02 -0.79 -4.76 115.26 118.49 2ouy n ASN 544 Ca 0.20 -2.02 -0.10 0.00 -0.03 0.00 0.00 54.58 52.63 2ouy n ASN 544 Cb 0.19 -0.18 -0.09 0.00 -0.61 0.00 0.00 39.78 39.09 2ouy n ASN 544 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2ouy n HIS 545 N -0.05 -0.39 1.47 3.10 -0.00 0.14 -1.45 115.22 118.04 2ouy n HIS 545 Ca -0.01 1.10 0.12 0.00 0.46 0.00 0.00 57.72 59.39 2ouy n HIS 545 Cb 0.96 -0.57 0.71 0.00 -0.12 0.00 0.00 29.99 30.97 2ouy n HIS 545 CO 0.00 0.00 0.00 0.25 0.46 0.00 0.00 176.34 177.05 2ouy n THR 546 N -5.03 0.03 0.16 3.57 -2.24 -1.26 -2.79 114.28 106.73 2ouy n THR 546 Ca 0.02 0.01 0.05 0.00 -2.27 0.00 0.00 64.05 61.86 2ouy n THR 546 Cb 0.23 -0.63 0.06 0.00 -2.10 0.00 0.00 70.33 67.90 2ouy n THR 546 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2ouy h LEU 547 N 0.00 0.00 -8.78 3.22 3.38 -1.63 -3.45 115.31 108.06 2ouy h LEU 547 Ca 0.00 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.28 2ouy h LEU 547 Cb 0.03 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.52 2ouy h LEU 547 CO 0.00 0.37 -0.81 -0.36 0.09 0.00 0.00 178.44 177.73 2ouy s PHE 548 N -3.03 2.59 0.88 1.13 0.40 -1.12 -5.12 117.98 113.71 2ouy s PHE 548 Ca 0.05 -0.31 -0.11 0.00 -0.60 0.00 0.00 56.93 55.96 2ouy s PHE 548 Cb 0.07 -1.61 0.12 0.00 0.51 0.00 0.00 43.02 42.11 2ouy s PHE 548 CO 0.73 0.07 1.10 0.95 0.70 0.00 0.00 175.22 178.77 2ouy s THR 549 N -0.59 2.72 0.29 0.64 -4.23 -1.26 -4.81 115.64 108.41 2ouy s THR 549 Ca 0.08 0.23 -0.02 0.00 -1.18 0.00 0.00 61.69 60.81 2ouy s THR 549 Cb -0.11 -2.58 0.27 0.00 1.34 0.00 0.00 72.50 71.41 2ouy s THR 549 CO 0.01 -0.31 1.95 0.44 -0.54 0.00 0.00 174.62 176.17 2ouy h ASP 550 N -1.56 0.97 -0.29 3.99 3.32 -1.98 -1.60 116.42 119.29 2ouy h ASP 550 Ca -0.47 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 2ouy h ASP 550 Cb 1.26 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 2ouy h ASP 550 CO 0.50 0.69 0.14 0.25 -1.72 0.00 0.00 179.24 179.10 2ouy h LEU 551 N 1.14 0.37 -0.84 1.55 5.85 -2.00 -2.44 115.31 118.94 2ouy h LEU 551 Ca 0.34 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.85 2ouy h LEU 551 Cb -0.05 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2ouy h LEU 551 CO -0.09 0.39 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.01 2ouy h GLU 552 N 0.33 0.79 -0.15 1.25 5.08 -1.81 -0.12 114.58 119.96 2ouy h GLU 552 Ca 0.10 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2ouy h GLU 552 Cb 0.12 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2ouy h GLU 552 CO -0.01 0.84 0.04 0.00 -1.00 0.00 0.00 179.01 178.88 2ouy h ARG 553 N 0.73 0.23 -0.30 2.33 3.08 -1.15 0.33 114.38 119.63 2ouy h ARG 553 Ca 0.13 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.03 2ouy h ARG 553 Cb 0.54 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 2ouy h ARG 553 CO 0.03 0.36 -0.25 1.57 -1.07 0.00 0.00 179.97 180.61 2ouy h LYS 554 N 0.05 0.58 -0.15 0.04 2.10 -1.38 -1.73 116.57 116.09 2ouy h LYS 554 Ca 0.05 -0.23 -0.02 0.00 -2.00 0.00 0.00 60.65 58.45 2ouy h LYS 554 Cb 0.23 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.52 2ouy h LYS 554 CO -0.00 0.78 0.01 0.78 -2.00 0.00 0.00 179.45 179.02 2ouy h GLY 555 N 1.01 0.29 1.41 0.07 0.00 -0.78 -2.71 103.07 102.35 2ouy h GLY 555 Ca 0.07 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.10 2ouy h GLY 555 CO 0.05 0.19 -0.16 1.41 0.00 0.00 0.00 176.54 178.04 2ouy h LEU 556 N 0.02 0.69 -0.46 3.11 3.38 -0.20 0.14 115.31 122.00 2ouy h LEU 556 Ca 0.04 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 2ouy h LEU 556 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2ouy h LEU 556 CO 0.01 0.86 -0.10 -0.07 0.09 0.00 0.00 178.44 179.22 2ouy h LEU 557 N 0.63 0.89 -0.46 1.67 3.38 -1.35 -1.12 115.31 118.95 2ouy h LEU 557 Ca 0.10 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 57.61 2ouy h LEU 557 Cb 0.62 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2ouy h LEU 557 CO 0.04 1.04 -0.11 0.40 0.09 0.00 0.00 178.44 179.90 2ouy h ILE 558 N 0.72 1.27 -0.88 1.22 1.08 -1.34 -2.17 117.51 117.42 2ouy h ILE 558 Ca 0.12 -1.23 0.01 0.00 -0.39 0.00 0.00 64.86 63.37 2ouy h ILE 558 Cb 0.65 1.13 -0.04 0.00 -3.07 0.00 0.00 36.82 35.48 2ouy h ILE 558 CO 0.04 0.42 0.58 0.00 -0.69 0.00 0.00 178.15 178.51 2ouy h ALA 559 N 0.87 1.12 -0.63 1.87 0.00 -0.81 -1.79 119.26 119.89 2ouy h ALA 559 Ca 0.12 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2ouy h ALA 559 Cb 0.65 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2ouy h ALA 559 CO 0.05 0.51 0.13 0.00 0.00 0.00 0.00 179.25 179.93 2ouy h LEU 561 N 0.94 0.18 -2.17 0.00 5.85 -0.85 -3.05 115.31 116.20 2ouy h LEU 561 Ca 0.19 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2ouy h LEU 561 Cb 0.40 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2ouy h LEU 561 CO 0.01 0.34 0.00 0.00 -0.34 0.00 0.00 178.44 178.45 2ouy h HIS 563 N 3.48 0.00 0.00 0.00 2.07 -0.41 -1.99 115.15 118.30 2ouy h HIS 563 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 2ouy h HIS 563 Cb 0.81 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.74 2ouy h HIS 563 CO 0.16 0.00 -0.36 0.09 -3.07 0.00 0.00 177.93 174.75 2ouy n ASN 564 N -3.24 1.56 -4.60 3.10 5.03 -1.26 -4.86 115.26 110.99 2ouy n ASN 564 Ca -0.02 -2.98 -0.50 0.00 0.87 0.00 0.00 54.58 51.96 2ouy n ASN 564 Cb 0.20 -0.40 -0.05 0.00 -1.02 0.00 0.00 39.78 38.51 2ouy n ASN 564 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2ouy n LEU 565 N -0.84 1.88 -2.29 3.41 7.94 -0.75 -1.75 117.00 124.61 2ouy n LEU 565 Ca 0.13 1.12 -0.21 0.00 -1.11 0.00 0.00 56.01 55.94 2ouy n LEU 565 Cb 0.73 -1.24 -0.02 0.00 0.53 0.00 0.00 43.42 43.42 2ouy n LEU 565 CO -0.01 -1.00 -0.26 -0.67 -1.11 0.00 0.00 177.39 174.34 2ouy n ASP 566 N 2.42 -5.81 -4.75 1.96 2.03 -0.65 -4.48 116.55 107.28 2ouy n ASP 566 Ca 0.17 0.06 -0.41 0.00 0.52 0.00 0.00 54.79 55.13 2ouy n ASP 566 Cb 0.23 -4.88 -0.03 0.00 -0.72 0.00 0.00 41.12 35.72 2ouy n ASP 566 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2ouy s HIS 567 N -2.99 3.18 -2.25 -0.67 5.65 -0.72 -4.92 115.29 112.57 2ouy s HIS 567 Ca 0.00 1.24 0.23 0.00 0.25 0.00 0.00 55.06 56.78 2ouy s HIS 567 Cb 0.00 -3.65 0.10 0.00 -1.18 0.00 0.00 32.58 27.85 2ouy s HIS 567 CO 0.00 -1.99 1.17 0.54 -0.65 0.00 0.00 174.74 173.81 2ouy n ARG 568 N 2.11 1.45 -0.13 2.88 5.12 -1.26 -4.26 116.66 122.57 2ouy n ARG 568 Ca 0.05 -1.18 0.00 0.00 -1.93 0.00 0.00 57.85 54.78 2ouy n ARG 568 Cb 0.42 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.25 2ouy n ARG 568 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ouy n GLY 569 N 1.40 0.93 3.21 -0.13 0.00 -1.26 -5.00 105.19 104.33 2ouy n GLY 569 Ca 0.11 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2ouy n GLY 569 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ouy s PHE 570 N -2.00 2.36 0.88 1.61 0.40 -1.26 -4.69 117.98 115.28 2ouy s PHE 570 Ca 0.00 -0.86 -0.12 0.00 -0.60 0.00 0.00 56.93 55.35 2ouy s PHE 570 Cb 0.00 -1.57 0.12 0.00 0.51 0.00 0.00 43.02 42.08 2ouy s PHE 570 CO 0.00 -0.33 1.13 -1.54 0.70 0.00 0.00 175.22 175.19 2ouy s SER 571 N 0.19 3.76 0.38 1.36 1.04 -1.26 -4.87 113.70 114.31 2ouy s SER 571 Ca -0.13 1.02 0.08 0.00 0.48 0.00 0.00 55.95 57.40 2ouy s SER 571 Cb -0.16 -1.62 0.75 0.00 0.10 0.00 0.00 66.02 65.09 2ouy s SER 571 CO 0.06 -2.40 1.92 0.78 0.98 0.00 0.00 173.24 174.59 2ouy h ASN 572 N -1.39 0.31 -0.44 7.02 2.35 -2.00 -2.21 115.58 119.23 2ouy h ASN 572 Ca -0.50 -0.06 0.04 0.00 -0.55 0.00 0.00 56.30 55.24 2ouy h ASN 572 Cb 1.32 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.57 2ouy h ASN 572 CO 0.62 0.42 0.21 0.28 -1.65 0.00 0.00 177.43 177.31 2ouy h SER 573 N 0.32 0.30 0.80 5.81 0.02 -1.98 -0.41 113.55 118.41 2ouy h SER 573 Ca 0.07 0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2ouy h SER 573 Cb 0.32 -0.03 0.01 0.00 0.14 0.00 0.00 62.40 62.84 2ouy h SER 573 CO 0.01 0.21 -0.38 0.22 -1.14 0.00 0.00 176.83 175.75 2ouy h TYR 574 N 0.43 -1.00 -0.86 3.45 3.20 -1.78 -1.20 116.97 119.21 2ouy h TYR 574 Ca 0.19 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.17 2ouy h TYR 574 Cb 0.11 0.33 -0.09 0.00 1.54 0.00 0.00 36.73 38.62 2ouy h TYR 574 CO -0.11 -0.61 0.47 -0.07 -1.64 0.00 0.00 178.16 176.20 2ouy h LEU 575 N -1.18 0.61 -0.40 2.82 3.38 -1.31 -0.93 115.31 118.30 2ouy h LEU 575 Ca -0.11 0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2ouy h LEU 575 Cb 0.84 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2ouy h LEU 575 CO 0.18 0.29 -0.68 1.56 0.09 0.00 0.00 178.44 179.88 2ouy h GLN 576 N 0.70 0.00 0.00 1.13 4.20 -1.09 0.46 115.11 120.52 2ouy h GLN 576 Ca 0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.16 2ouy h GLN 576 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2ouy h GLN 576 CO -0.32 0.68 -0.32 1.17 -0.67 0.00 0.00 178.83 179.37 2ouy n LYS 577 N -3.49 0.22 -0.19 1.46 3.00 -0.46 -3.48 118.16 115.22 2ouy n LYS 577 Ca -0.00 0.11 0.08 0.00 -0.00 0.00 0.00 58.31 58.51 2ouy n LYS 577 Cb 0.73 -1.69 0.17 0.00 0.00 0.00 0.00 35.03 34.24 2ouy n LYS 577 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2ouy n PHE 578 N -2.03 0.33 -4.20 5.64 3.01 -0.44 -4.99 117.46 114.78 2ouy n PHE 578 Ca 0.05 -0.89 -0.33 0.00 1.01 0.00 0.00 57.45 57.28 2ouy n PHE 578 Cb 0.41 -0.19 -0.04 0.00 -0.01 0.00 0.00 39.48 39.65 2ouy n PHE 578 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2ouy n ASP 579 N -0.96 -1.59 -4.76 4.37 10.43 -1.01 -4.90 116.55 118.12 2ouy n ASP 579 Ca 0.16 -1.08 -0.37 0.00 2.57 0.00 0.00 54.79 56.07 2ouy n ASP 579 Cb 0.68 -2.52 0.02 0.00 1.84 0.00 0.00 41.12 41.14 2ouy n ASP 579 CO 0.00 0.00 0.00 -2.28 -1.07 0.00 0.00 177.20 173.85 2ouy s HIS 580 N -3.65 2.56 0.31 1.24 2.46 0.12 -4.86 115.29 113.47 2ouy s HIS 580 Ca 0.43 1.48 0.06 0.00 0.47 0.00 0.00 55.06 57.49 2ouy s HIS 580 Cb -0.24 -3.54 0.84 0.00 -0.13 0.00 0.00 32.58 29.52 2ouy s HIS 580 CO 0.94 -2.13 1.64 -1.35 -2.47 0.00 0.00 174.74 171.37 2ouy h PRO 581 N 1.57 0.22 -0.90 2.88 0.11 -1.90 0.64 132.00 134.61 2ouy h PRO 581 Ca -0.50 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.73 2ouy h PRO 581 Cb 1.28 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 2ouy h PRO 581 CO 0.58 0.14 0.58 -0.07 -0.21 0.00 0.00 178.00 179.02 2ouy h LEU 582 N 0.22 0.71 -1.11 2.35 3.38 -1.92 0.63 115.31 119.57 2ouy h LEU 582 Ca 0.62 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.54 2ouy h LEU 582 Cb 1.32 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2ouy h LEU 582 CO -0.66 0.37 -0.43 0.00 0.09 0.00 0.00 178.44 177.81 2ouy h ALA 583 N 1.59 1.20 -0.07 1.53 0.00 -1.07 0.37 119.26 122.82 2ouy h ALA 583 Ca 0.45 -0.39 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2ouy h ALA 583 Cb 0.64 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2ouy h ALA 583 CO -0.21 0.53 -0.51 0.00 0.00 0.00 0.00 179.25 179.06 2ouy h ALA 584 N 1.57 0.15 -0.23 0.00 0.00 -0.83 -3.20 119.26 116.72 2ouy h ALA 584 Ca -0.00 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 2ouy h ALA 584 Cb 0.80 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2ouy h ALA 584 CO 0.06 0.35 -0.11 1.25 0.00 0.00 0.00 179.25 180.80 2ouy h LEU 585 N 0.02 0.50 -7.67 0.00 5.85 -0.99 -3.39 115.31 109.63 2ouy h LEU 585 Ca -0.05 -0.41 -0.67 0.00 0.84 0.00 0.00 57.88 57.60 2ouy h LEU 585 Cb 1.18 -0.14 -0.38 0.00 0.37 0.00 0.00 40.66 41.69 2ouy h LEU 585 CO 0.10 0.79 -0.63 -0.31 -0.34 0.00 0.00 178.44 178.05 2ouy s TYR 586 N -4.60 3.61 0.15 1.25 2.02 0.13 -5.00 117.35 114.90 2ouy s TYR 586 Ca -0.13 -2.86 -0.20 0.00 -0.37 0.00 0.00 57.07 53.50 2ouy s TYR 586 Cb 0.07 -3.01 0.04 0.00 -0.40 0.00 0.00 41.96 38.66 2ouy s TYR 586 CO 0.77 -0.92 1.66 0.77 -1.57 0.00 0.00 175.55 176.26 2ouy h SER 587 N 7.52 -0.53 -2.77 2.29 0.02 -1.77 -3.38 113.55 114.93 2ouy h SER 587 Ca -0.07 0.12 -0.52 0.00 -0.84 0.00 0.00 61.79 60.48 2ouy h SER 587 Cb 1.00 0.28 -0.14 0.00 0.14 0.00 0.00 62.40 63.68 2ouy h SER 587 CO 0.61 -0.20 -0.70 0.42 -1.14 0.00 0.00 176.83 175.82 2ouy s THR 588 N -6.15 1.85 -1.65 -2.27 -4.23 -1.26 -4.72 115.64 97.21 2ouy s THR 588 Ca -0.14 -2.19 -0.14 0.00 -1.18 0.00 0.00 61.69 58.04 2ouy s THR 588 Cb 0.12 -2.37 0.12 0.00 1.34 0.00 0.00 72.50 71.72 2ouy s THR 588 CO 0.69 -0.36 0.65 -1.20 -0.54 0.00 0.00 174.62 173.86 2ouy n SER 589 N -0.57 -2.34 -0.13 3.99 7.64 -1.26 -4.81 113.62 116.13 2ouy n SER 589 Ca -0.06 -1.04 -0.14 0.00 1.01 0.00 0.00 58.87 58.64 2ouy n SER 589 Cb 0.62 -2.67 -0.10 0.00 -1.01 0.00 0.00 64.21 61.05 2ouy n SER 589 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2ouy h THR 590 N -1.55 0.00 -0.29 0.44 2.02 -1.85 -0.18 112.91 111.50 2ouy h THR 590 Ca -0.60 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 66.45 2ouy h THR 590 Cb 1.38 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2ouy h THR 590 CO 0.75 0.00 -0.34 0.24 0.37 0.00 0.00 175.52 176.54 2ouy h MET 591 N -0.41 0.64 -0.77 6.66 2.86 -1.91 -2.78 114.93 119.22 2ouy h MET 591 Ca 0.07 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 2ouy h MET 591 Cb 0.60 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.22 2ouy h MET 591 CO -0.59 0.89 0.41 0.93 1.06 0.00 0.00 176.91 179.62 2ouy h GLU 592 N 0.54 1.08 -0.31 1.72 3.07 -1.80 0.12 114.58 119.01 2ouy h GLU 592 Ca 0.06 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.36 58.70 2ouy h GLU 592 Cb 0.84 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.53 2ouy h GLU 592 CO 0.07 0.81 -0.16 1.96 -1.40 0.00 0.00 179.01 180.29 2ouy h GLN 593 N 1.07 0.54 -0.36 2.33 4.20 -0.97 -2.22 115.11 119.70 2ouy h GLN 593 Ca 0.27 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 2ouy h GLN 593 Cb 0.05 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2ouy h GLN 593 CO -0.04 0.68 0.03 1.25 -0.67 0.00 0.00 178.83 180.08 2ouy h HIS 594 N 0.49 0.67 -0.77 2.96 2.76 -1.05 -2.15 115.15 118.06 2ouy h HIS 594 Ca 0.08 -0.11 0.07 0.00 -2.20 0.00 0.00 60.37 58.22 2ouy h HIS 594 Cb 0.56 -0.18 -0.06 0.00 1.55 0.00 0.00 27.41 29.28 2ouy h HIS 594 CO 0.02 0.70 0.44 0.45 -1.30 0.00 0.00 177.93 178.25 2ouy h HIS 595 N 0.45 0.81 -0.45 5.26 3.86 -0.39 -0.61 115.15 124.07 2ouy h HIS 595 Ca 0.11 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.27 2ouy h HIS 595 Cb 0.42 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 2ouy h HIS 595 CO 0.03 0.37 0.00 0.35 0.86 0.00 0.00 177.93 179.54 2ouy h PHE 596 N 0.79 0.86 -0.86 2.45 3.57 -1.26 -1.02 116.94 121.47 2ouy h PHE 596 Ca 0.35 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2ouy h PHE 596 Cb 0.25 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 2ouy h PHE 596 CO -0.06 0.84 0.55 1.03 -2.23 0.00 0.00 178.31 178.44 2ouy h SER 597 N 0.64 1.01 -0.48 0.41 0.87 -0.79 -1.66 113.55 113.54 2ouy h SER 597 Ca 0.13 -0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.53 2ouy h SER 597 Cb 0.50 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2ouy h SER 597 CO 0.02 0.75 -0.16 1.56 -0.53 0.00 0.00 176.83 178.47 2ouy h GLN 598 N 1.17 0.98 -0.19 2.24 1.08 -0.87 -1.88 115.11 117.64 2ouy h GLN 598 Ca 0.31 -0.39 0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2ouy h GLN 598 Cb -0.10 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 2ouy h GLN 598 CO -0.06 1.06 0.12 1.15 -0.95 0.00 0.00 178.83 180.14 2ouy h THR 599 N 0.86 1.03 -0.38 -0.54 2.02 -0.39 -1.02 112.91 114.49 2ouy h THR 599 Ca 0.12 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.14 2ouy h THR 599 Cb 0.73 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 2ouy h THR 599 CO 0.06 0.04 -0.12 -0.37 0.37 0.00 0.00 175.52 175.50 2ouy h VAL 600 N 0.24 1.25 -0.67 3.16 -1.51 -1.28 -1.70 116.25 115.74 2ouy h VAL 600 Ca 0.07 -1.13 0.01 0.00 -1.23 0.00 0.00 66.70 64.43 2ouy h VAL 600 Cb -0.01 1.09 -0.04 0.00 -2.13 0.00 0.00 31.29 30.21 2ouy h VAL 600 CO -0.03 0.38 0.44 0.28 -1.23 0.00 0.00 177.57 177.41 2ouy h SER 601 N 0.61 0.76 -0.20 4.19 0.02 -0.88 -1.42 113.55 116.62 2ouy h SER 601 Ca 0.11 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 2ouy h SER 601 Cb 0.56 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 2ouy h SER 601 CO 0.04 0.54 -0.17 0.40 -1.14 0.00 0.00 176.83 176.50 2ouy h ILE 602 N 0.90 1.26 0.00 3.27 2.04 -0.79 -2.37 117.51 121.81 2ouy h ILE 602 Ca 0.25 -1.19 -0.03 0.00 1.00 0.00 0.00 64.86 64.89 2ouy h ILE 602 Cb -0.08 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 2ouy h ILE 602 CO -0.06 0.39 -0.15 -0.07 0.00 0.00 0.00 178.15 178.26 2ouy h LEU 603 N 0.56 0.00 -0.28 1.44 3.38 -0.53 -2.34 115.31 117.55 2ouy h LEU 603 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ouy h LEU 603 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2ouy h LEU 603 CO 0.04 0.15 -0.10 0.00 0.09 0.00 0.00 178.44 178.63 2ouy n GLN 604 N -4.22 0.79 -2.14 1.13 6.02 -0.61 -2.49 117.38 115.86 2ouy n GLN 604 Ca -0.02 -0.28 -0.34 0.00 -0.01 0.00 0.00 57.00 56.34 2ouy n GLN 604 Cb 0.22 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 30.00 2ouy n GLN 604 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2ouy s LEU 605 N -2.40 3.66 0.11 1.08 1.43 -0.88 -4.91 118.68 116.77 2ouy s LEU 605 Ca 0.31 2.12 -0.33 0.00 -1.03 0.00 0.00 54.13 55.20 2ouy s LEU 605 Cb 0.20 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.73 2ouy s LEU 605 CO 0.46 -1.30 1.74 1.21 0.23 0.00 0.00 176.35 178.68 2ouy n GLU 606 N -1.57 2.45 -1.12 1.70 2.13 -1.26 -1.67 120.64 121.29 2ouy n GLU 606 Ca 0.11 0.89 -0.04 0.00 0.66 0.00 0.00 57.16 58.78 2ouy n GLU 606 Cb 0.51 -2.73 -0.02 0.00 0.27 0.00 0.00 31.44 29.48 2ouy n GLU 606 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ouy n GLY 607 N 3.95 0.66 0.00 8.31 0.00 -1.26 -4.89 105.19 111.96 2ouy n GLY 607 Ca 0.18 -0.32 0.06 0.00 0.00 0.00 0.00 46.02 45.94 2ouy n GLY 607 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ouy n HIS 608 N -2.66 0.00 -2.52 1.61 8.25 -0.67 -4.27 115.22 114.95 2ouy n HIS 608 Ca -0.04 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.02 2ouy n HIS 608 Cb 0.25 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.31 2ouy n HIS 608 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2ouy s ASN 609 N -2.23 6.40 0.42 0.41 3.84 -1.04 -4.68 114.94 118.07 2ouy s ASN 609 Ca 0.04 -1.38 0.29 0.00 0.21 0.00 0.00 52.86 52.02 2ouy s ASN 609 Cb 0.09 -2.57 1.24 0.00 -0.55 0.00 0.00 41.25 39.46 2ouy s ASN 609 CO 0.50 -1.60 1.87 0.16 -2.79 0.00 0.00 177.10 175.24 2ouy h ILE 610 N 6.82 0.00 -0.15 -5.21 3.07 -1.86 -3.06 117.51 117.12 2ouy h ILE 610 Ca 0.19 -0.35 0.00 0.00 1.55 0.00 0.00 64.86 66.25 2ouy h ILE 610 Cb 1.01 1.21 0.00 0.00 -0.27 0.00 0.00 36.82 38.77 2ouy h ILE 610 CO 1.41 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 179.00 2ouy n PHE 611 N -2.68 0.17 0.26 0.16 0.99 -1.26 -4.53 117.46 110.58 2ouy n PHE 611 Ca 0.01 -0.09 0.10 0.00 -0.00 0.00 0.00 57.45 57.47 2ouy n PHE 611 Cb 0.25 0.00 0.69 0.00 -1.00 0.00 0.00 39.48 39.43 2ouy n PHE 611 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 2ouy h SER 612 N 4.22 0.00 0.13 4.37 0.02 -1.95 -2.05 113.55 118.29 2ouy h SER 612 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ouy h SER 612 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2ouy h SER 612 CO 0.00 0.05 0.00 0.35 -1.14 0.00 0.00 176.83 176.09 2ouy n THR 613 N -4.22 0.03 -2.74 -2.27 -2.24 -1.26 -4.80 114.28 96.77 2ouy n THR 613 Ca -0.03 0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.42 2ouy n THR 613 Cb 0.13 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 67.74 2ouy n THR 613 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ouy s LEU 614 N -2.15 4.01 0.93 3.22 1.43 -0.77 -5.02 118.68 120.32 2ouy s LEU 614 Ca 0.38 1.78 -0.10 0.00 -1.03 0.00 0.00 54.13 55.16 2ouy s LEU 614 Cb 0.19 -4.42 0.15 0.00 0.03 0.00 0.00 46.19 42.14 2ouy s LEU 614 CO 0.35 -0.39 1.13 -0.94 0.23 0.00 0.00 176.35 176.73 2ouy s SER 615 N -2.00 2.86 0.41 2.29 1.04 -1.26 -4.61 113.70 112.42 2ouy s SER 615 Ca 0.61 2.10 0.11 0.00 0.48 0.00 0.00 55.95 59.25 2ouy s SER 615 Cb -0.13 -2.54 0.93 0.00 0.10 0.00 0.00 66.02 64.38 2ouy s SER 615 CO 0.17 -3.13 1.96 0.77 0.98 0.00 0.00 173.24 174.00 2ouy h SER 616 N -1.89 0.47 0.14 7.02 4.64 -1.95 0.27 113.55 122.25 2ouy h SER 616 Ca -0.45 0.01 -0.30 0.00 -0.47 0.00 0.00 61.79 60.58 2ouy h SER 616 Cb 1.27 -0.09 0.03 0.00 -0.31 0.00 0.00 62.40 63.30 2ouy h SER 616 CO 0.43 0.29 -1.25 0.77 -0.87 0.00 0.00 176.83 176.19 2ouy h SER 617 N 0.53 0.87 0.01 4.97 4.64 -2.00 -2.98 113.55 119.59 2ouy h SER 617 Ca 0.30 -0.84 -0.08 0.00 -0.47 0.00 0.00 61.79 60.71 2ouy h SER 617 Cb 0.49 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2ouy h SER 617 CO -0.10 1.62 -0.22 -0.33 -0.87 0.00 0.00 176.83 176.93 2ouy h GLU 618 N 0.24 0.36 0.06 4.77 5.08 -1.77 -0.17 114.58 123.15 2ouy h GLU 618 Ca -0.19 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2ouy h GLU 618 Cb 1.93 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.15 2ouy h GLU 618 CO 0.24 0.57 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.88 2ouy h TYR 619 N 0.33 -0.07 -0.92 4.33 3.20 -1.01 0.22 116.97 123.06 2ouy h TYR 619 Ca 0.05 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2ouy h TYR 619 Cb 0.58 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 2ouy h TYR 619 CO 0.01 -0.01 0.54 0.93 -1.64 0.00 0.00 178.16 178.00 2ouy h GLU 620 N -0.12 1.25 -0.18 1.82 5.08 -1.32 -2.12 114.58 119.00 2ouy h GLU 620 Ca -0.01 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2ouy h GLU 620 Cb 0.10 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 2ouy h GLU 620 CO 0.01 0.89 0.11 1.96 -1.00 0.00 0.00 179.01 180.98 2ouy h GLN 621 N 1.27 0.24 -0.29 2.33 4.20 -0.45 -2.01 115.11 120.40 2ouy h GLN 621 Ca 0.33 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.97 2ouy h GLN 621 Cb -0.03 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 2ouy h GLN 621 CO -0.06 0.19 -0.01 -0.24 -0.67 0.00 0.00 178.83 178.04 2ouy h VAL 622 N 0.22 1.18 -0.27 -0.54 3.04 -0.20 -0.88 116.25 118.80 2ouy h VAL 622 Ca 0.06 -0.73 -0.13 0.00 -1.01 0.00 0.00 66.70 64.89 2ouy h VAL 622 Cb 0.01 0.98 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 2ouy h VAL 622 CO -0.01 0.25 -0.38 -0.07 -1.01 0.00 0.00 177.57 176.34 2ouy h LEU 623 N 0.43 0.65 -0.46 3.16 3.38 -1.16 -1.16 115.31 120.15 2ouy h LEU 623 Ca 0.09 -0.28 -0.15 0.00 0.09 0.00 0.00 57.88 57.63 2ouy h LEU 623 Cb 0.31 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2ouy h LEU 623 CO 0.01 0.97 -0.34 -0.33 0.09 0.00 0.00 178.44 178.84 2ouy h GLU 624 N 0.52 0.91 -0.15 1.13 4.39 -0.79 0.19 114.58 120.77 2ouy h GLU 624 Ca 0.05 -0.45 -0.00 0.00 0.34 0.00 0.00 59.36 59.30 2ouy h GLU 624 Cb 0.89 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 2ouy h GLU 624 CO 0.08 1.10 0.09 0.82 -1.16 0.00 0.00 179.01 179.94 2ouy h ILE 625 N 0.76 1.06 -0.69 3.13 2.04 -1.00 -0.96 117.51 121.86 2ouy h ILE 625 Ca 0.07 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 2ouy h ILE 625 Cb 0.91 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 2ouy h ILE 625 CO 0.08 0.06 0.30 0.40 0.00 0.00 0.00 178.15 178.99 2ouy h ILE 626 N 0.17 1.24 0.01 -0.67 2.04 -1.07 -0.65 117.51 118.59 2ouy h ILE 626 Ca 0.05 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.20 2ouy h ILE 626 Cb 0.02 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2ouy h ILE 626 CO -0.01 0.29 -0.01 -0.09 0.00 0.00 0.00 178.15 178.33 2ouy h ARG 627 N 0.97 -0.02 -0.62 2.37 2.43 -0.38 -0.94 114.38 118.19 2ouy h ARG 627 Ca 0.23 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 2ouy h ARG 627 Cb 0.17 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2ouy h ARG 627 CO -0.02 0.09 0.24 0.87 -1.51 0.00 0.00 179.97 179.64 2ouy h LYS 628 N -0.12 0.93 -0.18 0.20 1.57 -1.11 -1.43 116.57 116.42 2ouy h LYS 628 Ca -0.00 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2ouy h LYS 628 Cb 0.11 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2ouy h LYS 628 CO 0.00 0.79 0.11 0.00 -0.57 0.00 0.00 179.45 179.79 2ouy h ALA 629 N 1.09 0.23 -0.60 3.86 0.00 -0.95 0.24 119.26 123.13 2ouy h ALA 629 Ca 0.20 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2ouy h ALA 629 Cb 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2ouy h ALA 629 CO -0.02 -0.28 -0.03 0.82 0.00 0.00 0.00 179.25 179.75 2ouy h ILE 630 N 0.23 1.27 -0.20 0.00 2.04 -1.09 -2.53 117.51 117.22 2ouy h ILE 630 Ca 0.07 -1.19 -0.07 0.00 1.00 0.00 0.00 64.86 64.67 2ouy h ILE 630 Cb 0.00 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2ouy h ILE 630 CO -0.01 0.43 -0.17 0.40 0.00 0.00 0.00 178.15 178.80 2ouy h ILE 631 N 0.97 1.22 0.00 -0.67 1.08 -1.08 -1.69 117.51 117.34 2ouy h ILE 631 Ca 0.17 -0.99 -0.00 0.00 -0.39 0.00 0.00 64.86 63.64 2ouy h ILE 631 Cb 0.59 1.25 -0.00 0.00 -3.07 0.00 0.00 36.82 35.60 2ouy h ILE 631 CO 0.04 0.31 -0.00 0.00 -0.69 0.00 0.00 178.15 177.81 2ouy h ALA 632 N 1.51 1.04 0.00 1.87 0.00 -0.50 -1.39 119.26 121.79 2ouy h ALA 632 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2ouy h ALA 632 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2ouy h ALA 632 CO 0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.53 2ouy n THR 633 N -3.14 0.00 -2.48 0.00 -2.24 -0.64 -4.51 114.28 101.27 2ouy n THR 633 Ca -0.03 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 2ouy n THR 633 Cb 0.09 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 67.77 2ouy n THR 633 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ouy s ASP 634 N -1.89 6.34 0.63 3.42 -1.08 -0.53 -4.86 116.67 118.71 2ouy s ASP 634 Ca 0.33 0.31 0.34 0.00 -0.52 0.00 0.00 52.55 53.01 2ouy s ASP 634 Cb 0.15 -2.55 1.90 0.00 -1.46 0.00 0.00 42.92 40.97 2ouy s ASP 634 CO 0.26 -1.53 2.15 0.25 0.52 0.00 0.00 175.17 176.82 2ouy h LEU 635 N 12.31 0.00 -1.33 -1.34 5.85 -1.89 -1.18 115.31 127.73 2ouy h LEU 635 Ca -0.26 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.51 2ouy h LEU 635 Cb 1.08 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 2ouy h LEU 635 CO 1.16 0.00 0.49 0.00 -0.34 0.00 0.00 178.44 179.75 2ouy h ALA 636 N 1.75 1.61 0.00 1.25 0.00 -1.93 -1.77 119.26 120.18 2ouy h ALA 636 Ca 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2ouy h ALA 636 Cb 0.35 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2ouy h ALA 636 CO -0.00 0.30 -0.11 -0.07 0.00 0.00 0.00 179.25 179.36 2ouy h LEU 637 N 0.85 0.00 -0.35 0.00 3.38 -1.55 -3.35 115.31 114.29 2ouy h LEU 637 Ca 0.30 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.31 2ouy h LEU 637 Cb 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2ouy h LEU 637 CO -0.09 0.11 0.16 0.22 0.09 0.00 0.00 178.44 178.92 2ouy h TYR 638 N 0.00 0.28 -0.30 1.13 3.20 -1.35 -2.09 116.97 117.84 2ouy h TYR 638 Ca -0.00 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.95 2ouy h TYR 638 Cb 1.01 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.14 2ouy h TYR 638 CO 0.00 0.14 -0.15 0.74 -1.64 0.00 0.00 178.16 177.25 2ouy h PHE 639 N 0.33 -0.35 -0.54 -3.82 -1.00 -1.69 0.18 116.94 110.04 2ouy h PHE 639 Ca 0.15 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.91 2ouy h PHE 639 Cb 0.09 0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.83 2ouy h PHE 639 CO -0.12 -0.22 0.10 0.78 -1.61 0.00 0.00 178.31 177.25 2ouy h GLY 640 N -0.10 0.95 0.92 -1.45 0.00 -1.77 -2.17 103.07 99.44 2ouy h GLY 640 Ca 0.16 -0.62 0.02 0.00 0.00 0.00 0.00 47.33 46.89 2ouy h GLY 640 CO -0.37 0.57 0.27 -0.57 0.00 0.00 0.00 176.54 176.45 2ouy h ASN 641 N 0.77 0.44 -0.55 0.19 -0.00 -0.62 -1.40 115.58 114.41 2ouy h ASN 641 Ca 0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 56.30 56.42 2ouy h ASN 641 Cb 0.38 -0.10 -0.02 0.00 -0.00 0.00 0.00 38.32 38.58 2ouy h ASN 641 CO 0.01 0.32 0.16 -0.09 -0.00 0.00 0.00 177.43 177.83 2ouy h ARG 642 N 0.55 0.86 -0.51 6.67 1.12 -0.58 -1.11 114.38 121.38 2ouy h ARG 642 Ca 0.17 -0.19 -0.01 0.00 -1.11 0.00 0.00 59.98 58.84 2ouy h ARG 642 Cb -0.00 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 29.81 2ouy h ARG 642 CO -0.07 0.79 0.27 -0.22 -3.11 0.00 0.00 179.97 177.63 2ouy h LYS 643 N 0.77 0.72 -0.18 0.20 3.64 -1.12 0.93 116.57 121.53 2ouy h LYS 643 Ca 0.18 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2ouy h LYS 643 Cb 0.30 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2ouy h LYS 643 CO -0.00 0.57 0.12 1.96 -2.27 0.00 0.00 179.45 179.83 2ouy h GLN 644 N 0.68 0.24 -0.57 1.90 1.08 -1.01 -0.92 115.11 116.51 2ouy h GLN 644 Ca 0.18 -0.02 -0.07 0.00 -1.45 0.00 0.00 58.65 57.29 2ouy h GLN 644 Cb 0.07 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 2ouy h GLN 644 CO -0.03 0.16 0.08 -0.07 -0.95 0.00 0.00 178.83 178.03 2ouy h LEU 645 N 0.24 0.88 -0.33 1.46 3.38 -0.97 0.36 115.31 120.33 2ouy h LEU 645 Ca 0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2ouy h LEU 645 Cb -0.02 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2ouy h LEU 645 CO -0.01 0.89 0.17 -0.08 0.09 0.00 0.00 178.44 179.50 2ouy h GLU 646 N 0.87 0.47 -0.35 1.13 4.57 -0.57 0.13 114.58 120.83 2ouy h GLU 646 Ca 0.18 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.28 2ouy h GLU 646 Cb 0.40 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.89 2ouy h GLU 646 CO 0.01 0.42 0.19 1.49 -1.18 0.00 0.00 179.01 179.94 2ouy h GLU 647 N 0.40 0.50 -0.22 1.92 4.81 -0.86 -1.05 114.58 120.09 2ouy h GLU 647 Ca 0.11 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2ouy h GLU 647 Cb 0.10 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 2ouy h GLU 647 CO -0.02 0.43 0.10 0.52 -0.73 0.00 0.00 179.01 179.31 2ouy h MET 648 N 0.44 0.21 -0.32 1.92 2.86 -0.61 -1.70 114.93 117.73 2ouy h MET 648 Ca 0.12 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2ouy h MET 648 Cb 0.08 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 2ouy h MET 648 CO -0.02 0.14 0.19 -0.92 1.06 0.00 0.00 176.91 177.36 2ouy h TYR 649 N 0.21 0.41 -0.23 -0.22 3.20 -0.58 0.80 116.97 120.57 2ouy h TYR 649 Ca 0.09 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.83 2ouy h TYR 649 Cb 0.03 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2ouy h TYR 649 CO -0.10 0.29 -0.40 1.96 -1.64 0.00 0.00 178.16 178.27 2ouy h GLN 650 N 0.41 0.54 0.00 1.82 4.20 -1.08 -2.87 115.11 118.14 2ouy h GLN 650 Ca 0.11 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.55 2ouy h GLN 650 Cb -0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2ouy h GLN 650 CO -0.02 0.85 -0.13 0.25 -0.67 0.00 0.00 178.83 179.12 2ouy n THR 651 N -4.03 0.41 -0.55 -0.54 -2.24 -0.65 -4.91 114.28 101.78 2ouy n THR 651 Ca -0.02 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2ouy n THR 651 Cb 0.51 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 2ouy n THR 651 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ouy n GLY 652 N 1.36 0.74 0.21 3.38 0.00 -0.56 -4.94 105.19 105.37 2ouy n GLY 652 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 2ouy n GLY 652 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ouy h SER 653 N 0.00 0.49 -1.22 1.61 0.02 -1.15 -3.46 113.55 109.84 2ouy h SER 653 Ca 0.00 -0.25 -0.79 0.00 -0.84 0.00 0.00 61.79 59.91 2ouy h SER 653 Cb 0.00 -0.14 0.03 0.00 0.14 0.00 0.00 62.40 62.43 2ouy h SER 653 CO 0.00 0.91 0.52 -0.11 -1.14 0.00 0.00 176.83 177.01 2ouy n LEU 654 N -3.97 1.19 -3.53 5.07 7.94 -0.77 -4.94 117.00 117.99 2ouy n LEU 654 Ca -0.02 1.15 -0.27 0.00 -1.11 0.00 0.00 56.01 55.75 2ouy n LEU 654 Cb 0.57 -1.00 -0.14 0.00 0.53 0.00 0.00 43.42 43.38 2ouy n LEU 654 CO 0.45 -1.09 -0.31 0.21 -1.11 0.00 0.00 177.39 175.55 2ouy s ASN 655 N 1.87 3.27 0.37 1.96 3.04 -1.26 -4.99 114.94 119.20 2ouy s ASN 655 Ca 0.96 -1.20 0.19 0.00 0.04 0.00 0.00 52.86 52.86 2ouy s ASN 655 Cb -1.26 -0.24 1.03 0.00 -1.54 0.00 0.00 41.25 39.24 2ouy s ASN 655 CO 0.66 -0.43 1.53 -0.07 -3.04 0.00 0.00 177.10 175.75 2ouy h LEU 656 N 8.39 0.00 -0.12 3.21 3.38 -1.94 0.42 115.31 128.66 2ouy h LEU 656 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2ouy h LEU 656 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2ouy h LEU 656 CO 0.42 0.00 -0.29 0.59 0.09 0.00 0.00 178.44 179.25 2ouy n ASN 657 N -2.24 0.48 -4.52 -0.43 3.02 -1.26 -4.59 115.26 105.71 2ouy n ASN 657 Ca -0.01 -0.26 -0.43 0.00 -0.03 0.00 0.00 54.58 53.85 2ouy n ASN 657 Cb 0.21 0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.34 2ouy n ASN 657 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2ouy s ASN 658 N -2.82 6.36 0.29 6.41 3.04 0.15 -4.95 114.94 123.41 2ouy s ASN 658 Ca 0.17 -0.28 0.04 0.00 0.04 0.00 0.00 52.86 52.83 2ouy s ASN 658 Cb 0.19 -2.36 0.69 0.00 -1.54 0.00 0.00 41.25 38.22 2ouy s ASN 658 CO 0.60 -0.91 1.75 -0.61 -3.04 0.00 0.00 177.10 174.89 2ouy h GLN 659 N 8.99 0.63 -0.48 0.43 5.75 -1.84 0.37 115.11 128.96 2ouy h GLN 659 Ca -0.25 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.18 2ouy h GLN 659 Cb 1.09 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 29.47 2ouy h GLN 659 CO 0.96 0.42 0.18 0.66 -2.65 0.00 0.00 178.83 178.39 2ouy h SER 660 N 0.65 0.63 -0.14 -0.69 4.64 -1.93 -0.35 113.55 116.36 2ouy h SER 660 Ca 0.55 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.70 2ouy h SER 660 Cb 0.88 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2ouy h SER 660 CO -0.41 0.59 -0.26 0.45 -0.87 0.00 0.00 176.83 176.32 2ouy h HIS 661 N 0.69 0.54 -0.45 4.77 3.86 -0.73 -3.08 115.15 120.73 2ouy h HIS 661 Ca 0.16 -0.19 0.08 0.00 -1.16 0.00 0.00 60.37 59.26 2ouy h HIS 661 Cb 0.17 -0.10 -0.07 0.00 1.06 0.00 0.00 27.41 28.46 2ouy h HIS 661 CO 0.01 0.89 0.04 0.00 0.86 0.00 0.00 177.93 179.72 2ouy h ARG 662 N 0.03 0.15 -0.75 2.45 3.08 0.18 -1.56 114.38 117.96 2ouy h ARG 662 Ca 0.01 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.12 2ouy h ARG 662 Cb 0.85 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.80 2ouy h ARG 662 CO 0.06 0.10 0.43 -0.44 -1.07 0.00 0.00 179.97 179.05 2ouy h ASP 663 N 0.16 0.63 -0.33 7.04 3.32 -1.11 -0.58 116.42 125.54 2ouy h ASP 663 Ca 0.23 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.29 2ouy h ASP 663 Cb 0.32 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2ouy h ASP 663 CO -0.34 0.38 0.11 0.03 -1.72 0.00 0.00 179.24 177.70 2ouy h ARG 664 N 0.76 0.51 -0.35 3.56 3.08 -1.24 0.08 114.38 120.77 2ouy h ARG 664 Ca 0.35 -0.10 0.04 0.00 0.07 0.00 0.00 59.98 60.33 2ouy h ARG 664 Cb 0.26 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 2ouy h ARG 664 CO -0.21 0.53 0.13 0.28 -1.07 0.00 0.00 179.97 179.64 2ouy h VAL 665 N 0.38 0.92 -0.89 2.04 2.07 -0.80 -0.52 116.25 119.45 2ouy h VAL 665 Ca 0.11 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2ouy h VAL 665 Cb 0.23 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2ouy h VAL 665 CO -0.00 0.05 0.50 0.40 0.02 0.00 0.00 177.57 178.54 2ouy h ILE 666 N 0.29 1.25 -0.79 4.57 2.04 -0.92 -0.37 117.51 123.59 2ouy h ILE 666 Ca 0.16 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 2ouy h ILE 666 Cb 0.12 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.20 2ouy h ILE 666 CO -0.15 0.28 0.47 1.23 0.00 0.00 0.00 178.15 179.98 2ouy h GLY 667 N 1.24 1.15 1.02 5.37 0.00 -0.10 -0.87 103.07 110.88 2ouy h GLY 667 Ca 0.31 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 2ouy h GLY 667 CO -0.05 0.47 -0.01 -2.00 0.00 0.00 0.00 176.54 174.95 2ouy h LEU 668 N 1.08 0.88 -1.08 3.11 5.85 -0.42 -1.66 115.31 123.08 2ouy h LEU 668 Ca 0.28 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 58.78 2ouy h LEU 668 Cb -0.03 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 40.69 2ouy h LEU 668 CO -0.05 0.98 0.62 0.24 -0.34 0.00 0.00 178.44 179.89 2ouy h MET 669 N 0.76 1.00 -0.60 1.25 2.86 -0.58 0.11 114.93 119.73 2ouy h MET 669 Ca 0.14 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 2ouy h MET 669 Cb 0.53 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 2ouy h MET 669 CO 0.03 0.66 0.16 0.52 1.06 0.00 0.00 176.91 179.34 2ouy h MET 670 N 1.03 0.96 -0.40 1.72 2.86 -0.51 -1.15 114.93 119.44 2ouy h MET 670 Ca 0.44 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 2ouy h MET 670 Cb 0.33 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 2ouy h MET 670 CO -0.20 0.87 0.16 1.15 1.06 0.00 0.00 176.91 179.95 2ouy h THR 671 N 0.87 1.20 -0.58 2.22 2.02 -0.31 -0.94 112.91 117.39 2ouy h THR 671 Ca 0.19 -0.60 0.06 0.00 0.77 0.00 0.00 66.41 66.83 2ouy h THR 671 Cb 0.33 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.53 2ouy h THR 671 CO -0.00 0.22 0.28 0.00 0.37 0.00 0.00 175.52 176.38 2ouy h ALA 672 N 1.01 0.75 -0.30 6.16 0.00 -0.47 -1.26 119.26 125.14 2ouy h ALA 672 Ca 0.13 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2ouy h ALA 672 Cb 0.19 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2ouy h ALA 672 CO -0.01 -0.09 -0.46 0.00 0.00 0.00 0.00 179.25 178.69 2ouy h ASP 674 N 0.64 1.12 -0.39 0.00 3.58 -0.72 -2.58 116.42 118.06 2ouy h ASP 674 Ca 0.04 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2ouy h ASP 674 Cb 1.04 -0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.81 2ouy h ASP 674 CO 0.10 0.90 0.00 0.18 -2.88 0.00 0.00 179.24 177.54 2ouy n LEU 675 N -4.34 2.51 0.16 2.28 4.77 -0.51 -4.62 117.00 117.24 2ouy n LEU 675 Ca 0.10 -1.18 0.07 0.00 -0.03 0.00 0.00 56.01 54.96 2ouy n LEU 675 Cb 0.10 -0.26 0.38 0.00 -2.33 0.00 0.00 43.42 41.31 2ouy n LEU 675 CO 0.39 0.59 0.79 0.00 -1.33 0.00 0.00 177.39 177.83 2ouy h SER 677 N 0.00 0.00 0.00 0.00 4.64 -1.85 0.12 113.55 116.46 2ouy h SER 677 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ouy h SER 677 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2ouy h SER 677 CO 0.00 0.01 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 2ouy n VAL 678 N -4.26 0.00 -0.24 0.95 0.24 -0.82 -2.71 118.33 111.50 2ouy n VAL 678 Ca -0.03 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.31 2ouy n VAL 678 Cb 0.10 -0.59 0.12 0.00 -1.47 0.00 0.00 33.84 32.00 2ouy n VAL 678 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2ouy n THR 679 N -0.95 1.15 -2.76 3.34 -2.24 0.42 -3.55 114.28 109.68 2ouy n THR 679 Ca 0.16 -1.13 -0.20 0.00 -2.27 0.00 0.00 64.05 60.60 2ouy n THR 679 Cb 0.07 0.40 0.04 0.00 -2.10 0.00 0.00 70.33 68.75 2ouy n THR 679 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ouy s LYS 680 N -1.24 2.44 0.58 -0.78 -0.14 -1.10 -4.61 119.74 114.88 2ouy s LYS 680 Ca 0.18 -1.04 -0.21 0.00 -1.36 0.00 0.00 55.97 53.54 2ouy s LYS 680 Cb 0.11 -2.55 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 2ouy s LYS 680 CO 0.10 -0.74 1.35 1.28 -0.76 0.00 0.00 175.35 176.58 2ouy n LEU 681 N -2.29 5.75 -0.30 3.17 4.77 -1.26 -4.58 117.00 122.25 2ouy n LEU 681 Ca 0.10 0.94 0.04 0.00 -0.03 0.00 0.00 56.01 57.06 2ouy n LEU 681 Cb 0.60 -1.58 0.12 0.00 -2.33 0.00 0.00 43.42 40.23 2ouy n LEU 681 CO 0.43 -0.66 0.70 -0.25 -1.33 0.00 0.00 177.39 176.28 2ouy h TRP 682 N 1.20 -0.42 -0.95 -1.77 2.91 -1.95 -0.09 115.95 114.88 2ouy h TRP 682 Ca -0.51 0.08 0.09 0.00 1.13 0.00 0.00 58.89 59.68 2ouy h TRP 682 Cb 1.31 0.32 -0.07 0.00 -0.51 0.00 0.00 29.16 30.21 2ouy h TRP 682 CO 0.44 -0.37 0.61 -1.35 -1.03 0.00 0.00 178.44 176.75 2ouy h PRO 683 N 0.01 0.99 -0.20 2.65 0.11 -2.00 -0.25 132.00 133.30 2ouy h PRO 683 Ca 0.42 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.41 2ouy h PRO 683 Cb 0.66 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 2ouy h PRO 683 CO -0.88 0.65 -0.11 0.28 -0.21 0.00 0.00 178.00 177.73 2ouy h VAL 684 N 1.02 1.31 -0.67 3.15 2.07 -1.39 -2.26 116.25 119.48 2ouy h VAL 684 Ca 0.44 -1.19 0.06 0.00 0.82 0.00 0.00 66.70 66.82 2ouy h VAL 684 Cb 0.33 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 2ouy h VAL 684 CO -0.19 0.36 0.38 0.74 0.02 0.00 0.00 177.57 178.88 2ouy h THR 685 N 0.13 0.98 -0.40 2.57 2.02 -0.69 -1.77 112.91 115.74 2ouy h THR 685 Ca 0.04 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.94 2ouy h THR 685 Cb 0.61 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2ouy h THR 685 CO 0.03 0.13 0.09 0.50 0.37 0.00 0.00 175.52 176.64 2ouy h LYS 686 N 0.70 0.64 -0.61 6.66 1.63 -0.99 -1.19 116.57 123.40 2ouy h LYS 686 Ca 0.30 -0.16 -0.04 0.00 -0.85 0.00 0.00 60.65 59.90 2ouy h LYS 686 Cb 0.18 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 2ouy h LYS 686 CO -0.18 0.67 0.21 -0.07 -3.45 0.00 0.00 179.45 176.64 2ouy h LEU 687 N 0.51 0.84 -0.57 5.20 3.38 -1.01 -2.01 115.31 121.64 2ouy h LEU 687 Ca 0.13 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2ouy h LEU 687 Cb 0.32 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2ouy h LEU 687 CO 0.00 0.78 -0.40 0.74 0.09 0.00 0.00 178.44 179.65 2ouy h THR 688 N 0.89 1.29 -0.90 0.22 2.02 -1.16 -2.63 112.91 112.65 2ouy h THR 688 Ca 0.21 -1.58 0.01 0.00 0.77 0.00 0.00 66.41 65.82 2ouy h THR 688 Cb 0.22 1.50 -0.05 0.00 -1.74 0.00 0.00 68.15 68.09 2ouy h THR 688 CO -0.01 0.51 0.59 0.00 0.37 0.00 0.00 175.52 176.98 2ouy h ALA 689 N 0.99 1.38 -0.71 6.16 0.00 -0.71 -0.82 119.26 125.54 2ouy h ALA 689 Ca 0.05 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2ouy h ALA 689 Cb 0.94 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2ouy h ALA 689 CO 0.09 0.57 0.42 -0.91 0.00 0.00 0.00 179.25 179.42 2ouy h ASN 690 N 1.19 0.66 -0.49 0.00 2.35 -1.01 -1.37 115.58 116.92 2ouy h ASN 690 Ca 0.33 0.02 -0.08 0.00 -0.55 0.00 0.00 56.30 56.02 2ouy h ASN 690 Cb -0.11 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.13 2ouy h ASN 690 CO -0.08 0.43 0.00 0.44 -1.65 0.00 0.00 177.43 176.58 2ouy h ASP 691 N 0.79 0.84 -0.49 5.81 3.32 -1.13 -0.57 116.42 124.98 2ouy h ASP 691 Ca 0.31 -0.31 0.04 0.00 0.02 0.00 0.00 57.03 57.09 2ouy h ASP 691 Cb 0.13 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 2ouy h ASP 691 CO -0.16 0.94 0.25 0.40 -1.72 0.00 0.00 179.24 178.95 2ouy h ILE 692 N 0.72 0.96 -0.04 0.35 2.04 -0.72 -2.16 117.51 118.66 2ouy h ILE 692 Ca 0.14 -0.17 -0.15 0.00 1.00 0.00 0.00 64.86 65.69 2ouy h ILE 692 Cb 0.51 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2ouy h ILE 692 CO 0.02 0.09 -0.64 1.88 0.00 0.00 0.00 178.15 179.51 2ouy h TYR 693 N 0.49 0.20 -0.69 1.37 -1.99 -1.10 -2.22 116.97 113.02 2ouy h TYR 693 Ca 0.21 -0.08 0.01 0.00 2.00 0.00 0.00 58.73 60.87 2ouy h TYR 693 Cb 0.12 -0.03 -0.03 0.00 2.00 0.00 0.00 36.73 38.78 2ouy h TYR 693 CO -0.10 0.74 0.46 0.00 -0.00 0.00 0.00 178.16 179.26 2ouy h ALA 694 N 1.24 0.88 -0.34 3.88 0.00 -0.61 0.87 119.26 125.17 2ouy h ALA 694 Ca -0.01 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 2ouy h ALA 694 Cb 1.14 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2ouy h ALA 694 CO 0.09 0.30 -0.42 1.49 0.00 0.00 0.00 179.25 180.72 2ouy h GLU 695 N 0.94 0.84 -0.38 0.00 4.81 -1.28 -2.45 114.58 117.06 2ouy h GLU 695 Ca 0.25 -0.45 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 2ouy h GLU 695 Cb -0.11 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2ouy h GLU 695 CO -0.06 1.09 -0.21 0.74 -0.73 0.00 0.00 179.01 179.84 2ouy h PHE 696 N 0.68 0.82 -0.13 0.92 0.04 -0.97 -2.28 116.94 116.02 2ouy h PHE 696 Ca 0.05 -0.18 -0.11 0.00 2.80 0.00 0.00 57.97 60.53 2ouy h PHE 696 Cb 0.99 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.93 2ouy h PHE 696 CO 0.06 0.88 -0.43 -1.49 -0.60 0.00 0.00 178.31 176.73 2ouy h TRP 697 N 0.64 0.34 -0.63 -0.55 6.55 -0.81 -0.90 115.95 120.60 2ouy h TRP 697 Ca 0.09 -0.10 -0.09 0.00 0.95 0.00 0.00 58.89 59.75 2ouy h TRP 697 Cb 0.70 -0.07 -0.02 0.00 -0.86 0.00 0.00 29.16 28.90 2ouy h TRP 697 CO 0.03 0.67 0.05 0.00 -1.05 0.00 0.00 178.44 178.15 2ouy h ALA 698 N 1.31 0.89 -0.63 1.49 0.00 -1.19 -0.12 119.26 121.02 2ouy h ALA 698 Ca 0.02 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 2ouy h ALA 698 Cb 0.86 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2ouy h ALA 698 CO 0.07 0.67 0.05 1.49 0.00 0.00 0.00 179.25 181.52 2ouy h GLU 699 N 0.99 1.08 -0.69 0.00 4.81 -1.06 -2.69 114.58 117.03 2ouy h GLU 699 Ca 0.19 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 2ouy h GLU 699 Cb 0.50 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 2ouy h GLU 699 CO 0.02 1.03 0.41 0.78 -0.73 0.00 0.00 179.01 180.52 2ouy h GLY 700 N 0.99 1.01 1.62 1.92 0.00 -0.50 -2.07 103.07 106.04 2ouy h GLY 700 Ca 0.18 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 47.02 2ouy h GLY 700 CO 0.02 0.41 -0.17 -0.55 0.00 0.00 0.00 176.54 176.25 2ouy h ASP 701 N 0.96 0.44 -0.14 0.19 3.32 -0.73 -2.32 116.42 118.14 2ouy h ASP 701 Ca 0.25 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.99 2ouy h ASP 701 Cb -0.02 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 2ouy h ASP 701 CO -0.05 0.63 -0.59 -0.33 -1.72 0.00 0.00 179.24 177.19 2ouy h GLU 702 N 0.41 0.74 -0.48 3.56 4.39 -1.11 -2.45 114.58 119.64 2ouy h GLU 702 Ca 0.07 -0.49 -0.03 0.00 0.34 0.00 0.00 59.36 59.25 2ouy h GLU 702 Cb 0.54 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2ouy h GLU 702 CO 0.04 1.11 0.20 0.52 -1.16 0.00 0.00 179.01 179.72 2ouy h MET 703 N 0.56 0.72 -0.07 2.33 2.86 -1.21 -2.74 114.93 117.37 2ouy h MET 703 Ca 0.00 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2ouy h MET 703 Cb 1.18 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.68 2ouy h MET 703 CO 0.12 0.64 -0.15 0.87 1.06 0.00 0.00 176.91 179.45 2ouy h LYS 704 N 0.64 -0.20 0.00 1.72 1.57 -1.26 -0.12 116.57 118.91 2ouy h LYS 704 Ca 0.16 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2ouy h LYS 704 Cb 0.18 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2ouy h LYS 704 CO -0.01 -0.14 0.26 0.87 -0.57 0.00 0.00 179.45 179.86 2ouy h LYS 705 N -0.21 0.00 -0.41 3.15 1.57 -1.20 0.61 116.57 120.07 2ouy h LYS 705 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2ouy h LYS 705 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2ouy h LYS 705 CO -0.20 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 179.96 2ouy n LEU 706 N -2.83 3.85 -0.25 2.94 4.77 -0.16 -4.97 117.00 120.34 2ouy n LEU 706 Ca -0.02 -2.48 -0.03 0.00 -0.03 0.00 0.00 56.01 53.44 2ouy n LEU 706 Cb 0.31 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 2ouy n LEU 706 CO 0.14 0.74 -0.03 0.61 -1.33 0.00 0.00 177.39 177.51 2ouy n GLY 707 N 0.37 0.63 3.02 -0.72 0.00 0.21 -5.03 105.19 103.66 2ouy n GLY 707 Ca 0.19 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 2ouy n GLY 707 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ouy s ILE 708 N -2.11 1.65 0.18 -0.61 -1.09 -0.57 -5.01 121.20 113.63 2ouy s ILE 708 Ca 0.00 -0.82 -0.30 0.00 -2.23 0.00 0.00 60.65 57.30 2ouy s ILE 708 Cb 0.00 -1.61 -0.08 0.00 -1.58 0.00 0.00 42.46 39.19 2ouy s ILE 708 CO 0.00 0.35 1.20 -1.58 -1.23 0.00 0.00 174.94 173.67 2ouy s GLN 709 N 1.43 4.49 0.62 2.79 0.74 -1.26 -2.83 119.66 125.64 2ouy s GLN 709 Ca 0.02 1.87 -0.08 0.00 0.05 0.00 0.00 55.36 57.23 2ouy s GLN 709 Cb -0.14 -3.24 0.00 0.00 1.10 0.00 0.00 33.01 30.73 2ouy s GLN 709 CO -0.10 -0.09 0.96 -1.25 -0.55 0.00 0.00 175.29 174.26 2ouy s PRO 710 N -0.22 2.98 0.80 1.67 0.04 -1.26 -5.00 135.00 134.00 2ouy s PRO 710 Ca 0.53 0.19 -0.11 0.00 0.04 0.00 0.00 61.00 61.64 2ouy s PRO 710 Cb -0.33 -2.19 0.08 0.00 0.04 0.00 0.00 34.50 32.10 2ouy s PRO 710 CO 0.36 -0.76 1.12 0.96 0.04 0.00 0.00 177.00 178.73 2ouy s ILE 711 N -3.10 2.80 0.27 0.56 -4.36 -1.26 -4.78 121.20 111.34 2ouy s ILE 711 Ca 0.55 0.29 0.00 0.00 -0.26 0.00 0.00 60.65 61.23 2ouy s ILE 711 Cb -0.11 -2.64 0.27 0.00 1.25 0.00 0.00 42.46 41.23 2ouy s ILE 711 CO 0.48 -0.31 1.69 -0.65 0.24 0.00 0.00 174.94 176.39 2ouy h PRO 712 N -1.12 0.35 -0.46 0.37 0.11 -1.97 -0.42 132.00 128.86 2ouy h PRO 712 Ca -0.44 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.72 2ouy h PRO 712 Cb 1.25 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2ouy h PRO 712 CO 0.48 0.23 0.31 1.98 -0.21 0.00 0.00 178.00 180.80 2ouy h MET 713 N 0.36 0.32 -0.69 1.05 4.05 -1.93 -1.28 114.93 116.81 2ouy h MET 713 Ca 0.51 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.91 2ouy h MET 713 Cb 0.92 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.65 2ouy h MET 713 CO -0.52 0.21 0.00 -1.33 0.23 0.00 0.00 176.91 175.50 2ouy n MET 714 N -4.47 2.72 -3.49 0.39 2.81 -0.19 -4.66 117.12 110.23 2ouy n MET 714 Ca 0.06 -2.51 -0.42 0.00 -1.81 0.00 0.00 57.70 53.02 2ouy n MET 714 Cb 0.29 -1.58 -0.10 0.00 -0.71 0.00 0.00 33.22 31.13 2ouy n MET 714 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2ouy s ASP 715 N -0.98 5.97 0.00 7.83 -1.08 -0.49 -3.46 116.67 124.47 2ouy s ASP 715 Ca 0.46 -1.13 0.11 0.00 -0.52 0.00 0.00 52.55 51.48 2ouy s ASP 715 Cb 0.25 -2.11 0.56 0.00 -1.46 0.00 0.00 42.92 40.15 2ouy s ASP 715 CO 0.30 -0.51 1.28 -2.11 0.52 0.00 0.00 175.17 174.66 2ouy n ARG 716 N 5.10 0.13 -0.07 4.34 1.85 -1.26 -1.21 116.66 125.55 2ouy n ARG 716 Ca -0.11 0.20 0.11 0.00 -1.00 0.00 0.00 57.85 57.05 2ouy n ARG 716 Cb 0.45 -1.50 0.39 0.00 -1.05 0.00 0.00 32.46 30.75 2ouy n ARG 716 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2ouy n ASP 717 N -1.32 1.76 -1.26 2.89 10.43 -1.26 -3.93 116.55 123.85 2ouy n ASP 717 Ca 0.05 -1.68 -0.01 0.00 2.57 0.00 0.00 54.79 55.71 2ouy n ASP 717 Cb 0.10 -0.09 0.12 0.00 1.84 0.00 0.00 41.12 43.09 2ouy n ASP 717 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2ouy n LYS 718 N 0.38 1.72 -0.11 -1.24 5.02 -0.35 -4.83 118.16 118.75 2ouy n LYS 718 Ca 0.17 -3.25 0.22 0.00 -2.02 0.00 0.00 58.31 53.42 2ouy n LYS 718 Cb 0.36 -1.44 0.65 0.00 -0.02 0.00 0.00 35.03 34.57 2ouy n LYS 718 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2ouy h LYS 719 N 1.38 0.12 -0.19 1.97 1.57 -1.71 -1.26 116.57 118.45 2ouy h LYS 719 Ca 0.02 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2ouy h LYS 719 Cb 1.31 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 2ouy h LYS 719 CO 0.20 0.08 0.21 -0.44 -0.57 0.00 0.00 179.45 178.92 2ouy h ASP 720 N 0.12 0.00 0.14 0.86 3.32 -1.93 -1.07 116.42 117.87 2ouy h ASP 720 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2ouy h ASP 720 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2ouy h ASP 720 CO -0.04 0.00 -0.07 -0.62 -1.72 0.00 0.00 179.24 176.78 2ouy n GLU 721 N -3.79 1.11 0.07 3.56 1.02 -0.48 -4.37 120.64 117.77 2ouy n GLU 721 Ca 0.02 -0.49 -0.11 0.00 -0.02 0.00 0.00 57.16 56.55 2ouy n GLU 721 Cb 0.33 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.22 2ouy n GLU 721 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2ouy h VAL 722 N 1.19 0.54 -0.63 2.62 2.07 -1.34 0.60 116.25 121.30 2ouy h VAL 722 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2ouy h VAL 722 Cb 0.37 0.54 -0.09 0.00 -1.52 0.00 0.00 31.29 30.59 2ouy h VAL 722 CO 0.00 0.00 0.13 -0.65 0.02 0.00 0.00 177.57 177.07 2ouy h PRO 723 N -0.33 0.25 -0.28 1.57 0.11 -1.81 0.30 132.00 131.81 2ouy h PRO 723 Ca 0.05 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.03 2ouy h PRO 723 Cb 0.39 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 2ouy h PRO 723 CO -0.17 0.16 -0.32 0.37 -0.21 0.00 0.00 178.00 177.83 2ouy h GLN 724 N 0.25 0.60 -0.61 1.05 5.75 -1.79 -1.71 115.11 118.67 2ouy h GLN 724 Ca 0.34 -0.27 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 2ouy h GLN 724 Cb 0.52 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.03 2ouy h GLN 724 CO -0.43 0.85 0.11 0.78 -2.65 0.00 0.00 178.83 177.49 2ouy h GLY 725 N 1.02 1.05 1.28 2.39 0.00 0.15 -1.25 103.07 107.71 2ouy h GLY 725 Ca 0.06 -0.66 -0.16 0.00 0.00 0.00 0.00 47.33 46.56 2ouy h GLY 725 CO 0.07 0.62 -0.48 1.46 0.00 0.00 0.00 176.54 178.20 2ouy h GLN 726 N 0.92 0.77 -0.55 4.80 1.08 -0.35 -1.66 115.11 120.12 2ouy h GLN 726 Ca 0.19 -0.45 0.04 0.00 -1.45 0.00 0.00 58.65 56.98 2ouy h GLN 726 Cb 0.39 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.81 2ouy h GLN 726 CO 0.01 1.07 0.31 1.25 -0.95 0.00 0.00 178.83 180.52 2ouy h LEU 727 N 0.60 0.47 -0.65 1.46 5.85 -0.97 -0.10 115.31 121.97 2ouy h LEU 727 Ca 0.03 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2ouy h LEU 727 Cb 1.06 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2ouy h LEU 727 CO 0.10 0.32 0.36 1.23 -0.34 0.00 0.00 178.44 180.12 2ouy h GLY 728 N 0.59 0.96 0.99 3.75 0.00 -1.06 -2.03 103.07 106.26 2ouy h GLY 728 Ca 0.23 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2ouy h GLY 728 CO -0.14 0.41 0.29 -2.75 0.00 0.00 0.00 176.54 174.35 2ouy h PHE 729 N 0.88 0.78 -0.30 5.60 3.57 -0.32 0.44 116.94 127.59 2ouy h PHE 729 Ca 0.23 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2ouy h PHE 729 Cb 0.02 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2ouy h PHE 729 CO -0.01 0.58 0.09 1.88 -2.23 0.00 0.00 178.31 178.62 2ouy h TYR 730 N 0.75 0.49 -0.51 0.41 -1.99 -0.87 0.24 116.97 115.49 2ouy h TYR 730 Ca 0.19 -0.05 -0.10 0.00 2.00 0.00 0.00 58.73 60.78 2ouy h TYR 730 Cb 0.08 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.65 2ouy h TYR 730 CO -0.01 0.51 -0.06 -0.91 -0.00 0.00 0.00 178.16 177.69 2ouy h ASN 731 N 0.32 0.93 1.12 3.88 2.35 -1.22 0.25 115.58 123.21 2ouy h ASN 731 Ca 0.10 -0.33 -0.12 0.00 -0.55 0.00 0.00 56.30 55.39 2ouy h ASN 731 Cb 0.25 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2ouy h ASN 731 CO -0.00 1.04 -0.93 0.00 -1.65 0.00 0.00 177.43 175.89 2ouy h ALA 732 N 0.92 0.66 0.00 -0.83 0.00 -0.88 -3.41 119.26 115.72 2ouy h ALA 732 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2ouy h ALA 732 Cb 0.60 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2ouy h ALA 732 CO 0.04 0.67 0.00 0.28 0.00 0.00 0.00 179.25 180.23 2ouy n VAL 733 N -3.02 0.57 0.36 0.00 0.31 0.82 -4.82 118.33 112.55 2ouy n VAL 733 Ca -0.03 0.19 -0.18 0.00 -0.01 0.00 0.00 64.34 64.30 2ouy n VAL 733 Cb 0.75 -1.06 -0.09 0.00 -0.91 0.00 0.00 33.84 32.53 2ouy n VAL 733 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ouy h ALA 734 N 0.00 -1.07 -0.04 3.52 0.00 -1.29 -2.00 119.26 118.38 2ouy h ALA 734 Ca 0.00 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2ouy h ALA 734 Cb 0.00 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2ouy h ALA 734 CO 0.00 -1.12 -0.21 0.82 0.00 0.00 0.00 179.25 178.73 2ouy h ILE 735 N -1.03 0.49 -0.95 0.00 1.08 -0.78 -1.28 117.51 115.04 2ouy h ILE 735 Ca -0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.48 2ouy h ILE 735 Cb 0.84 0.49 -0.07 0.00 -3.07 0.00 0.00 36.82 35.01 2ouy h ILE 735 CO 0.06 0.00 0.61 -0.65 -0.69 0.00 0.00 178.15 177.48 2ouy h PRO 736 N -0.32 0.99 0.78 2.37 0.11 -1.74 -0.28 132.00 133.90 2ouy h PRO 736 Ca 0.07 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 2ouy h PRO 736 Cb 0.42 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.31 2ouy h PRO 736 CO -0.22 0.65 -0.40 0.00 -0.21 0.00 0.00 178.00 177.82 2ouy h TYR 738 N -1.09 0.00 0.04 0.00 -1.99 -1.03 -1.19 116.97 111.72 2ouy h TYR 738 Ca -0.11 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.62 2ouy h TYR 738 Cb 0.84 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.57 2ouy h TYR 738 CO -0.04 0.11 -0.02 1.15 -0.00 0.00 0.00 178.16 179.36 2ouy h THR 739 N 0.00 1.28 -0.58 -2.88 2.02 -0.88 -1.64 112.91 110.23 2ouy h THR 739 Ca -0.00 -1.06 -0.10 0.00 0.77 0.00 0.00 66.41 66.01 2ouy h THR 739 Cb 0.49 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 2ouy h THR 739 CO 0.01 0.27 -0.03 0.74 0.37 0.00 0.00 175.52 176.88 2ouy h THR 740 N -0.53 1.26 -0.53 3.16 2.02 -1.12 -2.41 112.91 114.77 2ouy h THR 740 Ca -0.01 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 65.99 2ouy h THR 740 Cb 0.48 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 2ouy h THR 740 CO 0.01 0.42 0.30 0.25 0.37 0.00 0.00 175.52 176.87 2ouy h LEU 741 N 0.94 0.65 -1.18 2.58 5.85 -1.25 -2.28 115.31 120.62 2ouy h LEU 741 Ca 0.16 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 2ouy h LEU 741 Cb 0.58 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2ouy h LEU 741 CO 0.03 0.53 0.02 0.74 -0.34 0.00 0.00 178.44 179.43 2ouy h THR 742 N 0.70 1.20 -0.59 1.05 2.02 -1.13 0.33 112.91 116.50 2ouy h THR 742 Ca 0.19 -0.80 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 2ouy h THR 742 Cb 0.02 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 2ouy h THR 742 CO -0.03 0.28 0.21 1.56 0.37 0.00 0.00 175.52 177.90 2ouy h GLN 743 N 0.56 0.90 0.16 6.66 4.20 -1.05 -2.07 115.11 124.47 2ouy h GLN 743 Ca 0.12 -0.18 -0.29 0.00 0.06 0.00 0.00 58.65 58.36 2ouy h GLN 743 Cb 0.33 -0.14 0.03 0.00 0.30 0.00 0.00 27.48 28.00 2ouy h GLN 743 CO 0.01 0.79 -1.24 0.82 -0.67 0.00 0.00 178.83 178.54 2ouy h ILE 744 N 0.83 1.31 -3.01 2.54 2.04 -1.08 -3.40 117.51 116.74 2ouy h ILE 744 Ca 0.19 -2.52 -0.62 0.00 1.00 0.00 0.00 64.86 62.92 2ouy h ILE 744 Cb 0.25 2.86 -0.41 0.00 -0.74 0.00 0.00 36.82 38.78 2ouy h ILE 744 CO -0.01 0.76 -0.68 -0.76 0.00 0.00 0.00 178.15 177.46 2ouy s LEU 745 N -7.82 3.79 0.39 1.44 1.43 0.11 -5.00 118.68 113.02 2ouy s LEU 745 Ca -0.10 -3.34 0.19 0.00 -1.03 0.00 0.00 54.13 49.85 2ouy s LEU 745 Cb 0.04 -1.34 1.14 0.00 0.03 0.00 0.00 46.19 46.07 2ouy s LEU 745 CO 0.92 -0.16 1.72 -0.65 0.23 0.00 0.00 176.35 178.41 2ouy h PRO 746 N 5.90 0.33 0.00 1.29 0.11 -1.59 -0.81 132.00 137.23 2ouy h PRO 746 Ca 0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2ouy h PRO 746 Cb 0.84 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2ouy h PRO 746 CO 0.61 0.22 0.00 -1.35 -0.21 0.00 0.00 178.00 177.27 2ouy h PRO 747 N 0.34 0.00 -0.08 1.05 0.11 -1.86 -1.69 132.00 129.88 2ouy h PRO 747 Ca 0.67 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.78 2ouy h PRO 747 Cb 1.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.84 2ouy h PRO 747 CO -0.40 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.64 2ouy n THR 748 N -2.62 0.10 -0.33 -1.15 -2.24 -0.31 -4.37 114.28 103.36 2ouy n THR 748 Ca -0.02 -0.15 0.20 0.00 -2.27 0.00 0.00 64.05 61.81 2ouy n THR 748 Cb 0.06 0.00 0.39 0.00 -2.10 0.00 0.00 70.33 68.68 2ouy n THR 748 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2ouy h GLU 749 N 0.91 0.02 -0.77 -0.78 4.57 -1.49 -0.58 114.58 116.47 2ouy h GLU 749 Ca 0.00 -0.00 0.17 0.00 -1.18 0.00 0.00 59.36 58.35 2ouy h GLU 749 Cb 0.20 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.74 2ouy h GLU 749 CO 0.00 0.01 0.52 -1.35 -1.18 0.00 0.00 179.01 177.01 2ouy h PRO 750 N 0.02 0.32 -0.61 0.92 0.11 -1.87 -1.40 132.00 129.48 2ouy h PRO 750 Ca 0.68 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.72 2ouy h PRO 750 Cb 1.55 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.56 2ouy h PRO 750 CO -0.86 0.21 0.18 -0.07 -0.21 0.00 0.00 178.00 177.25 2ouy h LEU 751 N 0.33 0.90 -0.43 2.35 3.38 -1.45 -1.29 115.31 119.10 2ouy h LEU 751 Ca 0.38 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 2ouy h LEU 751 Cb 1.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2ouy h LEU 751 CO -0.11 0.87 -0.04 0.25 0.09 0.00 0.00 178.44 179.51 2ouy h LEU 752 N 0.88 0.77 -0.73 1.67 5.85 -1.38 -0.99 115.31 121.38 2ouy h LEU 752 Ca 0.20 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 2ouy h LEU 752 Cb 0.30 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 2ouy h LEU 752 CO -0.00 0.92 0.46 0.50 -0.34 0.00 0.00 178.44 179.97 2ouy h LYS 753 N 0.62 0.99 -0.39 1.25 3.64 -1.20 -0.75 116.57 120.73 2ouy h LYS 753 Ca 0.12 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 2ouy h LYS 753 Cb 0.54 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 2ouy h LYS 753 CO 0.03 0.69 -0.06 0.00 -2.27 0.00 0.00 179.45 177.84 2ouy h ALA 754 N 1.24 0.53 -0.71 5.00 0.00 -1.12 -1.61 119.26 122.59 2ouy h ALA 754 Ca 0.27 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ouy h ALA 754 Cb -0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2ouy h ALA 754 CO -0.05 0.36 0.46 0.00 0.00 0.00 0.00 179.25 180.02 2ouy h ARG 756 N 0.96 1.10 -0.57 0.00 3.08 -0.98 -1.15 114.38 116.82 2ouy h ARG 756 Ca 0.26 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2ouy h ARG 756 Cb -0.10 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.74 2ouy h ARG 756 CO -0.05 0.88 0.15 -0.44 -1.07 0.00 0.00 179.97 179.44 2ouy h ASP 757 N 1.06 0.81 0.59 7.04 3.32 -0.72 -2.08 116.42 126.44 2ouy h ASP 757 Ca 0.25 -0.14 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 2ouy h ASP 757 Cb 0.18 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2ouy h ASP 757 CO -0.02 0.78 -0.64 0.78 -1.72 0.00 0.00 179.24 178.41 2ouy h ASN 758 N 0.84 0.06 -0.29 6.45 2.35 -0.80 -2.20 115.58 121.99 2ouy h ASN 758 Ca 0.19 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2ouy h ASN 758 Cb 0.29 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2ouy h ASN 758 CO -0.00 0.68 0.19 0.25 -1.65 0.00 0.00 177.43 176.90 2ouy h LEU 759 N 0.03 0.33 -1.38 1.61 5.85 -0.82 -1.28 115.31 119.66 2ouy h LEU 759 Ca -0.01 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2ouy h LEU 759 Cb 1.14 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2ouy h LEU 759 CO 0.09 0.24 0.47 -1.28 -0.34 0.00 0.00 178.44 177.62 2ouy h SER 760 N 0.39 0.66 -0.30 1.25 0.87 -1.12 -1.52 113.55 113.78 2ouy h SER 760 Ca 0.11 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.53 2ouy h SER 760 Cb -0.04 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2ouy h SER 760 CO -0.02 0.43 -0.31 1.56 -0.53 0.00 0.00 176.83 177.96 2ouy h GLN 761 N 0.75 0.82 -0.17 2.24 1.08 -0.73 -1.69 115.11 117.41 2ouy h GLN 761 Ca 0.31 -0.38 -0.10 0.00 -1.45 0.00 0.00 58.65 57.03 2ouy h GLN 761 Cb 0.24 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 2ouy h GLN 761 CO -0.10 1.02 -0.32 -1.49 -0.95 0.00 0.00 178.83 176.98 2ouy h TRP 762 N 0.70 0.39 -0.14 2.96 4.06 -0.31 -0.50 115.95 123.10 2ouy h TRP 762 Ca 0.08 -0.09 -0.14 0.00 2.06 0.00 0.00 58.89 60.80 2ouy h TRP 762 Cb 0.85 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.91 2ouy h TRP 762 CO 0.05 0.63 -0.50 0.93 -3.56 0.00 0.00 178.44 175.99 2ouy h GLU 763 N 0.30 0.36 -0.56 0.49 5.08 -1.15 -1.39 114.58 117.71 2ouy h GLU 763 Ca 0.04 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.08 2ouy h GLU 763 Cb 0.72 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2ouy h GLU 763 CO 0.05 0.78 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.56 2ouy h LYS 764 N 0.29 1.04 -0.36 2.33 3.64 -0.84 -0.98 116.57 121.69 2ouy h LYS 764 Ca 0.01 -0.37 -0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2ouy h LYS 764 Cb 0.98 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 2ouy h LYS 764 CO 0.08 1.06 0.21 0.28 -2.27 0.00 0.00 179.45 178.81 2ouy h VAL 765 N 0.92 1.12 -0.13 2.00 2.07 -0.77 -1.52 116.25 119.94 2ouy h VAL 765 Ca 0.15 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2ouy h VAL 765 Cb 0.63 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2ouy h VAL 765 CO 0.04 0.12 -0.05 0.40 0.02 0.00 0.00 177.57 178.11 2ouy h ILE 766 N 0.46 1.12 0.00 4.57 2.04 -0.97 -1.26 117.51 123.47 2ouy h ILE 766 Ca 0.13 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2ouy h ILE 766 Cb 0.02 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 2ouy h ILE 766 CO -0.02 0.16 0.00 0.54 0.00 0.00 0.00 178.15 178.82 2ouy n ARG 767 N -4.37 0.11 -1.30 2.37 1.74 -0.40 -4.89 116.66 109.92 2ouy n ARG 767 Ca -0.01 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 2ouy n ARG 767 Cb 0.19 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 2ouy n ARG 767 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ouy n GLY 768 N 0.92 1.01 1.60 -0.13 0.00 -0.48 -5.00 105.19 103.12 2ouy n GLY 768 Ca 0.08 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.63 2ouy n GLY 768 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ouy n GLU 769 N -0.50 2.07 -1.23 1.61 1.02 -0.62 -5.04 120.64 117.95 2ouy n GLU 769 Ca 0.00 -3.44 -0.30 0.00 -0.02 0.00 0.00 57.16 53.40 2ouy n GLU 769 Cb 0.28 -1.60 0.22 0.00 -0.02 0.00 0.00 31.44 30.32 2ouy n GLU 769 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2ouy s GLU 770 N -2.95 -0.60 0.00 3.49 2.12 -1.26 -4.71 118.70 114.79 2ouy s GLU 770 Ca 0.40 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.73 2ouy s GLU 770 Cb 0.38 -1.66 0.00 0.00 0.26 0.00 0.00 34.13 33.11 2ouy s GLU 770 CO -0.04 -3.31 0.00 2.41 -0.54 0.00 0.00 175.26 173.78 2ouy n THR 771 N -4.49 0.00 0.00 -1.70 -1.04 -1.26 -5.08 114.28 100.71 2ouy n THR 771 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 2ouy n THR 771 Cb 0.59 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 2ouy n THR 771 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ouy n ALA 772 N -3.00 -0.52 -3.76 2.41 0.00 -1.26 -4.90 120.51 109.49 2ouy n ALA 772 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2ouy n ALA 772 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2ouy n ALA 772 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2ouy s THR 773 N 0.00 3.50 -0.12 0.00 2.01 -1.26 -5.05 115.64 114.73 2ouy s THR 773 Ca 0.00 -2.88 0.01 0.00 0.31 0.00 0.00 61.69 59.13 2ouy s THR 773 Cb 0.00 -3.31 0.02 0.00 0.01 0.00 0.00 72.50 69.22 2ouy s THR 773 CO 0.00 -0.84 -0.13 0.26 -0.69 0.00 0.00 174.62 173.23 2ouy s TRP 774 N 0.08 1.83 -0.03 4.92 0.51 -1.26 -5.12 118.94 119.88 2ouy s TRP 774 Ca 0.16 -0.91 -0.00 0.00 -2.12 0.00 0.00 56.10 53.22 2ouy s TRP 774 Cb -0.21 -1.38 0.03 0.00 -0.81 0.00 0.00 33.47 31.10 2ouy s TRP 774 CO -0.03 -0.52 0.03 0.42 -0.51 0.00 0.00 176.95 176.34 2ouy s ILE 775 N 1.28 -0.02 -2.00 2.03 1.01 -1.26 -5.01 121.20 117.22 2ouy s ILE 775 Ca -0.01 0.24 0.29 0.00 0.00 0.00 0.00 60.65 61.17 2ouy s ILE 775 Cb -0.14 -0.14 0.81 0.00 0.01 0.00 0.00 42.46 43.01 2ouy s ILE 775 CO -0.05 0.12 2.05 -1.54 0.00 0.00 0.00 174.94 175.52