#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oak s TYR 508 N 0.00 1.21 -0.30 2.03 6.14 -1.26 -4.84 117.35 120.32 1oak s TYR 508 Ca 0.00 -0.52 -0.04 0.00 0.64 0.00 0.00 57.07 57.15 1oak s TYR 508 Cb 0.00 -0.66 0.04 0.00 0.42 0.00 0.00 41.96 41.75 1oak s TYR 508 CO 0.00 0.06 0.04 0.00 0.64 0.00 0.00 175.55 176.29 1oak s SER 510 N 1.35 5.20 0.35 0.00 0.15 -1.26 -0.54 113.70 118.95 1oak s SER 510 Ca -0.02 -3.78 -0.01 0.00 0.70 0.00 0.00 55.95 52.84 1oak s SER 510 Cb -0.19 -1.73 -0.00 0.00 -1.71 0.00 0.00 66.02 62.39 1oak s SER 510 CO 0.00 -0.12 0.46 -0.13 1.20 0.00 0.00 173.24 174.65 1oak s ARG 511 N -1.38 1.92 -0.47 5.44 0.52 -1.26 -4.69 118.95 119.04 1oak s ARG 511 Ca 0.25 -1.82 -0.23 0.00 -0.52 0.00 0.00 55.73 53.42 1oak s ARG 511 Cb -0.06 0.43 0.03 0.00 0.52 0.00 0.00 34.95 35.87 1oak s ARG 511 CO -0.15 -0.79 0.79 -0.51 0.02 0.00 0.00 175.30 174.67 1oak s LEU 512 N -3.27 4.29 -0.05 2.53 1.43 -0.80 -3.00 118.68 119.80 1oak s LEU 512 Ca 0.32 -0.21 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 1oak s LEU 512 Cb -0.00 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 43.35 1oak s LEU 512 CO 0.22 -0.96 0.40 -0.22 0.23 0.00 0.00 176.35 176.02 1oak s LEU 513 N 3.34 0.49 -0.36 1.79 2.96 -0.82 -2.76 118.68 123.32 1oak s LEU 513 Ca 0.29 0.37 0.04 0.00 -0.22 0.00 0.00 54.13 54.60 1oak s LEU 513 Cb -0.13 1.53 0.10 0.00 0.50 0.00 0.00 46.19 48.19 1oak s LEU 513 CO 0.21 -0.41 0.08 -1.81 -1.32 0.00 0.00 176.35 173.11 1oak s ASP 514 N -0.95 4.64 -0.24 3.68 1.11 -0.65 -0.43 116.67 123.82 1oak s ASP 514 Ca -0.10 -2.23 -0.10 0.00 0.18 0.00 0.00 52.55 50.30 1oak s ASP 514 Cb -0.04 -1.56 -0.04 0.00 1.07 0.00 0.00 42.92 42.35 1oak s ASP 514 CO 0.04 -0.36 0.13 -0.22 1.18 0.00 0.00 175.17 175.95 1oak s LEU 515 N 0.80 3.93 -0.34 1.23 2.96 0.21 -1.94 118.68 125.53 1oak s LEU 515 Ca 0.12 0.03 -0.08 0.00 -0.22 0.00 0.00 54.13 53.98 1oak s LEU 515 Cb -0.20 -2.05 0.03 0.00 0.50 0.00 0.00 46.19 44.47 1oak s LEU 515 CO -0.08 0.04 0.12 -0.69 -1.32 0.00 0.00 176.35 174.42 1oak s VAL 516 N 1.18 4.04 -0.24 1.68 1.01 -0.61 -1.51 120.40 125.95 1oak s VAL 516 Ca 0.06 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 60.87 1oak s VAL 516 Cb -0.14 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 1oak s VAL 516 CO 0.05 -0.12 0.80 -0.36 0.00 0.00 0.00 175.10 175.47 1oak s PHE 517 N 1.47 3.31 -0.32 5.22 0.08 0.60 -1.13 117.98 127.21 1oak s PHE 517 Ca 0.00 1.09 -0.02 0.00 0.12 0.00 0.00 56.93 58.12 1oak s PHE 517 Cb -0.19 -3.02 0.06 0.00 -0.57 0.00 0.00 43.02 39.30 1oak s PHE 517 CO 0.04 -0.39 0.04 -0.51 -0.10 0.00 0.00 175.22 174.30 1oak s LEU 518 N 2.80 4.19 -0.24 -0.37 1.43 -0.50 -0.92 118.68 125.06 1oak s LEU 518 Ca 0.34 -1.42 -0.13 0.00 -1.03 0.00 0.00 54.13 51.89 1oak s LEU 518 Cb -0.15 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1oak s LEU 518 CO 0.07 -0.32 0.27 -0.76 0.23 0.00 0.00 176.35 175.84 1oak s LEU 519 N 1.23 4.11 0.00 1.79 1.43 0.84 -1.23 118.68 126.85 1oak s LEU 519 Ca -0.02 0.25 -0.32 0.00 -1.03 0.00 0.00 54.13 53.01 1oak s LEU 519 Cb -0.20 -2.28 -0.10 0.00 0.03 0.00 0.00 46.19 43.64 1oak s LEU 519 CO -0.02 -0.03 1.93 -0.67 0.23 0.00 0.00 176.35 177.80 1oak n ASP 520 N 4.57 3.89 -2.31 2.29 -0.08 -0.81 -0.18 116.55 123.92 1oak n ASP 520 Ca -0.12 0.94 -0.31 0.00 -1.51 0.00 0.00 54.79 53.79 1oak n ASP 520 Cb 0.52 -1.47 0.05 0.00 2.34 0.00 0.00 41.12 42.55 1oak n ASP 520 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1oak n GLY 521 N 4.46 6.03 3.76 0.27 0.00 0.72 -4.81 105.19 115.63 1oak n GLY 521 Ca 0.21 -2.51 -0.23 0.00 0.00 0.00 0.00 46.02 43.49 1oak n GLY 521 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oak s SER 522 N -2.54 5.21 0.00 1.61 1.04 -1.21 -2.35 113.70 115.47 1oak s SER 522 Ca 0.57 -0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.68 1oak s SER 522 Cb 0.45 -1.23 0.16 0.00 0.10 0.00 0.00 66.02 65.50 1oak s SER 522 CO -0.06 -0.01 0.95 -1.54 0.98 0.00 0.00 173.24 173.56 1oak n SER 523 N -0.94 0.00 0.30 7.02 3.41 0.13 -1.57 113.62 121.98 1oak n SER 523 Ca -0.08 0.28 0.20 0.00 -0.26 0.00 0.00 58.87 59.02 1oak n SER 523 Cb 0.58 -0.32 0.98 0.00 -0.26 0.00 0.00 64.21 65.18 1oak n SER 523 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1oak h ARG 524 N 0.00 0.00 -5.09 4.33 2.47 -1.91 -3.37 114.38 110.81 1oak h ARG 524 Ca 0.00 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 58.06 1oak h ARG 524 Cb 0.03 0.00 -0.29 0.00 -1.65 0.00 0.00 29.97 28.06 1oak h ARG 524 CO 0.00 0.00 -0.76 -0.51 0.56 0.00 0.00 179.97 179.26 1oak s LEU 525 N -6.00 2.68 1.06 3.04 1.43 -0.61 -5.01 118.68 115.28 1oak s LEU 525 Ca -0.02 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 1oak s LEU 525 Cb 0.11 -1.65 0.23 0.00 0.03 0.00 0.00 46.19 44.91 1oak s LEU 525 CO 0.44 0.03 1.06 -0.94 0.23 0.00 0.00 176.35 177.17 1oak s SER 526 N 1.17 1.92 0.23 2.29 1.04 -1.26 -4.66 113.70 114.44 1oak s SER 526 Ca 0.02 1.43 -0.07 0.00 0.48 0.00 0.00 55.95 57.80 1oak s SER 526 Cb -0.14 -2.14 0.23 0.00 0.10 0.00 0.00 66.02 64.08 1oak s SER 526 CO -0.03 -3.60 1.90 -0.08 0.98 0.00 0.00 173.24 172.41 1oak h GLU 527 N -2.21 1.17 -0.41 4.02 4.81 -1.96 0.35 114.58 120.34 1oak h GLU 527 Ca -0.57 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 58.46 1oak h GLU 527 Cb 1.32 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1oak h GLU 527 CO 0.53 0.77 -0.26 0.00 -0.73 0.00 0.00 179.01 179.32 1oak h ALA 528 N 1.34 0.76 -0.25 2.92 0.00 -2.00 -2.64 119.26 119.39 1oak h ALA 528 Ca 0.34 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1oak h ALA 528 Cb -0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1oak h ALA 528 CO -0.08 0.66 -0.27 0.93 0.00 0.00 0.00 179.25 180.48 1oak h GLU 529 N 0.73 0.50 0.00 0.00 5.08 -1.73 -2.16 114.58 117.00 1oak h GLU 529 Ca 0.09 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1oak h GLU 529 Cb 0.81 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1oak h GLU 529 CO 0.07 0.73 -0.17 0.35 -1.00 0.00 0.00 179.01 178.98 1oak h PHE 530 N 0.43 0.00 -0.02 4.33 3.57 -0.83 -1.45 116.94 122.98 1oak h PHE 530 Ca 0.06 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.35 1oak h PHE 530 Cb 0.70 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 1oak h PHE 530 CO 0.02 0.17 -0.87 0.93 -2.23 0.00 0.00 178.31 176.33 1oak h GLU 531 N 0.00 0.36 -0.51 1.11 4.39 -1.03 -0.97 114.58 117.92 1oak h GLU 531 Ca -0.00 -0.36 -0.12 0.00 0.34 0.00 0.00 59.36 59.22 1oak h GLU 531 Cb 0.66 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 1oak h GLU 531 CO 0.02 1.04 -0.15 0.28 -1.16 0.00 0.00 179.01 179.03 1oak h VAL 532 N 0.21 1.27 0.53 3.13 2.07 -1.03 -0.68 116.25 121.75 1oak h VAL 532 Ca -0.06 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.12 1oak h VAL 532 Cb 1.49 1.03 0.01 0.00 -1.52 0.00 0.00 31.29 32.30 1oak h VAL 532 CO 0.15 0.46 -0.25 0.25 0.02 0.00 0.00 177.57 178.19 1oak h LEU 533 N 0.88 -0.60 -1.62 2.57 5.85 -1.20 -1.36 115.31 119.83 1oak h LEU 533 Ca 0.13 -0.03 0.19 0.00 0.84 0.00 0.00 57.88 59.00 1oak h LEU 533 Cb 0.72 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 1oak h LEU 533 CO 0.06 -0.33 0.55 0.11 -0.34 0.00 0.00 178.44 178.49 1oak h LYS 534 N -0.85 0.33 -0.03 1.25 1.57 -1.09 -0.65 116.57 117.11 1oak h LYS 534 Ca -0.07 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1oak h LYS 534 Cb 0.60 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1oak h LYS 534 CO 0.12 0.22 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 1oak h ALA 535 N 1.63 0.04 -0.70 3.86 0.00 -0.74 -1.46 119.26 121.88 1oak h ALA 535 Ca 0.41 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.27 1oak h ALA 535 Cb 1.10 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1oak h ALA 535 CO -0.13 -0.32 0.35 0.35 0.00 0.00 0.00 179.25 179.51 1oak h PHE 536 N -0.22 0.63 -0.92 0.00 3.57 -0.03 0.34 116.94 120.31 1oak h PHE 536 Ca 0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1oak h PHE 536 Cb 0.28 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1oak h PHE 536 CO 0.02 0.24 0.58 0.28 -2.23 0.00 0.00 178.31 177.20 1oak h VAL 537 N 0.60 1.24 -0.00 1.41 2.07 -1.02 0.06 116.25 120.61 1oak h VAL 537 Ca 0.34 -0.49 -0.18 0.00 0.82 0.00 0.00 66.70 67.19 1oak h VAL 537 Cb 0.34 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1oak h VAL 537 CO -0.26 0.25 -0.83 0.58 0.02 0.00 0.00 177.57 177.33 1oak h VAL 538 N 1.26 1.52 -0.16 2.57 2.07 -0.02 -1.44 116.25 122.05 1oak h VAL 538 Ca 0.33 -2.62 -0.08 0.00 0.82 0.00 0.00 66.70 65.16 1oak h VAL 538 Cb -0.10 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1oak h VAL 538 CO -0.07 0.76 -0.24 0.44 0.02 0.00 0.00 177.57 178.48 1oak h ASP 539 N 0.07 0.28 0.21 0.57 3.32 0.15 -1.57 116.42 119.45 1oak h ASP 539 Ca -0.03 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1oak h ASP 539 Cb 1.44 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1oak h ASP 539 CO 0.12 0.53 -0.10 -0.03 -1.72 0.00 0.00 179.24 178.04 1oak h MET 540 N 0.26 -0.27 -0.29 3.56 4.05 -0.72 -2.80 114.93 118.72 1oak h MET 540 Ca 0.04 0.02 0.09 0.00 -0.28 0.00 0.00 59.70 59.57 1oak h MET 540 Cb 0.57 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.42 1oak h MET 540 CO 0.04 0.09 0.27 0.52 0.23 0.00 0.00 176.91 178.05 1oak h MET 541 N -0.67 0.00 0.00 0.39 2.86 -1.02 0.48 114.93 116.97 1oak h MET 541 Ca -0.03 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1oak h MET 541 Cb 0.48 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1oak h MET 541 CO 0.05 0.00 -0.34 0.93 1.06 0.00 0.00 176.91 178.60 1oak h GLU 542 N 0.00 0.00 -0.51 1.72 5.08 -1.10 -2.89 114.58 116.88 1oak h GLU 542 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1oak h GLU 542 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1oak h GLU 542 CO -0.00 0.34 0.00 0.54 -1.00 0.00 0.00 179.01 178.89 1oak n ARG 543 N -3.46 4.50 -4.38 2.33 1.74 0.16 -4.92 116.66 112.64 1oak n ARG 543 Ca 0.00 -3.10 -0.23 0.00 -0.77 0.00 0.00 57.85 53.74 1oak n ARG 543 Cb 0.51 -2.18 -0.13 0.00 -1.02 0.00 0.00 32.46 29.64 1oak n ARG 543 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1oak s LEU 544 N -2.77 2.24 -1.27 0.55 1.43 -0.98 -1.39 118.68 116.48 1oak s LEU 544 Ca 0.52 -0.60 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 1oak s LEU 544 Cb 0.40 -0.83 0.15 0.00 0.03 0.00 0.00 46.19 45.94 1oak s LEU 544 CO 0.15 0.07 1.74 -1.14 0.23 0.00 0.00 176.35 177.39 1oak n ARG 545 N 1.42 3.42 -1.59 1.70 0.63 0.30 -4.87 116.66 117.67 1oak n ARG 545 Ca -0.19 -3.54 -0.44 0.00 -0.92 0.00 0.00 57.85 52.76 1oak n ARG 545 Cb 0.54 -3.05 -0.04 0.00 0.45 0.00 0.00 32.46 30.36 1oak n ARG 545 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1oak n ILE 546 N 4.23 0.38 -3.57 5.15 5.41 -1.25 -1.80 119.36 127.92 1oak n ILE 546 Ca 0.41 -0.38 -0.09 0.00 1.00 0.00 0.00 62.75 63.68 1oak n ILE 546 Cb 0.40 -2.38 -0.04 0.00 -0.71 0.00 0.00 39.64 36.90 1oak n ILE 546 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1oak s SER 547 N 7.55 -0.34 0.09 4.38 0.15 -0.30 -4.78 113.70 120.45 1oak s SER 547 Ca 1.00 0.28 0.15 0.00 0.70 0.00 0.00 55.95 58.09 1oak s SER 547 Cb -0.43 0.30 0.66 0.00 -1.71 0.00 0.00 66.02 64.83 1oak s SER 547 CO 0.39 -0.38 1.47 0.00 1.20 0.00 0.00 173.24 175.91 1oak n GLN 548 N 0.48 0.06 0.00 5.44 1.13 -1.26 -1.71 117.38 121.52 1oak n GLN 548 Ca -0.09 0.37 0.07 0.00 -1.94 0.00 0.00 57.00 55.42 1oak n GLN 548 Cb 0.59 -1.64 -0.03 0.00 0.11 0.00 0.00 30.24 29.27 1oak n GLN 548 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1oak n LYS 549 N -1.76 1.84 0.00 -1.09 4.01 -1.26 -4.94 118.16 114.96 1oak n LYS 549 Ca 0.02 -0.55 0.00 0.00 -0.51 0.00 0.00 58.31 57.27 1oak n LYS 549 Cb 0.14 -1.24 0.00 0.00 -0.51 0.00 0.00 35.03 33.43 1oak n LYS 549 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 1oak n TRP 550 N -0.50 0.00 -3.33 2.13 7.02 -0.69 -4.80 117.44 117.27 1oak n TRP 550 Ca 0.05 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.12 1oak n TRP 550 Cb 0.30 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.10 1oak n TRP 550 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1oak s VAL 551 N 1.68 5.10 0.14 -0.99 1.01 -0.75 -1.94 120.40 124.65 1oak s VAL 551 Ca 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 61.96 1oak s VAL 551 Cb 0.00 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1oak s VAL 551 CO 0.00 -0.22 0.40 -0.13 0.00 0.00 0.00 175.10 175.15 1oak s ARG 552 N 2.17 3.66 0.05 2.72 0.52 0.43 -1.15 118.95 127.35 1oak s ARG 552 Ca 0.14 -0.00 0.03 0.00 -0.52 0.00 0.00 55.73 55.38 1oak s ARG 552 Cb -0.16 -2.86 -0.03 0.00 0.52 0.00 0.00 34.95 32.43 1oak s ARG 552 CO 0.13 0.47 -0.10 0.14 0.02 0.00 0.00 175.30 175.95 1oak s VAL 553 N -1.62 0.78 0.01 3.52 -7.23 -1.26 -0.62 120.40 113.97 1oak s VAL 553 Ca 0.40 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.43 1oak s VAL 553 Cb -0.12 -0.79 -0.01 0.00 0.56 0.00 0.00 36.38 36.02 1oak s VAL 553 CO 0.23 -0.30 -0.04 0.00 -0.31 0.00 0.00 175.10 174.68 1oak s ALA 554 N -1.29 0.29 -0.07 1.32 0.00 -0.57 -3.56 121.76 117.88 1oak s ALA 554 Ca -0.06 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1oak s ALA 554 Cb -0.10 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.01 1oak s ALA 554 CO 0.01 0.03 -0.13 0.08 0.00 0.00 0.00 175.76 175.75 1oak s VAL 555 N -0.41 1.21 -0.01 0.00 1.01 -0.23 -0.29 120.40 121.69 1oak s VAL 555 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1oak s VAL 555 Cb -0.03 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 35.26 1oak s VAL 555 CO -0.00 0.37 0.01 -0.69 0.00 0.00 0.00 175.10 174.79 1oak s VAL 556 N 0.61 0.04 -0.13 2.92 1.01 -0.10 -0.53 120.40 124.22 1oak s VAL 556 Ca -0.14 0.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 1oak s VAL 556 Cb -0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.09 1oak s VAL 556 CO 0.04 0.06 0.01 -0.70 0.00 0.00 0.00 175.10 174.51 1oak s GLU 557 N 0.52 3.42 -0.07 2.72 -6.30 -0.43 -0.11 118.70 118.44 1oak s GLU 557 Ca -0.04 -0.41 0.04 0.00 -2.50 0.00 0.00 54.97 52.05 1oak s GLU 557 Cb -0.07 -2.94 0.00 0.00 0.00 0.00 0.00 34.13 31.13 1oak s GLU 557 CO -0.01 0.48 -0.18 1.52 0.02 0.00 0.00 175.26 177.09 1oak s TYR 558 N -0.26 1.92 0.00 5.30 1.13 0.74 -0.41 117.35 125.77 1oak s TYR 558 Ca 0.06 -0.69 0.00 0.00 -1.41 0.00 0.00 57.07 55.03 1oak s TYR 558 Cb -0.12 -1.32 0.00 0.00 -1.10 0.00 0.00 41.96 39.42 1oak s TYR 558 CO 0.02 -0.28 0.00 -2.39 -2.51 0.00 0.00 175.55 170.39 1oak n HIS 559 N 3.48 0.00 0.09 -3.49 1.44 -1.26 -0.20 115.22 115.28 1oak n HIS 559 Ca -0.20 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.47 1oak n HIS 559 Cb 0.52 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.58 1oak n HIS 559 CO 0.00 0.00 0.00 -0.44 -2.81 0.00 0.00 176.34 173.09 1oak h ASP 560 N 0.00 0.00 -2.87 4.39 3.32 -1.91 0.27 116.42 119.62 1oak h ASP 560 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 1oak h ASP 560 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1oak h ASP 560 CO 0.00 0.82 -0.06 0.61 -1.72 0.00 0.00 179.24 178.89 1oak n GLY 561 N 1.22 4.01 3.31 2.75 0.00 -1.26 -4.82 105.19 110.40 1oak n GLY 561 Ca 0.00 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 1oak n GLY 561 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oak s SER 562 N -1.34 3.19 -0.40 1.61 0.01 -1.26 -4.43 113.70 111.08 1oak s SER 562 Ca 0.02 -0.45 -0.04 0.00 1.31 0.00 0.00 55.95 56.79 1oak s SER 562 Cb 0.00 -0.63 0.10 0.00 0.21 0.00 0.00 66.02 65.69 1oak s SER 562 CO 0.02 0.29 0.19 -1.00 0.41 0.00 0.00 173.24 173.15 1oak s HIS 563 N -0.41 3.49 -0.60 2.43 3.76 0.45 -4.96 115.29 119.44 1oak s HIS 563 Ca 0.04 -2.14 -0.25 0.00 -0.15 0.00 0.00 55.06 52.55 1oak s HIS 563 Cb -0.12 -3.02 0.04 0.00 1.11 0.00 0.00 32.58 30.59 1oak s HIS 563 CO 0.01 -0.93 1.06 0.00 -0.85 0.00 0.00 174.74 174.03 1oak s ALA 564 N 1.22 3.05 -0.04 -1.40 0.00 -1.26 -1.32 121.76 122.01 1oak s ALA 564 Ca 0.05 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1oak s ALA 564 Cb -0.23 -3.91 -0.26 0.00 0.00 0.00 0.00 23.12 18.73 1oak s ALA 564 CO -0.02 -2.65 0.69 1.88 0.00 0.00 0.00 175.76 175.65 1oak h TYR 565 N 9.52 0.33 -3.79 0.00 0.05 -1.20 -3.47 116.97 118.41 1oak h TYR 565 Ca -0.27 -0.24 -0.41 0.00 0.05 0.00 0.00 58.73 57.87 1oak h TYR 565 Cb 1.07 -0.01 -0.31 0.00 1.01 0.00 0.00 36.73 38.48 1oak h TYR 565 CO 0.98 1.38 -0.78 0.42 -1.05 0.00 0.00 178.16 179.11 1oak s ILE 566 N -2.60 0.68 0.05 -2.88 1.01 -0.70 -4.89 121.20 111.88 1oak s ILE 566 Ca -0.11 -0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1oak s ILE 566 Cb 0.07 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.89 1oak s ILE 566 CO 0.82 0.22 -0.09 -0.83 0.00 0.00 0.00 174.94 175.06 1oak s GLY 567 N 0.22 1.75 0.58 6.18 0.00 -1.26 -1.07 107.32 113.73 1oak s GLY 567 Ca -0.03 -1.13 0.28 0.00 0.00 0.00 0.00 44.72 43.84 1oak s GLY 567 CO 0.00 -1.04 2.03 1.41 0.00 0.00 0.00 173.10 175.50 1oak h LEU 568 N 4.14 0.00 -0.47 0.66 3.38 -1.95 0.27 115.31 121.34 1oak h LEU 568 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1oak h LEU 568 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1oak h LEU 568 CO 0.53 0.00 -0.35 0.29 0.09 0.00 0.00 178.44 179.00 1oak n LYS 569 N -3.84 0.73 -1.64 1.13 5.02 -1.26 -4.65 118.16 113.66 1oak n LYS 569 Ca 0.04 -0.47 -0.44 0.00 -2.02 0.00 0.00 58.31 55.42 1oak n LYS 569 Cb 0.45 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.93 1oak n LYS 569 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1oak n ASP 570 N -0.72 3.70 -4.38 4.39 8.00 0.94 -4.90 116.55 123.59 1oak n ASP 570 Ca 0.11 0.75 -0.46 0.00 0.71 0.00 0.00 54.79 55.90 1oak n ASP 570 Cb 0.36 -1.48 -0.01 0.00 -0.02 0.00 0.00 41.12 39.96 1oak n ASP 570 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1oak s ARG 571 N 4.87 3.79 0.03 -1.24 0.52 -1.26 -4.94 118.95 120.72 1oak s ARG 571 Ca 0.94 -2.48 0.01 0.00 -0.52 0.00 0.00 55.73 53.68 1oak s ARG 571 Cb -0.50 -4.64 -0.02 0.00 0.52 0.00 0.00 34.95 30.31 1oak s ARG 571 CO 0.43 -1.44 -0.06 0.15 0.02 0.00 0.00 175.30 174.40 1oak s LYS 572 N 0.60 0.45 0.41 3.54 1.02 -1.26 -5.13 119.74 119.36 1oak s LYS 572 Ca 0.27 -0.70 -0.27 0.00 0.02 0.00 0.00 55.97 55.29 1oak s LYS 572 Cb -0.08 -0.14 -0.10 0.00 -0.52 0.00 0.00 37.83 36.99 1oak s LYS 572 CO -0.08 0.01 1.45 1.03 -0.92 0.00 0.00 175.35 176.85 1oak s ARG 573 N -1.53 3.93 0.26 1.68 0.52 -1.26 -4.71 118.95 117.85 1oak s ARG 573 Ca -0.12 2.49 -0.04 0.00 -0.52 0.00 0.00 55.73 57.54 1oak s ARG 573 Cb -0.10 -2.83 0.54 0.00 0.52 0.00 0.00 34.95 33.08 1oak s ARG 573 CO -0.00 -0.65 1.62 -1.35 0.02 0.00 0.00 175.30 174.95 1oak h PRO 574 N 2.71 0.10 -0.63 3.54 0.11 -1.99 0.50 132.00 136.34 1oak h PRO 574 Ca -0.51 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.70 1oak h PRO 574 Cb 1.25 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.26 1oak h PRO 574 CO 0.63 0.07 0.23 0.66 -0.21 0.00 0.00 178.00 179.38 1oak h SER 575 N 0.10 0.22 -0.33 -2.05 4.64 -1.99 0.37 113.55 114.52 1oak h SER 575 Ca 0.47 0.08 0.01 0.00 -0.47 0.00 0.00 61.79 61.89 1oak h SER 575 Cb 0.88 0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.01 1oak h SER 575 CO -0.72 0.12 0.19 -0.08 -0.87 0.00 0.00 176.83 175.47 1oak h GLU 576 N 0.41 0.37 -0.82 4.77 4.22 -0.41 -1.66 114.58 121.46 1oak h GLU 576 Ca 0.32 -0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.70 1oak h GLU 576 Cb 0.42 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 1oak h GLU 576 CO -0.33 0.25 0.36 -0.07 -2.18 0.00 0.00 179.01 177.04 1oak h LEU 577 N 0.38 1.10 -1.09 1.64 3.38 0.65 -0.37 115.31 121.01 1oak h LEU 577 Ca 0.13 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1oak h LEU 577 Cb 0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1oak h LEU 577 CO -0.07 0.95 -0.05 0.03 0.09 0.00 0.00 178.44 179.40 1oak h ARG 578 N 1.18 0.59 0.34 1.13 3.08 -0.09 -1.18 114.38 119.42 1oak h ARG 578 Ca 0.28 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 1oak h ARG 578 Cb 0.17 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1oak h ARG 578 CO -0.03 0.65 -0.16 -0.09 -1.07 0.00 0.00 179.97 179.27 1oak h ARG 579 N 0.55 -0.44 -0.76 0.04 2.43 -0.72 -1.40 114.38 114.08 1oak h ARG 579 Ca 0.11 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.48 1oak h ARG 579 Cb 0.43 0.10 -0.11 0.00 -0.42 0.00 0.00 29.97 29.97 1oak h ARG 579 CO 0.02 -0.13 0.20 0.82 -1.51 0.00 0.00 179.97 179.37 1oak h ILE 580 N -0.76 0.50 -0.23 1.20 2.04 -0.95 0.15 117.51 119.46 1oak h ILE 580 Ca -0.05 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.76 1oak h ILE 580 Cb 0.51 0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1oak h ILE 580 CO 0.08 0.05 -0.02 0.00 0.00 0.00 0.00 178.15 178.26 1oak h ALA 581 N 1.63 0.18 0.00 1.87 0.00 -1.03 -0.51 119.26 121.40 1oak h ALA 581 Ca 0.44 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.42 1oak h ALA 581 Cb 0.76 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1oak h ALA 581 CO -0.52 -0.44 -0.01 0.66 0.00 0.00 0.00 179.25 178.94 1oak h SER 582 N 0.04 0.00 -0.83 0.00 4.64 0.35 -2.15 113.55 115.61 1oak h SER 582 Ca 0.11 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.11 1oak h SER 582 Cb 0.15 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.05 1oak h SER 582 CO -0.20 0.01 0.41 0.00 -0.87 0.00 0.00 176.83 176.17 1oak n GLN 583 N -3.14 3.24 -2.62 4.77 1.13 -0.15 -4.94 117.38 115.66 1oak n GLN 583 Ca -0.02 -3.03 -0.43 0.00 -1.94 0.00 0.00 57.00 51.58 1oak n GLN 583 Cb 0.16 -2.20 -0.02 0.00 0.11 0.00 0.00 30.24 28.28 1oak n GLN 583 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1oak s VAL 584 N -3.07 4.60 0.30 5.09 1.01 -0.81 -4.98 120.40 122.54 1oak s VAL 584 Ca 0.56 1.93 -0.30 0.00 0.00 0.00 0.00 61.98 64.17 1oak s VAL 584 Cb 0.45 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 32.46 1oak s VAL 584 CO 0.13 -0.19 1.52 -0.54 0.00 0.00 0.00 175.10 176.01 1oak s LYS 585 N 3.28 4.17 0.17 2.72 1.02 -1.26 -4.96 119.74 124.88 1oak s LYS 585 Ca 0.46 2.48 -0.30 0.00 0.02 0.00 0.00 55.97 58.63 1oak s LYS 585 Cb -0.16 -3.04 -0.08 0.00 -0.52 0.00 0.00 37.83 34.03 1oak s LYS 585 CO 0.08 -0.53 1.13 -0.47 -0.92 0.00 0.00 175.35 174.64 1oak s TYR 586 N -0.28 3.55 -0.23 3.18 5.04 -1.26 -5.01 117.35 122.34 1oak s TYR 586 Ca 0.59 1.55 -0.00 0.00 -2.44 0.00 0.00 57.07 56.77 1oak s TYR 586 Cb -0.45 -3.32 0.06 0.00 0.35 0.00 0.00 41.96 38.60 1oak s TYR 586 CO 0.50 -0.77 -0.01 0.00 -1.34 0.00 0.00 175.55 173.92 1oak s ALA 587 N -0.14 1.65 -0.76 3.97 0.00 -1.26 -5.03 121.76 120.20 1oak s ALA 587 Ca 0.51 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 51.23 1oak s ALA 587 Cb -0.30 -1.38 0.22 0.00 0.00 0.00 0.00 23.12 21.66 1oak s ALA 587 CO 0.35 -1.24 2.31 0.41 0.00 0.00 0.00 175.76 177.60 1oak n GLY 588 N 4.79 5.12 3.73 0.00 0.00 -1.26 -3.29 105.19 114.29 1oak n GLY 588 Ca -0.10 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.35 1oak n GLY 588 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oak s SER 589 N -0.46 4.29 0.54 1.61 1.04 -0.99 -3.45 113.70 116.28 1oak s SER 589 Ca 0.53 2.25 0.33 0.00 0.48 0.00 0.00 55.95 59.54 1oak s SER 589 Cb 0.37 -2.58 1.31 0.00 0.10 0.00 0.00 66.02 65.23 1oak s SER 589 CO -0.29 -2.19 1.96 0.06 0.98 0.00 0.00 173.24 173.76 1oak h GLN 590 N -0.38 0.00 -3.56 4.02 3.07 -1.94 0.38 115.11 116.69 1oak h GLN 590 Ca -0.47 0.00 -0.27 0.00 0.09 0.00 0.00 58.65 58.00 1oak h GLN 590 Cb 1.28 0.00 -0.32 0.00 0.08 0.00 0.00 27.48 28.52 1oak h GLN 590 CO 0.50 0.01 -0.71 0.08 0.09 0.00 0.00 178.83 178.80 1oak s VAL 591 N -3.65 -0.04 -0.30 1.86 1.01 -1.26 -4.80 120.40 113.21 1oak s VAL 591 Ca 0.01 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1oak s VAL 591 Cb 0.09 -0.07 0.08 0.00 0.00 0.00 0.00 36.38 36.47 1oak s VAL 591 CO 0.55 0.06 -0.02 0.00 0.00 0.00 0.00 175.10 175.69 1oak s ALA 592 N 0.73 2.75 -0.53 5.51 0.00 -1.26 -3.05 121.76 125.92 1oak s ALA 592 Ca -0.06 -2.13 -0.29 0.00 0.00 0.00 0.00 51.96 49.49 1oak s ALA 592 Cb -0.09 -1.81 0.03 0.00 0.00 0.00 0.00 23.12 21.25 1oak s ALA 592 CO -0.02 -1.44 1.22 0.45 0.00 0.00 0.00 175.76 175.97 1oak s SER 593 N 1.05 6.46 0.14 0.00 0.15 0.95 -4.38 113.70 118.07 1oak s SER 593 Ca 0.00 0.32 -0.12 0.00 0.70 0.00 0.00 55.95 56.86 1oak s SER 593 Cb -0.20 -2.55 -0.02 0.00 -1.71 0.00 0.00 66.02 61.55 1oak s SER 593 CO -0.06 -1.43 1.53 0.71 1.20 0.00 0.00 173.24 175.19 1oak h THR 594 N 6.24 1.28 -0.48 6.45 1.35 -1.94 -2.42 112.91 123.39 1oak h THR 594 Ca -0.25 -1.31 0.05 0.00 -0.55 0.00 0.00 66.41 64.35 1oak h THR 594 Cb 1.07 1.20 -0.05 0.00 -1.73 0.00 0.00 68.15 68.64 1oak h THR 594 CO 1.16 0.45 0.20 0.28 -0.25 0.00 0.00 175.52 177.35 1oak h SER 595 N 0.71 0.25 -0.34 5.36 0.02 -1.90 -0.82 113.55 116.83 1oak h SER 595 Ca 0.10 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 1oak h SER 595 Cb 0.73 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1oak h SER 595 CO 0.06 0.18 0.12 -0.33 -1.14 0.00 0.00 176.83 175.71 1oak h GLU 596 N 0.40 0.60 -0.07 3.45 4.39 -1.82 0.29 114.58 121.82 1oak h GLU 596 Ca 0.22 -0.10 -0.24 0.00 0.34 0.00 0.00 59.36 59.59 1oak h GLU 596 Cb 0.19 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1oak h GLU 596 CO -0.20 0.54 -0.90 0.28 -1.16 0.00 0.00 179.01 177.58 1oak h VAL 597 N 0.59 1.30 -0.47 3.13 2.07 -0.83 0.13 116.25 122.18 1oak h VAL 597 Ca 0.14 -2.15 -0.08 0.00 0.82 0.00 0.00 66.70 65.43 1oak h VAL 597 Cb 0.20 2.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1oak h VAL 597 CO -0.01 0.67 -0.03 -0.07 0.02 0.00 0.00 177.57 178.16 1oak h LEU 598 N 0.42 0.83 -0.66 2.57 3.38 -1.01 0.58 115.31 121.42 1oak h LEU 598 Ca -0.08 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1oak h LEU 598 Cb 1.53 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 1oak h LEU 598 CO 0.17 0.95 0.36 0.50 0.09 0.00 0.00 178.44 180.51 1oak h LYS 599 N 0.69 0.93 -0.45 1.13 3.64 -0.87 0.41 116.57 122.06 1oak h LYS 599 Ca 0.13 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1oak h LYS 599 Cb 0.54 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1oak h LYS 599 CO 0.03 0.71 -0.13 -0.92 -2.27 0.00 0.00 179.45 176.87 1oak h TYR 600 N 0.91 0.92 -0.47 1.91 3.20 -0.35 0.39 116.97 123.48 1oak h TYR 600 Ca 0.23 -0.18 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 1oak h TYR 600 Cb 0.05 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1oak h TYR 600 CO -0.00 0.91 0.05 1.15 -1.64 0.00 0.00 178.16 178.62 1oak h THR 601 N 0.74 1.25 0.36 1.81 2.02 0.88 0.84 112.91 120.82 1oak h THR 601 Ca 0.12 -0.98 -0.02 0.00 0.77 0.00 0.00 66.41 66.30 1oak h THR 601 Cb 0.63 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1oak h THR 601 CO 0.04 0.34 -0.17 0.25 0.37 0.00 0.00 175.52 176.35 1oak h LEU 602 N 0.67 -0.41 0.00 2.58 5.85 0.01 0.12 115.31 124.13 1oak h LEU 602 Ca 0.14 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1oak h LEU 602 Cb 0.44 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1oak h LEU 602 CO 0.02 -0.01 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.34 1oak h PHE 603 N -0.89 0.00 0.00 1.25 0.04 -1.00 -3.18 116.94 113.17 1oak h PHE 603 Ca -0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1oak h PHE 603 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 1oak h PHE 603 CO 0.03 0.17 -0.27 1.04 -0.60 0.00 0.00 178.31 178.68 1oak n GLN 604 N -3.00 0.14 0.19 1.51 1.13 0.25 -4.12 117.38 113.48 1oak n GLN 604 Ca 0.01 0.06 -0.14 0.00 -1.94 0.00 0.00 57.00 54.98 1oak n GLN 604 Cb 0.61 -0.67 -0.07 0.00 0.11 0.00 0.00 30.24 30.22 1oak n GLN 604 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1oak h ILE 605 N -0.27 0.50 -0.90 5.09 2.04 -1.24 -3.08 117.51 119.64 1oak h ILE 605 Ca 0.00 0.00 -0.59 0.00 1.00 0.00 0.00 64.86 65.27 1oak h ILE 605 Cb 0.27 0.50 -0.30 0.00 -0.74 0.00 0.00 36.82 36.55 1oak h ILE 605 CO 0.00 0.00 0.47 0.49 0.00 0.00 0.00 178.15 179.11 1oak n PHE 606 N -5.36 2.95 -0.31 1.37 3.72 0.40 -4.58 117.46 115.66 1oak n PHE 606 Ca -0.09 -2.59 0.08 0.00 -0.05 0.00 0.00 57.45 54.80 1oak n PHE 606 Cb 0.27 -1.11 0.29 0.00 -0.94 0.00 0.00 39.48 37.99 1oak n PHE 606 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1oak h SER 607 N 1.79 0.82 -4.33 4.37 4.64 -1.51 -3.41 113.55 115.92 1oak h SER 607 Ca 0.54 0.03 -0.34 0.00 -0.47 0.00 0.00 61.79 61.55 1oak h SER 607 Cb 1.34 -0.14 -0.25 0.00 -0.31 0.00 0.00 62.40 63.04 1oak h SER 607 CO 1.28 0.47 -0.76 -0.75 -0.87 0.00 0.00 176.83 176.19 1oak s LYS 608 N -5.84 0.62 -0.90 4.77 2.20 -1.26 -5.04 119.74 114.29 1oak s LYS 608 Ca -0.11 -0.55 -0.10 0.00 -0.36 0.00 0.00 55.97 54.85 1oak s LYS 608 Cb 0.21 -0.54 0.23 0.00 -1.51 0.00 0.00 37.83 36.23 1oak s LYS 608 CO 0.80 0.13 0.84 0.42 -0.36 0.00 0.00 175.35 177.17 1oak s ILE 609 N -0.77 5.38 -0.18 5.43 -1.09 -1.26 -4.86 121.20 123.84 1oak s ILE 609 Ca -0.02 -2.98 0.29 0.00 -2.23 0.00 0.00 60.65 55.71 1oak s ILE 609 Cb -0.07 -4.30 0.33 0.00 -1.58 0.00 0.00 42.46 36.85 1oak s ILE 609 CO 0.00 -1.07 1.85 0.44 -1.23 0.00 0.00 174.94 174.94 1oak h ASP 610 N 7.15 0.00 -2.16 3.58 5.19 -1.97 -3.35 116.42 124.86 1oak h ASP 610 Ca 0.12 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.94 1oak h ASP 610 Cb 0.95 0.00 -0.41 0.00 0.18 0.00 0.00 39.33 40.06 1oak h ASP 610 CO 0.84 0.00 -0.78 -1.14 -3.12 0.00 0.00 179.24 175.03 1oak n ARG 611 N -2.76 1.81 0.28 3.56 0.63 -1.26 -4.92 116.66 114.00 1oak n ARG 611 Ca 0.02 -4.12 0.13 0.00 -0.92 0.00 0.00 57.85 52.96 1oak n ARG 611 Cb 0.31 -1.87 0.84 0.00 0.45 0.00 0.00 32.46 32.18 1oak n ARG 611 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1oak h PRO 612 N 4.19 0.00 0.00 -0.14 0.13 -2.00 -1.44 132.00 132.73 1oak h PRO 612 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1oak h PRO 612 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1oak h PRO 612 CO 0.69 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.61 1oak n GLU 613 N -4.05 0.49 -4.85 0.86 0.00 -1.26 -4.72 120.64 107.12 1oak n GLU 613 Ca -0.03 0.03 -0.31 0.00 0.00 0.00 0.00 57.16 56.86 1oak n GLU 613 Cb 0.09 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 29.89 1oak n GLU 613 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1oak s ALA 614 N -2.16 2.43 0.87 -1.84 0.00 -0.55 -4.82 121.76 115.70 1oak s ALA 614 Ca 0.25 -1.19 -0.12 0.00 0.00 0.00 0.00 51.96 50.90 1oak s ALA 614 Cb 0.13 -0.65 0.11 0.00 0.00 0.00 0.00 23.12 22.71 1oak s ALA 614 CO 0.23 0.55 1.11 -1.12 0.00 0.00 0.00 175.76 176.53 1oak s SER 615 N -1.19 3.84 -0.07 0.00 0.01 -1.11 -4.84 113.70 110.33 1oak s SER 615 Ca 0.13 1.21 0.01 0.00 1.31 0.00 0.00 55.95 58.61 1oak s SER 615 Cb -0.10 -1.88 0.02 0.00 0.21 0.00 0.00 66.02 64.27 1oak s SER 615 CO 0.03 -2.37 -0.08 -0.13 0.41 0.00 0.00 173.24 171.10 1oak s ARG 616 N -5.14 1.33 -0.03 12.44 0.52 -1.26 -1.64 118.95 125.17 1oak s ARG 616 Ca 0.63 -0.25 0.03 0.00 -0.52 0.00 0.00 55.73 55.61 1oak s ARG 616 Cb -0.15 -1.24 -0.00 0.00 0.52 0.00 0.00 34.95 34.07 1oak s ARG 616 CO 0.55 -0.09 -0.11 0.42 0.02 0.00 0.00 175.30 176.09 1oak s ILE 617 N 1.05 0.91 -0.33 1.52 1.01 -0.82 0.92 121.20 125.46 1oak s ILE 617 Ca -0.08 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.09 1oak s ILE 617 Cb -0.14 -0.79 0.05 0.00 0.01 0.00 0.00 42.46 41.58 1oak s ILE 617 CO -0.01 0.27 0.07 0.00 0.00 0.00 0.00 174.94 175.28 1oak s ALA 618 N 0.08 2.96 -0.52 9.38 0.00 0.18 -1.57 121.76 132.27 1oak s ALA 618 Ca -0.02 -1.81 -0.22 0.00 0.00 0.00 0.00 51.96 49.91 1oak s ALA 618 Cb -0.08 -2.14 0.04 0.00 0.00 0.00 0.00 23.12 20.94 1oak s ALA 618 CO 0.01 -1.34 0.82 -1.17 0.00 0.00 0.00 175.76 174.07 1oak s LEU 619 N 1.32 4.37 -0.68 0.00 2.96 -0.28 -0.85 118.68 125.52 1oak s LEU 619 Ca -0.03 -0.47 -0.17 0.00 -0.22 0.00 0.00 54.13 53.24 1oak s LEU 619 Cb -0.20 -2.74 0.14 0.00 0.50 0.00 0.00 46.19 43.89 1oak s LEU 619 CO 0.01 -1.08 0.75 -0.22 -1.32 0.00 0.00 176.35 174.49 1oak s LEU 620 N 3.45 5.76 -0.54 -0.68 2.96 0.17 -1.41 118.68 128.39 1oak s LEU 620 Ca 0.26 -1.85 -0.25 0.00 -0.22 0.00 0.00 54.13 52.08 1oak s LEU 620 Cb -0.14 -2.28 0.04 0.00 0.50 0.00 0.00 46.19 44.30 1oak s LEU 620 CO 0.18 -0.95 0.96 -0.76 -1.32 0.00 0.00 176.35 174.45 1oak s LEU 621 N 1.98 4.05 0.02 -0.68 1.43 -0.37 -0.78 118.68 124.34 1oak s LEU 621 Ca 0.14 -0.28 0.07 0.00 -1.03 0.00 0.00 54.13 53.04 1oak s LEU 621 Cb -0.19 -2.89 -0.02 0.00 0.03 0.00 0.00 46.19 43.12 1oak s LEU 621 CO 0.00 -1.22 -0.21 0.00 0.23 0.00 0.00 176.35 175.15 1oak s MET 622 N 3.99 1.49 0.00 1.70 0.23 -0.56 -1.92 119.30 124.23 1oak s MET 622 Ca 0.32 -0.87 0.00 0.00 -1.03 0.00 0.00 55.69 54.11 1oak s MET 622 Cb -0.12 -1.55 0.00 0.00 -1.53 0.00 0.00 34.83 31.63 1oak s MET 622 CO 0.20 0.41 0.14 0.00 -2.03 0.00 0.00 175.02 173.74 1oak n ALA 623 N 2.10 0.74 -3.80 3.16 0.00 -1.26 -0.43 120.51 121.03 1oak n ALA 623 Ca -0.16 -0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.10 1oak n ALA 623 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.97 1oak n ALA 623 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1oak n SER 624 N -0.03 1.46 -3.46 0.00 3.41 -1.25 -2.78 113.62 110.98 1oak n SER 624 Ca 0.00 -1.29 -0.17 0.00 -0.26 0.00 0.00 58.87 57.15 1oak n SER 624 Cb 0.16 0.10 -0.12 0.00 -0.26 0.00 0.00 64.21 64.09 1oak n SER 624 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1oak s GLN 625 N -2.22 0.23 0.84 4.33 0.74 -1.15 -0.22 119.66 122.21 1oak s GLN 625 Ca 0.02 0.15 -0.10 0.00 0.05 0.00 0.00 55.36 55.47 1oak s GLN 625 Cb 0.00 -1.04 0.10 0.00 1.10 0.00 0.00 33.01 33.18 1oak s GLN 625 CO 0.01 -0.73 1.12 -1.83 -0.55 0.00 0.00 175.29 173.31 1oak s GLU 626 N 2.35 1.62 0.32 1.67 -1.05 -1.26 -4.96 118.70 117.39 1oak s GLU 626 Ca 0.08 1.34 -0.29 0.00 -0.15 0.00 0.00 54.97 55.95 1oak s GLU 626 Cb -0.15 -1.81 -0.10 0.00 -0.44 0.00 0.00 34.13 31.62 1oak s GLU 626 CO -0.17 -2.14 1.33 -2.14 0.95 0.00 0.00 175.26 173.09 1oak s PRO 627 N -4.78 4.33 0.33 -4.83 0.02 -1.26 -4.91 135.00 123.89 1oak s PRO 627 Ca 0.64 2.25 0.11 0.00 0.02 0.00 0.00 61.00 64.02 1oak s PRO 627 Cb -0.20 -3.07 0.95 0.00 0.02 0.00 0.00 34.50 32.21 1oak s PRO 627 CO 0.57 -0.24 1.70 1.96 -0.33 0.00 0.00 177.00 180.66 1oak h GLN 628 N 3.54 0.45 -0.21 5.54 4.20 -1.99 0.29 115.11 126.93 1oak h GLN 628 Ca -0.49 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.26 1oak h GLN 628 Cb 1.23 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1oak h GLN 628 CO 0.67 0.30 0.22 0.07 -0.67 0.00 0.00 178.83 179.41 1oak h ARG 629 N 0.46 0.00 0.00 1.46 0.11 -2.03 0.25 114.38 114.64 1oak h ARG 629 Ca 0.67 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.75 1oak h ARG 629 Cb 1.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.47 1oak h ARG 629 CO -0.53 0.00 -0.24 -1.33 0.10 0.00 0.00 179.97 177.97 1oak n MET 630 N -3.87 0.27 0.00 0.08 2.81 0.10 -3.60 117.12 112.91 1oak n MET 630 Ca 0.02 0.16 0.13 0.00 -1.81 0.00 0.00 57.70 56.21 1oak n MET 630 Cb 0.35 -1.76 0.38 0.00 -0.71 0.00 0.00 33.22 31.49 1oak n MET 630 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1oak n SER 631 N -2.20 1.34 -0.33 7.83 7.64 0.88 -4.58 113.62 124.21 1oak n SER 631 Ca 0.05 -1.18 0.15 0.00 1.01 0.00 0.00 58.87 58.89 1oak n SER 631 Cb 0.43 0.11 0.30 0.00 -1.01 0.00 0.00 64.21 64.04 1oak n SER 631 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1oak h ARG 632 N 1.82 0.04 -0.44 1.43 2.43 -1.60 0.26 114.38 118.32 1oak h ARG 632 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1oak h ARG 632 Cb 0.55 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1oak h ARG 632 CO 0.00 0.03 0.00 0.09 -1.51 0.00 0.00 179.97 178.58 1oak n ASN 633 N -5.43 4.23 -0.11 -3.80 3.02 -1.26 -4.75 115.26 107.16 1oak n ASN 633 Ca 0.23 -2.62 -0.09 0.00 -0.03 0.00 0.00 54.58 52.07 1oak n ASN 633 Cb 0.76 -0.51 -0.07 0.00 -0.61 0.00 0.00 39.78 39.35 1oak n ASN 633 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1oak h PHE 634 N 2.87 -1.14 -0.63 3.10 3.57 -0.76 -1.03 116.94 122.92 1oak h PHE 634 Ca 0.00 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.62 1oak h PHE 634 Cb 1.38 0.54 -0.04 0.00 2.79 0.00 0.00 35.95 40.62 1oak h PHE 634 CO 0.61 -0.31 0.42 0.28 -2.23 0.00 0.00 178.31 177.08 1oak h VAL 635 N -0.23 0.99 -0.18 1.41 2.07 -1.85 -0.54 116.25 117.92 1oak h VAL 635 Ca 0.05 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1oak h VAL 635 Cb 0.38 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1oak h VAL 635 CO -0.42 0.11 -0.20 0.03 0.02 0.00 0.00 177.57 177.11 1oak h ARG 636 N 0.61 0.31 -0.04 1.57 3.08 -1.64 -0.21 114.38 118.05 1oak h ARG 636 Ca 0.27 -0.09 -0.22 0.00 0.07 0.00 0.00 59.98 60.01 1oak h ARG 636 Cb 0.30 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.33 1oak h ARG 636 CO -0.08 0.51 -0.89 1.88 -1.07 0.00 0.00 179.97 180.32 1oak h TYR 637 N 0.28 0.77 -0.20 3.04 0.05 0.12 -0.91 116.97 120.12 1oak h TYR 637 Ca 0.05 -0.39 -0.11 0.00 0.05 0.00 0.00 58.73 58.33 1oak h TYR 637 Cb 0.53 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1oak h TYR 637 CO 0.01 1.20 -0.35 0.28 -1.05 0.00 0.00 178.16 178.25 1oak h VAL 638 N 0.33 1.29 -0.10 -2.88 2.07 -1.06 -1.18 116.25 114.73 1oak h VAL 638 Ca -0.07 -1.45 -0.17 0.00 0.82 0.00 0.00 66.70 65.83 1oak h VAL 638 Cb 1.51 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 1oak h VAL 638 CO 0.16 0.45 -0.66 1.56 0.02 0.00 0.00 177.57 179.10 1oak h GLN 639 N 0.36 0.39 -0.54 1.57 4.20 -0.96 -1.41 115.11 118.71 1oak h GLN 639 Ca 0.04 -0.29 -0.07 0.00 0.06 0.00 0.00 58.65 58.39 1oak h GLN 639 Cb 0.79 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 1oak h GLN 639 CO 0.06 0.91 0.04 0.78 -0.67 0.00 0.00 178.83 179.95 1oak h GLY 640 N 1.30 0.96 0.93 3.46 0.00 -0.78 -0.40 103.07 108.55 1oak h GLY 640 Ca -0.02 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 1oak h GLY 640 CO 0.11 0.59 0.01 1.41 0.00 0.00 0.00 176.54 178.66 1oak h LEU 641 N 0.84 0.64 -1.61 3.11 3.38 -1.01 -2.10 115.31 118.55 1oak h LEU 641 Ca 0.16 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.87 1oak h LEU 641 Cb 0.44 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1oak h LEU 641 CO 0.02 0.78 0.32 0.50 0.09 0.00 0.00 178.44 180.15 1oak h LYS 642 N 0.47 0.49 0.00 1.13 3.64 -0.86 -0.01 116.57 121.43 1oak h LYS 642 Ca 0.11 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1oak h LYS 642 Cb 0.45 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1oak h LYS 642 CO 0.02 0.33 0.00 0.87 -2.27 0.00 0.00 179.45 178.39 1oak h LYS 643 N 0.51 0.00 -0.60 1.90 1.57 -0.51 -1.62 116.57 117.82 1oak h LYS 643 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1oak h LYS 643 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1oak h LYS 643 CO -0.05 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.46 1oak n LYS 644 N -2.87 2.42 -3.40 3.15 5.02 -0.14 -4.96 118.16 117.38 1oak n LYS 644 Ca 0.03 -2.16 -0.17 0.00 -2.02 0.00 0.00 58.31 53.99 1oak n LYS 644 Cb 0.42 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 34.03 1oak n LYS 644 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1oak n LYS 645 N 1.24 -6.56 -3.71 1.97 4.76 -0.61 -4.97 118.16 110.28 1oak n LYS 645 Ca 0.20 0.80 -0.38 0.00 -2.87 0.00 0.00 58.31 56.06 1oak n LYS 645 Cb 0.51 -5.70 -0.12 0.00 -1.84 0.00 0.00 35.03 27.88 1oak n LYS 645 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1oak s VAL 646 N -3.33 4.10 0.21 -0.18 1.01 -0.48 -4.03 120.40 117.70 1oak s VAL 646 Ca 0.11 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 1oak s VAL 646 Cb -0.05 -3.24 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 1oak s VAL 646 CO 0.69 -0.11 1.16 -0.63 0.00 0.00 0.00 175.10 176.22 1oak s ILE 647 N 1.48 3.56 -0.38 2.22 1.01 0.26 -4.11 121.20 125.25 1oak s ILE 647 Ca 0.01 1.39 -0.03 0.00 0.00 0.00 0.00 60.65 62.02 1oak s ILE 647 Cb -0.19 -3.88 0.09 0.00 0.01 0.00 0.00 42.46 38.49 1oak s ILE 647 CO 0.04 0.26 0.16 -0.69 0.00 0.00 0.00 174.94 174.70 1oak s VAL 648 N -0.40 3.24 -0.39 2.92 1.01 -1.26 0.51 120.40 126.04 1oak s VAL 648 Ca 0.50 -1.89 -0.17 0.00 0.00 0.00 0.00 61.98 60.42 1oak s VAL 648 Cb -0.32 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 32.92 1oak s VAL 648 CO 0.38 -0.56 0.46 -0.63 0.00 0.00 0.00 175.10 174.76 1oak s ILE 649 N 1.17 5.06 -0.10 2.22 -1.09 -0.03 -4.46 121.20 123.97 1oak s ILE 649 Ca 0.05 -0.04 -0.20 0.00 -2.23 0.00 0.00 60.65 58.24 1oak s ILE 649 Cb -0.22 -3.99 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 1oak s ILE 649 CO -0.03 -0.31 0.54 -2.16 -1.23 0.00 0.00 174.94 171.74 1oak s PRO 650 N 2.25 4.37 -0.32 2.79 0.04 -1.24 -0.66 135.00 142.23 1oak s PRO 650 Ca 0.15 0.57 0.02 0.00 0.04 0.00 0.00 61.00 61.77 1oak s PRO 650 Cb -0.16 -3.44 0.08 0.00 0.04 0.00 0.00 34.50 31.02 1oak s PRO 650 CO 0.14 0.13 0.02 0.08 0.04 0.00 0.00 177.00 177.41 1oak s VAL 651 N 0.66 2.54 0.18 -0.36 1.01 0.04 -0.91 120.40 123.56 1oak s VAL 651 Ca 0.29 -1.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.05 1oak s VAL 651 Cb -0.16 -2.66 -0.07 0.00 0.00 0.00 0.00 36.38 33.48 1oak s VAL 651 CO 0.12 -0.36 1.02 -0.83 0.00 0.00 0.00 175.10 175.06 1oak s GLY 652 N 1.17 2.97 -0.10 4.51 0.00 0.52 -1.49 107.32 114.90 1oak s GLY 652 Ca 0.02 0.70 -0.01 0.00 0.00 0.00 0.00 44.72 45.43 1oak s GLY 652 CO -0.05 1.48 -0.03 -0.42 0.00 0.00 0.00 173.10 174.08 1oak s ILE 653 N -0.42 0.66 0.00 0.90 1.01 0.43 -0.53 121.20 123.25 1oak s ILE 653 Ca 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.01 1oak s ILE 653 Cb -0.27 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1oak s ILE 653 CO 0.33 0.27 0.00 0.61 0.00 0.00 0.00 174.94 176.15 1oak n GLY 654 N 5.05 -2.10 0.00 6.18 0.00 -0.96 -4.10 105.19 109.26 1oak n GLY 654 Ca -0.09 -1.50 0.05 0.00 0.00 0.00 0.00 46.02 44.48 1oak n GLY 654 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oak n PRO 655 N -1.96 0.66 0.00 1.61 -0.04 -1.26 -2.93 135.00 131.08 1oak n PRO 655 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1oak n PRO 655 Cb 0.00 -1.26 -0.01 0.00 -0.04 0.00 0.00 33.50 32.19 1oak n PRO 655 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1oak n HIS 656 N -0.76 0.00 -1.71 0.54 8.25 -1.26 -4.99 115.22 115.29 1oak n HIS 656 Ca 0.08 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.11 1oak n HIS 656 Cb 0.04 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.12 1oak n HIS 656 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1oak n ALA 657 N -0.54 2.36 -1.55 -1.41 0.00 -1.12 -2.96 120.51 115.29 1oak n ALA 657 Ca 0.03 0.40 -0.31 0.00 0.00 0.00 0.00 53.44 53.56 1oak n ALA 657 Cb 0.17 -2.46 -0.04 0.00 0.00 0.00 0.00 19.45 17.13 1oak n ALA 657 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1oak n ASN 658 N 3.19 2.19 -0.05 0.00 2.85 0.69 -4.81 115.26 119.33 1oak n ASN 658 Ca 0.14 -0.71 -0.07 0.00 -0.11 0.00 0.00 54.58 53.82 1oak n ASN 658 Cb 0.34 -1.60 0.10 0.00 1.24 0.00 0.00 39.78 39.86 1oak n ASN 658 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1oak h LEU 659 N 20.23 0.70 0.24 1.20 5.85 -1.90 -2.16 115.31 139.47 1oak h LEU 659 Ca -0.19 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.26 1oak h LEU 659 Cb 1.21 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1oak h LEU 659 CO 1.13 0.96 -0.38 0.50 -0.34 0.00 0.00 178.44 180.31 1oak h LYS 660 N 0.58 -0.67 -0.07 1.25 3.64 -2.00 -0.21 116.57 119.10 1oak h LYS 660 Ca 0.07 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1oak h LYS 660 Cb 0.81 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1oak h LYS 660 CO 0.07 -0.44 0.02 1.96 -2.27 0.00 0.00 179.45 178.78 1oak h GLN 661 N -0.69 0.09 -0.21 1.90 4.20 -1.95 0.10 115.11 118.56 1oak h GLN 661 Ca 0.00 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1oak h GLN 661 Cb 0.67 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 1oak h GLN 661 CO -0.15 0.09 -0.12 0.82 -0.67 0.00 0.00 178.83 178.80 1oak h ILE 662 N 0.10 1.31 -0.45 2.54 2.04 -0.68 -0.63 117.51 121.73 1oak h ILE 662 Ca 0.02 -1.22 -0.08 0.00 1.00 0.00 0.00 64.86 64.59 1oak h ILE 662 Cb 0.04 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1oak h ILE 662 CO -0.00 0.37 -0.02 0.03 0.00 0.00 0.00 178.15 178.53 1oak h ARG 663 N 0.14 0.80 -0.81 2.37 3.08 -0.41 -2.54 114.38 117.01 1oak h ARG 663 Ca 0.04 -0.27 0.02 0.00 0.07 0.00 0.00 59.98 59.85 1oak h ARG 663 Cb 0.63 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.57 1oak h ARG 663 CO 0.03 0.87 0.54 1.25 -1.07 0.00 0.00 179.97 181.59 1oak h LEU 664 N 0.65 0.89 -0.61 3.04 5.85 -0.75 -2.01 115.31 122.38 1oak h LEU 664 Ca 0.13 -0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.68 1oak h LEU 664 Cb 0.52 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1oak h LEU 664 CO 0.03 0.63 -0.56 0.40 -0.34 0.00 0.00 178.44 178.59 1oak h ILE 665 N 1.04 1.35 -0.02 4.05 2.04 -0.88 -2.86 117.51 122.22 1oak h ILE 665 Ca 0.31 -1.85 -0.08 0.00 1.00 0.00 0.00 64.86 64.24 1oak h ILE 665 Cb -0.03 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1oak h ILE 665 CO -0.08 0.56 -0.35 -0.33 0.00 0.00 0.00 178.15 177.95 1oak h GLU 666 N 0.31 0.05 0.00 2.37 5.08 -0.99 -2.84 114.58 118.56 1oak h GLU 666 Ca 0.00 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1oak h GLU 666 Cb 1.08 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1oak h GLU 666 CO 0.10 0.39 -0.13 0.87 -1.00 0.00 0.00 179.01 179.24 1oak h LYS 667 N 0.04 0.00 -0.08 2.33 1.79 -1.20 -3.32 116.57 116.13 1oak h LYS 667 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1oak h LYS 667 Cb 0.64 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1oak h LYS 667 CO 0.05 0.13 -0.58 1.96 -1.08 0.00 0.00 179.45 179.93 1oak h GLN 668 N 0.00 0.24 -2.84 3.15 1.08 -1.28 -3.45 115.11 112.00 1oak h GLN 668 Ca -0.00 -0.15 -0.12 0.00 -1.45 0.00 0.00 58.65 56.93 1oak h GLN 668 Cb 1.05 0.02 -0.22 0.00 -0.05 0.00 0.00 27.48 28.28 1oak h GLN 668 CO 0.02 0.75 -0.23 0.00 -0.95 0.00 0.00 178.83 178.41 1oak s ALA 669 N -3.81 -0.95 0.45 3.87 0.00 -1.25 -5.05 121.76 115.01 1oak s ALA 669 Ca -0.04 0.76 0.11 0.00 0.00 0.00 0.00 51.96 52.78 1oak s ALA 669 Cb 0.12 -0.26 0.99 0.00 0.00 0.00 0.00 23.12 23.98 1oak s ALA 669 CO 0.79 -0.24 2.07 -1.00 0.00 0.00 0.00 175.76 177.39 1oak h PRO 670 N 4.54 0.31 0.00 0.00 0.13 -1.88 -2.84 132.00 132.26 1oak h PRO 670 Ca -0.28 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1oak h PRO 670 Cb 1.18 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1oak h PRO 670 CO 0.33 0.24 0.00 0.39 -0.23 0.00 0.00 178.00 178.73 1oak n GLU 671 N -4.47 0.19 -2.12 0.86 1.02 -1.26 -4.55 120.64 110.31 1oak n GLU 671 Ca 0.00 0.19 -0.34 0.00 -0.02 0.00 0.00 57.16 57.00 1oak n GLU 671 Cb 0.10 -1.74 -0.04 0.00 -0.02 0.00 0.00 31.44 29.74 1oak n GLU 671 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1oak n ASN 672 N -2.07 3.58 -4.78 1.62 3.02 -1.07 -4.87 115.26 110.69 1oak n ASN 672 Ca 0.05 -2.76 -0.39 0.00 -0.03 0.00 0.00 54.58 51.45 1oak n ASN 672 Cb 0.38 -1.69 -0.06 0.00 -0.61 0.00 0.00 39.78 37.81 1oak n ASN 672 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1oak s LYS 673 N 5.59 4.34 -0.04 3.52 2.20 -1.26 -4.10 119.74 129.99 1oak s LYS 673 Ca 0.63 0.85 -0.02 0.00 -0.36 0.00 0.00 55.97 57.07 1oak s LYS 673 Cb 0.03 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1oak s LYS 673 CO 0.11 0.48 0.07 0.00 -0.36 0.00 0.00 175.35 175.66 1oak s ALA 674 N -0.65 3.56 -0.30 3.13 0.00 -1.26 -3.63 121.76 122.62 1oak s ALA 674 Ca 0.32 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.49 1oak s ALA 674 Cb -0.20 -1.62 0.08 0.00 0.00 0.00 0.00 23.12 21.38 1oak s ALA 674 CO 0.20 0.65 -0.03 -0.06 0.00 0.00 0.00 175.76 176.52 1oak s PHE 675 N -1.09 3.46 -0.48 0.00 0.08 -0.09 -5.00 117.98 114.86 1oak s PHE 675 Ca 0.19 -2.54 -0.16 0.00 0.12 0.00 0.00 56.93 54.55 1oak s PHE 675 Cb -0.12 -2.35 0.07 0.00 -0.57 0.00 0.00 43.02 40.05 1oak s PHE 675 CO 0.09 -0.90 0.43 0.08 -0.10 0.00 0.00 175.22 174.83 1oak s VAL 676 N 1.04 5.18 0.04 -0.44 1.01 -1.26 -0.36 120.40 125.61 1oak s VAL 676 Ca -0.01 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1oak s VAL 676 Cb -0.20 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1oak s VAL 676 CO -0.06 -0.62 0.09 -0.76 0.00 0.00 0.00 175.10 173.75 1oak s LEU 677 N 1.80 3.88 0.32 3.92 1.02 0.31 -4.95 118.68 124.99 1oak s LEU 677 Ca 0.06 0.08 0.18 0.00 0.02 0.00 0.00 54.13 54.46 1oak s LEU 677 Cb -0.24 -2.43 0.14 0.00 0.02 0.00 0.00 46.19 43.69 1oak s LEU 677 CO 0.07 0.21 1.47 0.28 0.02 0.00 0.00 176.35 178.41 1oak h SER 678 N 3.63 0.00 -4.98 2.29 0.02 -1.91 -2.55 113.55 110.05 1oak h SER 678 Ca -0.48 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.56 1oak h SER 678 Cb 1.17 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.61 1oak h SER 678 CO 0.65 0.33 0.36 -0.94 -1.14 0.00 0.00 176.83 176.10 1oak s SER 679 N -6.34 -0.35 0.26 3.07 1.04 -1.26 -2.95 113.70 107.16 1oak s SER 679 Ca 0.05 -0.22 0.17 0.00 0.48 0.00 0.00 55.95 56.42 1oak s SER 679 Cb 0.07 0.54 0.94 0.00 0.10 0.00 0.00 66.02 67.66 1oak s SER 679 CO 0.72 -0.93 1.53 1.33 0.98 0.00 0.00 173.24 176.88 1oak n VAL 680 N -0.38 1.23 0.20 5.02 0.24 -1.26 -1.04 118.33 122.33 1oak n VAL 680 Ca -0.09 0.68 0.07 0.00 -2.04 0.00 0.00 64.34 62.96 1oak n VAL 680 Cb 0.62 -1.68 0.36 0.00 -1.47 0.00 0.00 33.84 31.67 1oak n VAL 680 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1oak h ASP 681 N 0.00 0.00 1.40 -1.34 3.32 -1.96 -2.51 116.42 115.32 1oak h ASP 681 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1oak h ASP 681 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1oak h ASP 681 CO 0.00 0.33 -0.10 -0.62 -1.72 0.00 0.00 179.24 177.13 1oak n GLU 682 N -3.47 0.28 -0.19 3.56 1.02 -0.21 -3.86 120.64 117.77 1oak n GLU 682 Ca 0.00 0.20 -0.00 0.00 -0.02 0.00 0.00 57.16 57.34 1oak n GLU 682 Cb 0.50 -1.80 0.08 0.00 -0.02 0.00 0.00 31.44 30.20 1oak n GLU 682 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1oak h LEU 683 N 0.00 -0.29 -0.49 -4.62 3.38 -1.54 -2.09 115.31 109.67 1oak h LEU 683 Ca 0.00 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1oak h LEU 683 Cb 0.75 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1oak h LEU 683 CO 0.00 -0.11 -0.03 -0.08 0.09 0.00 0.00 178.44 178.31 1oak h GLU 684 N 0.10 0.89 -0.97 1.13 4.81 -1.75 0.10 114.58 118.88 1oak h GLU 684 Ca 0.30 -0.30 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1oak h GLU 684 Cb 0.47 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 1oak h GLU 684 CO -0.51 0.93 0.64 1.96 -0.73 0.00 0.00 179.01 181.31 1oak h GLN 685 N 0.74 1.22 -0.01 1.92 4.20 -1.60 -2.62 115.11 118.97 1oak h GLN 685 Ca 0.14 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1oak h GLN 685 Cb 0.55 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1oak h GLN 685 CO 0.03 0.81 -0.60 1.04 -0.67 0.00 0.00 178.83 179.44 1oak n GLN 686 N -4.42 0.49 -0.31 1.46 6.02 -0.84 -4.49 117.38 115.28 1oak n GLN 686 Ca 0.13 -0.37 0.15 0.00 -0.01 0.00 0.00 57.00 56.90 1oak n GLN 686 Cb 0.07 -1.49 0.31 0.00 1.02 0.00 0.00 30.24 30.15 1oak n GLN 686 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1oak h ARG 687 N 0.89 0.12 -0.28 -1.09 2.43 -0.39 -0.22 114.38 115.85 1oak h ARG 687 Ca 0.00 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1oak h ARG 687 Cb 0.57 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1oak h ARG 687 CO 0.00 0.08 -0.41 -0.44 -1.51 0.00 0.00 179.97 177.69 1oak h ASP 688 N 0.13 0.73 -0.04 -3.80 3.32 -1.79 -1.20 116.42 113.76 1oak h ASP 688 Ca 0.58 -0.33 -0.14 0.00 0.02 0.00 0.00 57.03 57.16 1oak h ASP 688 Cb 1.22 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1oak h ASP 688 CO -0.74 1.05 -0.45 -0.33 -1.72 0.00 0.00 179.24 177.05 1oak h GLU 689 N 0.56 0.59 -0.07 3.56 3.07 -1.40 -1.40 114.58 119.49 1oak h GLU 689 Ca 0.04 -0.32 -0.01 0.00 -0.50 0.00 0.00 59.36 58.58 1oak h GLU 689 Cb 0.95 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1oak h GLU 689 CO 0.09 0.92 0.01 0.82 -1.40 0.00 0.00 179.01 179.44 1oak h ILE 690 N 0.47 1.22 -0.20 3.13 2.04 -1.06 -1.28 117.51 121.84 1oak h ILE 690 Ca 0.03 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 1oak h ILE 690 Cb 0.97 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 1oak h ILE 690 CO 0.09 0.19 0.02 0.58 0.00 0.00 0.00 178.15 179.02 1oak h VAL 691 N -0.14 1.12 0.22 1.67 2.07 -1.14 -1.72 116.25 118.33 1oak h VAL 691 Ca 0.02 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1oak h VAL 691 Cb 0.29 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1oak h VAL 691 CO 0.00 0.15 -0.11 -1.28 0.02 0.00 0.00 177.57 176.36 1oak h SER 692 N 0.29 -0.25 -0.08 0.57 0.87 -1.03 -1.88 113.55 112.04 1oak h SER 692 Ca 0.07 -0.24 0.04 0.00 -1.23 0.00 0.00 61.79 60.43 1oak h SER 692 Cb 0.17 0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.14 1oak h SER 692 CO 0.00 0.13 -0.27 0.22 -0.53 0.00 0.00 176.83 176.39 1oak h TYR 693 N -0.67 -0.72 -0.89 2.24 3.20 -0.94 0.96 116.97 120.16 1oak h TYR 693 Ca -0.03 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.93 1oak h TYR 693 Cb 0.47 0.33 -0.06 0.00 1.54 0.00 0.00 36.73 39.01 1oak h TYR 693 CO 0.04 -0.35 0.58 -0.07 -1.64 0.00 0.00 178.16 176.71 1oak h LEU 694 N -0.36 0.89 -0.45 2.82 3.38 -1.38 -1.94 115.31 118.27 1oak h LEU 694 Ca 0.08 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1oak h LEU 694 Cb 0.49 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1oak h LEU 694 CO -0.28 0.58 -0.14 0.00 0.09 0.00 0.00 178.44 178.68 1oak n ASP 696 N -4.23 0.54 -0.57 0.00 8.00 0.25 -1.02 116.55 119.51 1oak n ASP 696 Ca -0.00 0.66 0.13 0.00 0.71 0.00 0.00 54.79 56.29 1oak n ASP 696 Cb 0.40 -0.77 0.44 0.00 -0.02 0.00 0.00 41.12 41.18 1oak n ASP 696 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1oak n LEU 697 N -2.13 1.78 -4.62 0.64 4.77 -0.89 -4.87 117.00 111.69 1oak n LEU 697 Ca 0.01 -0.61 -0.29 0.00 -0.03 0.00 0.00 56.01 55.09 1oak n LEU 697 Cb 0.16 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.15 1oak n LEU 697 CO 0.16 0.30 -0.38 0.00 -1.33 0.00 0.00 177.39 176.14 1oak s ALA 698 N -1.98 3.09 0.14 -1.18 0.00 -0.19 -4.78 121.76 116.86 1oak s ALA 698 Ca 0.36 -1.25 -0.20 0.00 0.00 0.00 0.00 51.96 50.86 1oak s ALA 698 Cb 0.21 -0.98 -0.07 0.00 0.00 0.00 0.00 23.12 22.27 1oak s ALA 698 CO 0.32 0.61 0.66 -1.25 0.00 0.00 0.00 175.76 176.11 1oak s PRO 699 N -2.42 4.28 0.75 0.00 0.04 -1.26 -4.90 135.00 131.49 1oak s PRO 699 Ca 0.24 0.85 -0.11 0.00 0.04 0.00 0.00 61.00 62.01 1oak s PRO 699 Cb -0.11 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.35 1oak s PRO 699 CO 0.16 0.55 1.10 -1.83 0.04 0.00 0.00 177.00 177.01 1oak s GLU 700 N -1.42 2.52 -0.00 4.56 -1.05 -1.26 -1.91 118.70 120.13 1oak s GLU 700 Ca 0.35 0.55 0.03 0.00 -0.15 0.00 0.00 54.97 55.75 1oak s GLU 700 Cb -0.19 -1.98 -0.03 0.00 -0.44 0.00 0.00 34.13 31.49 1oak s GLU 700 CO 0.21 -1.29 -0.07 0.00 0.95 0.00 0.00 175.26 175.05 1oak s ALA 701 N -3.26 2.99 -2.60 -0.84 0.00 -1.26 -4.82 121.76 111.95 1oak s ALA 701 Ca 0.59 -1.01 0.21 0.00 0.00 0.00 0.00 51.96 51.75 1oak s ALA 701 Cb -0.13 -1.12 0.16 0.00 0.00 0.00 0.00 23.12 22.04 1oak s ALA 701 CO 0.53 0.61 1.16 -0.35 0.00 0.00 0.00 175.76 177.71