#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m10 n ASP 506 N 0.00 0.00 -4.95 0.41 8.00 -1.26 -4.75 116.55 113.99 1m10 n ASP 506 Ca 0.00 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 1m10 n ASP 506 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1m10 n ASP 506 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1m10 s PHE 507 N 0.00 3.28 -0.30 1.24 -0.12 -1.26 -5.10 117.98 115.73 1m10 s PHE 507 Ca 0.00 0.22 -0.15 0.00 -0.05 0.00 0.00 56.93 56.95 1m10 s PHE 507 Cb 0.00 -2.18 0.16 0.00 -0.63 0.00 0.00 43.02 40.37 1m10 s PHE 507 CO 0.00 -0.21 0.96 -0.47 -0.05 0.00 0.00 175.22 175.46 1m10 s TYR 508 N -2.46 -0.71 0.50 3.49 5.04 -1.26 -5.03 117.35 116.92 1m10 s TYR 508 Ca 0.46 1.25 0.06 0.00 -2.44 0.00 0.00 57.07 56.39 1m10 s TYR 508 Cb -0.10 0.42 0.00 0.00 0.35 0.00 0.00 41.96 42.64 1m10 s TYR 508 CO 0.37 -0.35 0.30 0.00 -1.34 0.00 0.00 175.55 174.53 1m10 s SER 510 N -4.13 0.36 0.16 0.00 0.15 -1.26 -4.40 113.70 104.58 1m10 s SER 510 Ca 0.34 0.17 -0.01 0.00 0.70 0.00 0.00 55.95 57.15 1m10 s SER 510 Cb -0.00 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1m10 s SER 510 CO 0.20 -0.18 0.22 0.54 1.20 0.00 0.00 173.24 175.22 1m10 n ARG 511 N 4.62 0.32 -2.72 5.44 1.74 -1.26 -2.90 116.66 121.89 1m10 n ARG 511 Ca -0.18 -1.27 -0.42 0.00 -0.77 0.00 0.00 57.85 55.20 1m10 n ARG 511 Cb 0.50 1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 33.13 1m10 n ARG 511 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1m10 s LEU 512 N 0.00 3.92 0.01 0.55 1.43 -0.52 -3.96 118.68 120.11 1m10 s LEU 512 Ca 0.13 -0.96 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1m10 s LEU 512 Cb -0.00 -2.48 -0.01 0.00 0.03 0.00 0.00 46.19 43.72 1m10 s LEU 512 CO 0.09 -1.55 -0.02 -0.22 0.23 0.00 0.00 176.35 174.88 1m10 s LEU 513 N 4.62 2.13 -0.45 1.79 2.96 -0.57 -2.81 118.68 126.34 1m10 s LEU 513 Ca 0.31 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 1m10 s LEU 513 Cb -0.10 0.03 0.13 0.00 0.50 0.00 0.00 46.19 46.75 1m10 s LEU 513 CO 0.07 -0.15 0.23 -1.81 -1.32 0.00 0.00 176.35 173.37 1m10 s ASP 514 N -0.77 3.99 -0.25 3.68 1.01 -0.89 -1.08 116.67 122.36 1m10 s ASP 514 Ca -0.08 -2.68 -0.11 0.00 0.71 0.00 0.00 52.55 50.39 1m10 s ASP 514 Cb -0.05 -1.29 -0.05 0.00 1.01 0.00 0.00 42.92 42.54 1m10 s ASP 514 CO -0.00 -0.27 0.19 -0.22 0.21 0.00 0.00 175.17 175.07 1m10 s LEU 515 N 0.22 4.09 -0.15 1.23 2.96 -0.81 -2.01 118.68 124.21 1m10 s LEU 515 Ca 0.16 0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 54.13 1m10 s LEU 515 Cb -0.24 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.27 1m10 s LEU 515 CO -0.02 0.02 0.00 -0.69 -1.32 0.00 0.00 176.35 174.34 1m10 s VAL 516 N 1.30 4.27 -0.16 1.68 1.01 -0.16 -2.40 120.40 125.94 1m10 s VAL 516 Ca 0.08 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 1m10 s VAL 516 Cb -0.14 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1m10 s VAL 516 CO 0.07 0.50 0.08 -0.36 0.00 0.00 0.00 175.10 175.39 1m10 s PHE 517 N 0.14 3.32 -0.29 5.22 0.08 0.11 -0.91 117.98 125.65 1m10 s PHE 517 Ca 0.01 0.20 0.00 0.00 0.12 0.00 0.00 56.93 57.27 1m10 s PHE 517 Cb -0.13 -2.03 0.09 0.00 -0.57 0.00 0.00 43.02 40.38 1m10 s PHE 517 CO 0.02 0.32 0.05 -0.51 -0.10 0.00 0.00 175.22 175.00 1m10 s LEU 518 N -0.04 2.64 -0.19 -0.37 1.43 -0.65 -1.40 118.68 120.10 1m10 s LEU 518 Ca 0.07 -1.54 -0.12 0.00 -1.03 0.00 0.00 54.13 51.51 1m10 s LEU 518 Cb -0.12 -1.04 -0.05 0.00 0.03 0.00 0.00 46.19 45.02 1m10 s LEU 518 CO 0.01 -0.36 0.22 -0.76 0.23 0.00 0.00 176.35 175.69 1m10 s LEU 519 N 1.47 4.20 -0.03 1.79 1.02 0.18 -0.52 118.68 126.79 1m10 s LEU 519 Ca 0.06 0.35 -0.30 0.00 0.02 0.00 0.00 54.13 54.26 1m10 s LEU 519 Cb -0.18 -2.24 -0.06 0.00 0.02 0.00 0.00 46.19 43.73 1m10 s LEU 519 CO -0.16 0.11 1.75 -0.62 0.02 0.00 0.00 176.35 177.44 1m10 s ASP 520 N 0.57 6.59 -0.58 2.29 -1.08 -0.84 -1.85 116.67 121.78 1m10 s ASP 520 Ca 0.12 2.35 0.02 0.00 -0.52 0.00 0.00 52.55 54.52 1m10 s ASP 520 Cb -0.12 -2.53 0.42 0.00 -1.46 0.00 0.00 42.92 39.23 1m10 s ASP 520 CO 0.02 -0.97 1.65 0.61 0.52 0.00 0.00 175.17 177.00 1m10 n GLY 521 N 4.27 5.95 3.98 2.66 0.00 -0.18 -4.87 105.19 116.99 1m10 n GLY 521 Ca 0.18 -2.53 -0.19 0.00 0.00 0.00 0.00 46.02 43.49 1m10 n GLY 521 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1m10 s SER 522 N -2.40 5.38 0.24 1.61 1.04 -1.26 -2.56 113.70 115.74 1m10 s SER 522 Ca 0.55 -0.60 0.25 0.00 0.48 0.00 0.00 55.95 56.63 1m10 s SER 522 Cb 0.45 -0.44 0.91 0.00 0.10 0.00 0.00 66.02 67.03 1m10 s SER 522 CO -0.13 -0.84 1.74 -1.54 0.98 0.00 0.00 173.24 173.45 1m10 n SER 523 N -1.83 0.73 0.00 7.02 3.41 0.14 -3.32 113.62 119.76 1m10 n SER 523 Ca 0.08 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1m10 n SER 523 Cb 0.60 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1m10 n SER 523 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1m10 n ARG 524 N -2.25 0.00 -3.66 4.33 5.12 -1.26 -3.98 116.66 114.96 1m10 n ARG 524 Ca 0.04 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.77 1m10 n ARG 524 Cb 0.32 -1.09 -0.16 0.00 -1.16 0.00 0.00 32.46 30.36 1m10 n ARG 524 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1m10 s LEU 525 N -1.15 0.01 1.00 0.55 1.43 -1.21 -4.95 118.68 114.36 1m10 s LEU 525 Ca 0.00 0.19 -0.11 0.00 -1.03 0.00 0.00 54.13 53.18 1m10 s LEU 525 Cb 0.00 0.12 0.19 0.00 0.03 0.00 0.00 46.19 46.53 1m10 s LEU 525 CO 0.00 -0.25 1.09 -0.94 0.23 0.00 0.00 176.35 176.48 1m10 s SER 526 N 2.25 2.37 0.14 2.29 1.04 -1.26 -4.64 113.70 115.89 1m10 s SER 526 Ca 0.04 1.79 -0.17 0.00 0.48 0.00 0.00 55.95 58.09 1m10 s SER 526 Cb -0.12 -2.39 -0.01 0.00 0.10 0.00 0.00 66.02 63.59 1m10 s SER 526 CO -0.05 -3.38 1.78 -0.08 0.98 0.00 0.00 173.24 172.49 1m10 h GLU 527 N -2.06 0.46 -0.90 4.02 4.81 -1.96 0.50 114.58 119.45 1m10 h GLU 527 Ca -0.51 -0.04 0.14 0.00 -0.13 0.00 0.00 59.36 58.82 1m10 h GLU 527 Cb 1.29 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.50 1m10 h GLU 527 CO 0.48 0.33 0.58 0.00 -0.73 0.00 0.00 179.01 179.67 1m10 h ALA 528 N 1.10 1.79 0.00 2.92 0.00 -2.01 0.80 119.26 123.86 1m10 h ALA 528 Ca 0.12 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1m10 h ALA 528 Cb -0.02 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1m10 h ALA 528 CO -0.02 -0.03 -0.10 0.93 0.00 0.00 0.00 179.25 180.02 1m10 h GLU 529 N 0.73 0.00 -0.40 0.00 5.08 -1.33 -3.19 114.58 115.48 1m10 h GLU 529 Ca 0.45 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.72 1m10 h GLU 529 Cb 0.69 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1m10 h GLU 529 CO -0.21 0.10 -0.13 0.35 -1.00 0.00 0.00 179.01 178.12 1m10 h PHE 530 N 0.00 0.90 -0.97 4.33 3.57 0.23 -2.91 116.94 122.09 1m10 h PHE 530 Ca -0.00 -0.20 0.12 0.00 3.53 0.00 0.00 57.97 61.41 1m10 h PHE 530 Cb 1.07 -0.21 -0.08 0.00 2.79 0.00 0.00 35.95 39.52 1m10 h PHE 530 CO 0.00 0.93 0.60 0.93 -2.23 0.00 0.00 178.31 178.54 1m10 h GLU 531 N 0.60 0.92 0.00 1.11 4.39 -1.40 0.15 114.58 120.36 1m10 h GLU 531 Ca 0.10 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1m10 h GLU 531 Cb 0.66 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1m10 h GLU 531 CO 0.05 0.61 0.00 0.28 -1.16 0.00 0.00 179.01 178.78 1m10 h VAL 532 N 0.95 0.00 0.10 3.13 2.07 -1.56 0.30 116.25 121.24 1m10 h VAL 532 Ca 0.48 -0.41 -0.25 0.00 0.82 0.00 0.00 66.70 67.34 1m10 h VAL 532 Cb 0.47 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1m10 h VAL 532 CO -0.27 0.00 -1.26 0.25 0.02 0.00 0.00 177.57 176.31 1m10 h LEU 533 N 0.00 0.33 -0.62 2.57 5.85 -0.68 -2.97 115.31 119.78 1m10 h LEU 533 Ca 0.00 -0.84 0.04 0.00 0.84 0.00 0.00 57.88 57.92 1m10 h LEU 533 Cb 0.44 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1m10 h LEU 533 CO 0.00 1.55 0.36 0.11 -0.34 0.00 0.00 178.44 180.12 1m10 h LYS 534 N -0.42 0.67 0.14 1.25 1.57 -0.32 -1.21 116.57 118.26 1m10 h LYS 534 Ca -0.28 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.48 1m10 h LYS 534 Cb 1.66 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.78 1m10 h LYS 534 CO 0.04 0.45 -0.35 0.00 -0.57 0.00 0.00 179.45 179.02 1m10 h ALA 535 N 1.30 -0.61 -0.98 3.86 0.00 -0.52 -0.82 119.26 121.49 1m10 h ALA 535 Ca 0.26 -0.06 0.33 0.00 0.00 0.00 0.00 54.91 55.44 1m10 h ALA 535 Cb 0.10 0.57 -0.16 0.00 0.00 0.00 0.00 17.79 18.29 1m10 h ALA 535 CO -0.14 -0.90 0.41 0.35 0.00 0.00 0.00 179.25 178.97 1m10 h PHE 536 N -0.59 0.64 0.23 0.00 3.57 -1.09 -0.26 116.94 119.45 1m10 h PHE 536 Ca 0.02 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1m10 h PHE 536 Cb 0.61 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.23 1m10 h PHE 536 CO -0.30 -0.32 -0.11 0.28 -2.23 0.00 0.00 178.31 175.63 1m10 h VAL 537 N 0.15 0.80 -1.06 1.41 2.07 -0.30 -2.17 116.25 117.16 1m10 h VAL 537 Ca 0.72 -0.79 0.28 0.00 0.82 0.00 0.00 66.70 67.72 1m10 h VAL 537 Cb 1.68 1.22 -0.10 0.00 -1.52 0.00 0.00 31.29 32.57 1m10 h VAL 537 CO -0.71 0.16 0.67 0.58 0.02 0.00 0.00 177.57 178.28 1m10 h VAL 538 N -0.75 0.49 0.36 2.57 2.07 0.06 0.10 116.25 121.15 1m10 h VAL 538 Ca -0.03 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1m10 h VAL 538 Cb 0.50 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1m10 h VAL 538 CO 0.05 0.07 -0.17 0.44 0.02 0.00 0.00 177.57 177.98 1m10 h ASP 539 N 0.40 -0.41 -1.00 0.57 5.19 -1.27 -1.75 116.42 118.14 1m10 h ASP 539 Ca 0.62 -0.14 0.35 0.00 -0.62 0.00 0.00 57.03 57.24 1m10 h ASP 539 Cb 1.55 0.11 -0.16 0.00 0.18 0.00 0.00 39.33 41.01 1m10 h ASP 539 CO -0.34 0.02 0.56 0.24 -3.12 0.00 0.00 179.24 176.59 1m10 h MET 540 N -0.95 0.21 -0.03 3.56 2.86 -0.44 0.28 114.93 120.42 1m10 h MET 540 Ca -0.05 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1m10 h MET 540 Cb 0.53 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 1m10 h MET 540 CO 0.08 0.14 -0.02 0.52 1.06 0.00 0.00 176.91 178.69 1m10 h MET 541 N 0.22 0.07 -0.45 1.72 2.86 -0.74 -3.24 114.93 115.38 1m10 h MET 541 Ca 0.77 -0.04 0.09 0.00 -2.06 0.00 0.00 59.70 58.46 1m10 h MET 541 Cb 1.86 -0.00 -0.08 0.00 0.06 0.00 0.00 31.60 33.45 1m10 h MET 541 CO -0.66 0.51 -0.02 0.93 1.06 0.00 0.00 176.91 178.72 1m10 h GLU 542 N -0.36 0.08 -1.34 1.72 5.08 0.43 0.11 114.58 120.31 1m10 h GLU 542 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1m10 h GLU 542 Cb 0.49 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1m10 h GLU 542 CO 0.01 0.06 0.00 1.04 -1.00 0.00 0.00 179.01 179.11 1m10 n GLN 543 N -5.24 0.33 -3.66 2.33 6.02 -0.47 -4.60 117.38 112.09 1m10 n GLN 543 Ca 0.04 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.96 1m10 n GLN 543 Cb 0.24 -1.29 -0.08 0.00 1.02 0.00 0.00 30.24 30.13 1m10 n GLN 543 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1m10 s LEU 544 N 0.00 -0.74 -0.74 1.08 1.43 0.38 -4.17 118.68 115.92 1m10 s LEU 544 Ca 0.00 1.32 -0.27 0.00 -1.03 0.00 0.00 54.13 54.15 1m10 s LEU 544 Cb 0.00 2.00 -0.15 0.00 0.03 0.00 0.00 46.19 48.07 1m10 s LEU 544 CO 0.00 -0.22 2.51 0.54 0.23 0.00 0.00 176.35 179.41 1m10 n ARG 545 N 4.64 0.53 -2.70 1.70 5.12 -1.26 -4.86 116.66 119.84 1m10 n ARG 545 Ca -0.18 -0.07 -0.43 0.00 -1.93 0.00 0.00 57.85 55.24 1m10 n ARG 545 Cb 0.55 -2.57 -0.02 0.00 -1.16 0.00 0.00 32.46 29.26 1m10 n ARG 545 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1m10 s ILE 546 N 10.44 4.63 -0.28 0.55 1.01 -1.26 -3.39 121.20 132.89 1m10 s ILE 546 Ca 1.14 1.79 -0.34 0.00 0.00 0.00 0.00 60.65 63.24 1m10 s ILE 546 Cb -0.63 -4.32 0.17 0.00 0.01 0.00 0.00 42.46 37.69 1m10 s ILE 546 CO 0.35 -0.31 1.36 -0.94 0.00 0.00 0.00 174.94 175.41 1m10 s SER 547 N 1.44 -0.03 0.00 3.58 1.04 -0.94 -4.50 113.70 114.29 1m10 s SER 547 Ca 0.43 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1m10 s SER 547 Cb -0.14 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.01 1m10 s SER 547 CO 0.11 -0.04 0.74 1.67 0.98 0.00 0.00 173.24 176.70 1m10 n GLN 548 N 0.20 0.79 -0.03 4.02 7.27 -1.26 -2.87 117.38 125.50 1m10 n GLN 548 Ca 0.03 0.00 0.02 0.00 0.07 0.00 0.00 57.00 57.12 1m10 n GLN 548 Cb 0.57 -1.04 -0.10 0.00 2.41 0.00 0.00 30.24 32.08 1m10 n GLN 548 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1m10 n LYS 549 N -0.43 1.02 0.04 3.69 5.02 -1.26 -4.91 118.16 121.33 1m10 n LYS 549 Ca 0.00 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1m10 n LYS 549 Cb 0.02 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1m10 n LYS 549 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1m10 n TRP 550 N -2.14 -0.42 -3.80 2.13 5.03 -1.14 -5.03 117.44 112.07 1m10 n TRP 550 Ca -0.09 0.07 -0.28 0.00 3.03 0.00 0.00 57.50 60.24 1m10 n TRP 550 Cb 0.55 0.21 -0.16 0.00 -1.03 0.00 0.00 31.31 30.88 1m10 n TRP 550 CO 0.00 0.00 0.00 0.08 -0.03 0.00 0.00 177.69 177.74 1m10 s VAL 551 N -2.00 0.78 0.25 -0.99 1.01 -1.17 -1.51 120.40 116.78 1m10 s VAL 551 Ca 0.00 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.44 1m10 s VAL 551 Cb 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1m10 s VAL 551 CO 0.00 -0.06 0.38 -0.13 0.00 0.00 0.00 175.10 175.29 1m10 s ARG 552 N 1.75 3.43 0.24 2.72 0.52 -0.24 -2.22 118.95 125.16 1m10 s ARG 552 Ca -0.01 -0.73 -0.11 0.00 -0.52 0.00 0.00 55.73 54.37 1m10 s ARG 552 Cb -0.16 -2.86 -0.01 0.00 0.52 0.00 0.00 34.95 32.43 1m10 s ARG 552 CO -0.07 0.39 0.42 0.14 0.02 0.00 0.00 175.30 176.19 1m10 s VAL 553 N -2.02 0.00 -0.18 3.52 -7.23 -1.26 -1.93 120.40 111.30 1m10 s VAL 553 Ca 0.35 -1.51 -0.21 0.00 -1.81 0.00 0.00 61.98 58.79 1m10 s VAL 553 Cb -0.09 -2.27 0.06 0.00 0.56 0.00 0.00 36.38 34.64 1m10 s VAL 553 CO 0.30 0.00 0.58 0.00 -0.31 0.00 0.00 175.10 175.66 1m10 s ALA 554 N -4.02 -1.44 -0.14 1.32 0.00 -1.01 -2.73 121.76 113.74 1m10 s ALA 554 Ca 0.25 1.49 0.01 0.00 0.00 0.00 0.00 51.96 53.72 1m10 s ALA 554 Cb 0.01 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.42 1m10 s ALA 554 CO 0.10 -0.29 -0.17 0.08 0.00 0.00 0.00 175.76 175.48 1m10 s VAL 555 N -0.06 1.69 -0.08 0.00 1.01 -1.19 0.05 120.40 121.82 1m10 s VAL 555 Ca -0.03 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1m10 s VAL 555 Cb -0.04 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.82 1m10 s VAL 555 CO 0.02 0.48 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 1m10 s VAL 556 N 1.18 0.85 -0.12 2.92 1.01 -0.49 -0.86 120.40 124.89 1m10 s VAL 556 Ca -0.01 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.69 1m10 s VAL 556 Cb -0.14 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1m10 s VAL 556 CO -0.06 0.32 0.05 -1.83 0.00 0.00 0.00 175.10 173.57 1m10 s GLU 557 N 1.34 3.36 0.40 2.72 4.04 -0.98 -0.65 118.70 128.93 1m10 s GLU 557 Ca -0.03 -0.33 0.03 0.00 0.04 0.00 0.00 54.97 54.69 1m10 s GLU 557 Cb -0.14 -3.00 -0.03 0.00 0.02 0.00 0.00 34.13 30.98 1m10 s GLU 557 CO -0.03 0.60 0.09 1.52 -1.84 0.00 0.00 175.26 175.60 1m10 s TYR 558 N -0.58 1.86 0.00 4.83 1.13 -0.77 -1.35 117.35 122.48 1m10 s TYR 558 Ca 0.11 -1.13 0.00 0.00 -1.41 0.00 0.00 57.07 54.63 1m10 s TYR 558 Cb -0.12 -1.28 0.00 0.00 -1.10 0.00 0.00 41.96 39.47 1m10 s TYR 558 CO 0.02 -0.12 0.00 -2.39 -2.51 0.00 0.00 175.55 170.55 1m10 n HIS 559 N -0.91 0.00 -3.07 -3.49 1.44 -1.26 -1.01 115.22 106.91 1m10 n HIS 559 Ca -0.07 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.21 1m10 n HIS 559 Cb 0.66 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.71 1m10 n HIS 559 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1m10 s ASP 560 N -4.00 6.27 0.28 4.39 1.01 -1.26 -1.76 116.67 121.59 1m10 s ASP 560 Ca 0.00 -0.68 0.00 0.00 0.71 0.00 0.00 52.55 52.58 1m10 s ASP 560 Cb 0.00 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.60 1m10 s ASP 560 CO 0.00 -0.95 0.00 0.61 0.21 0.00 0.00 175.17 175.04 1m10 n GLY 561 N 5.14 -2.73 3.93 0.21 0.00 -1.26 -4.93 105.19 105.54 1m10 n GLY 561 Ca -0.04 -1.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.46 1m10 n GLY 561 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m10 s SER 562 N -5.75 6.30 -0.42 1.61 0.01 -1.26 -4.63 113.70 109.55 1m10 s SER 562 Ca 0.00 0.60 0.02 0.00 1.31 0.00 0.00 55.95 57.88 1m10 s SER 562 Cb 0.00 -2.10 0.14 0.00 0.21 0.00 0.00 66.02 64.27 1m10 s SER 562 CO 0.00 -0.37 0.24 -1.00 0.41 0.00 0.00 173.24 172.52 1m10 s HIS 563 N -2.42 1.60 -0.08 2.43 3.76 -0.45 -5.00 115.29 115.12 1m10 s HIS 563 Ca 0.42 -2.20 -0.30 0.00 -0.15 0.00 0.00 55.06 52.84 1m10 s HIS 563 Cb -0.10 -1.57 -0.04 0.00 1.11 0.00 0.00 32.58 31.98 1m10 s HIS 563 CO 0.38 -0.79 1.51 0.00 -0.85 0.00 0.00 174.74 174.98 1m10 s ALA 564 N 0.52 3.63 -0.16 -1.40 0.00 -1.26 -2.32 121.76 120.77 1m10 s ALA 564 Ca 0.18 0.78 0.06 0.00 0.00 0.00 0.00 51.96 52.98 1m10 s ALA 564 Cb -0.22 -3.69 -0.14 0.00 0.00 0.00 0.00 23.12 19.07 1m10 s ALA 564 CO -0.01 -1.28 -0.08 0.66 0.00 0.00 0.00 175.76 175.05 1m10 n TYR 565 N 6.80 0.00 -4.17 0.00 4.02 -0.03 -5.01 117.16 118.77 1m10 n TYR 565 Ca 0.16 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.88 1m10 n TYR 565 Cb 0.43 -0.68 -0.11 0.00 -0.02 0.00 0.00 39.34 38.96 1m10 n TYR 565 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1m10 s ILE 566 N -2.35 1.02 0.09 -0.72 1.01 -1.16 -4.93 121.20 114.16 1m10 s ILE 566 Ca -0.17 -1.44 0.05 0.00 0.00 0.00 0.00 60.65 59.09 1m10 s ILE 566 Cb 0.05 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 1m10 s ILE 566 CO 0.47 -0.37 -0.13 -0.83 0.00 0.00 0.00 174.94 174.08 1m10 s GLY 567 N -2.03 0.89 0.28 6.18 0.00 -1.26 -3.17 107.32 108.21 1m10 s GLY 567 Ca 0.01 -1.08 0.02 0.00 0.00 0.00 0.00 44.72 43.66 1m10 s GLY 567 CO 0.01 -1.13 1.79 1.41 0.00 0.00 0.00 173.10 175.18 1m10 h LEU 568 N 4.01 0.73 -0.37 0.66 3.38 -1.91 0.13 115.31 121.94 1m10 h LEU 568 Ca -0.40 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1m10 h LEU 568 Cb 1.19 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1m10 h LEU 568 CO 0.45 0.31 -0.10 0.29 0.09 0.00 0.00 178.44 179.48 1m10 n LYS 569 N -4.77 0.91 -1.73 1.13 5.02 -1.26 -4.58 118.16 112.88 1m10 n LYS 569 Ca 0.20 -0.37 -0.42 0.00 -2.02 0.00 0.00 58.31 55.69 1m10 n LYS 569 Cb 0.46 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.95 1m10 n LYS 569 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1m10 s ASP 570 N -2.35 6.29 -0.51 4.39 1.11 0.03 -4.93 116.67 120.70 1m10 s ASP 570 Ca 0.32 2.42 -0.19 0.00 0.18 0.00 0.00 52.55 55.28 1m10 s ASP 570 Cb 0.20 -2.53 0.06 0.00 1.07 0.00 0.00 42.92 41.73 1m10 s ASP 570 CO 0.45 -1.21 0.62 -0.13 1.18 0.00 0.00 175.17 176.08 1m10 s ARG 571 N 4.76 3.11 -0.20 8.23 0.52 -1.26 -4.87 118.95 129.24 1m10 s ARG 571 Ca 0.88 -0.94 -0.18 0.00 -0.52 0.00 0.00 55.73 54.96 1m10 s ARG 571 Cb -0.39 -4.11 0.05 0.00 0.52 0.00 0.00 34.95 31.02 1m10 s ARG 571 CO 0.38 -1.24 0.53 0.15 0.02 0.00 0.00 175.30 175.15 1m10 s LYS 572 N 2.59 0.62 0.50 3.54 1.02 -1.26 -5.15 119.74 121.59 1m10 s LYS 572 Ca 0.14 0.74 -0.23 0.00 0.02 0.00 0.00 55.97 56.65 1m10 s LYS 572 Cb -0.20 0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 37.33 1m10 s LYS 572 CO 0.11 -0.08 1.19 2.89 -0.92 0.00 0.00 175.35 178.54 1m10 n ARG 573 N 2.83 1.54 -0.29 1.68 1.85 -1.26 -4.65 116.66 118.35 1m10 n ARG 573 Ca -0.14 0.56 0.09 0.00 -1.00 0.00 0.00 57.85 57.36 1m10 n ARG 573 Cb 0.56 -2.34 0.21 0.00 -1.05 0.00 0.00 32.46 29.84 1m10 n ARG 573 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 1m10 h PRO 574 N 1.45 0.07 -0.28 2.89 0.11 -2.00 0.29 132.00 134.53 1m10 h PRO 574 Ca -0.48 -0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.69 1m10 h PRO 574 Cb 1.32 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.34 1m10 h PRO 574 CO 0.56 0.05 -0.26 0.66 -0.21 0.00 0.00 178.00 178.80 1m10 h SER 575 N 0.07 -0.84 -0.26 -2.05 4.64 -1.96 -1.75 113.55 111.40 1m10 h SER 575 Ca 0.49 0.15 0.06 0.00 -0.47 0.00 0.00 61.79 62.02 1m10 h SER 575 Cb 0.91 0.40 -0.06 0.00 -0.31 0.00 0.00 62.40 63.34 1m10 h SER 575 CO -0.77 -0.29 -0.13 -0.08 -0.87 0.00 0.00 176.83 174.69 1m10 h GLU 576 N -0.25 -0.09 0.00 4.77 4.57 -0.80 -2.49 114.58 120.28 1m10 h GLU 576 Ca 0.15 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1m10 h GLU 576 Cb 0.48 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1m10 h GLU 576 CO -0.43 -0.06 0.00 1.28 -1.18 0.00 0.00 179.01 178.62 1m10 n LEU 577 N -5.30 0.00 -0.12 1.64 4.77 -0.62 -2.07 117.00 115.31 1m10 n LEU 577 Ca -0.01 0.63 0.08 0.00 -0.03 0.00 0.00 56.01 56.68 1m10 n LEU 577 Cb 0.21 -0.13 0.15 0.00 -2.33 0.00 0.00 43.42 41.32 1m10 n LEU 577 CO 0.18 -0.13 0.32 0.54 -1.33 0.00 0.00 177.39 176.98 1m10 n ARG 578 N -1.11 -0.03 0.00 3.23 1.74 -0.73 0.44 116.66 120.20 1m10 n ARG 578 Ca 0.00 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 1m10 n ARG 578 Cb 0.00 -0.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 1m10 n ARG 578 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1m10 n ARG 579 N -4.12 0.00 -0.28 5.56 0.63 -0.94 -1.88 116.66 115.63 1m10 n ARG 579 Ca 0.10 0.24 0.03 0.00 -0.92 0.00 0.00 57.85 57.30 1m10 n ARG 579 Cb 0.35 -1.23 0.08 0.00 0.45 0.00 0.00 32.46 32.11 1m10 n ARG 579 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1m10 n ILE 580 N -1.23 -0.35 -0.31 5.15 5.41 0.17 0.28 119.36 128.48 1m10 n ILE 580 Ca 0.00 1.77 0.10 0.00 1.00 0.00 0.00 62.75 65.62 1m10 n ILE 580 Cb 0.00 -2.40 0.28 0.00 -0.71 0.00 0.00 39.64 36.80 1m10 n ILE 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1m10 h ALA 581 N 1.36 1.43 0.00 -1.39 0.00 -1.18 0.19 119.26 119.68 1m10 h ALA 581 Ca 0.33 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1m10 h ALA 581 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1m10 h ALA 581 CO -0.78 -0.15 0.00 0.66 0.00 0.00 0.00 179.25 178.98 1m10 h SER 582 N 0.60 0.00 -0.40 0.00 4.64 0.49 -3.11 113.55 115.76 1m10 h SER 582 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1m10 h SER 582 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1m10 h SER 582 CO -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.55 1m10 n GLN 583 N -3.08 2.51 -1.70 4.77 6.02 0.67 -4.90 117.38 121.66 1m10 n GLN 583 Ca 0.03 -1.69 -0.43 0.00 -0.01 0.00 0.00 57.00 54.90 1m10 n GLN 583 Cb 0.44 -1.57 -0.03 0.00 1.02 0.00 0.00 30.24 30.10 1m10 n GLN 583 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1m10 s VAL 584 N -1.65 3.12 0.12 5.09 1.01 -1.11 -4.91 120.40 122.07 1m10 s VAL 584 Ca 0.30 0.13 -0.31 0.00 0.00 0.00 0.00 61.98 62.10 1m10 s VAL 584 Cb 0.19 -3.14 -0.10 0.00 0.00 0.00 0.00 36.38 33.33 1m10 s VAL 584 CO 0.16 -0.07 1.74 -0.54 0.00 0.00 0.00 175.10 176.39 1m10 s LYS 585 N 5.74 4.16 0.30 2.72 -0.14 -1.26 -4.95 119.74 126.30 1m10 s LYS 585 Ca 0.93 2.49 -0.29 0.00 -1.36 0.00 0.00 55.97 57.74 1m10 s LYS 585 Cb -0.33 -3.51 -0.13 0.00 -1.68 0.00 0.00 37.83 32.18 1m10 s LYS 585 CO 0.36 -0.78 1.30 0.98 -0.76 0.00 0.00 175.35 176.45 1m10 n TYR 586 N 5.36 2.12 -0.09 3.18 9.36 -1.26 -4.94 117.16 130.89 1m10 n TYR 586 Ca 0.17 0.53 -0.18 0.00 3.32 0.00 0.00 57.90 61.73 1m10 n TYR 586 Cb 0.39 -2.41 -0.06 0.00 -0.63 0.00 0.00 39.34 36.62 1m10 n TYR 586 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1m10 n ALA 587 N 0.92 1.54 -1.22 2.98 0.00 -1.26 -4.99 120.51 118.48 1m10 n ALA 587 Ca 0.08 -0.78 -0.07 0.00 0.00 0.00 0.00 53.44 52.66 1m10 n ALA 587 Cb 0.34 0.18 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 1m10 n ALA 587 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m10 n GLY 588 N 1.75 0.75 3.28 0.00 0.00 -1.06 -4.93 105.19 104.98 1m10 n GLY 588 Ca -0.32 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 1m10 n GLY 588 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1m10 n SER 589 N -0.98 -2.67 0.02 1.61 2.88 -1.07 -2.81 113.62 110.61 1m10 n SER 589 Ca -0.07 -0.34 -0.06 0.00 -1.33 0.00 0.00 58.87 57.06 1m10 n SER 589 Cb 0.52 -1.02 -0.12 0.00 -0.75 0.00 0.00 64.21 62.84 1m10 n SER 589 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1m10 h GLN 590 N -2.69 0.00 -6.72 -1.46 4.20 -1.93 0.39 115.11 106.89 1m10 h GLN 590 Ca -0.50 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 57.54 1m10 h GLN 590 Cb 1.26 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 28.85 1m10 h GLN 590 CO 0.36 0.61 -0.81 0.08 -0.67 0.00 0.00 178.83 178.40 1m10 s VAL 591 N -2.69 2.69 -0.40 -0.54 1.01 -1.26 -4.77 120.40 114.44 1m10 s VAL 591 Ca -0.02 -1.64 0.04 0.00 0.00 0.00 0.00 61.98 60.36 1m10 s VAL 591 Cb 0.09 -2.24 0.16 0.00 0.00 0.00 0.00 36.38 34.39 1m10 s VAL 591 CO 0.82 0.05 0.45 0.00 0.00 0.00 0.00 175.10 176.42 1m10 s ALA 592 N -1.24 -0.78 -0.26 5.51 0.00 -1.26 -3.98 121.76 119.75 1m10 s ALA 592 Ca 0.18 -0.85 -0.28 0.00 0.00 0.00 0.00 51.96 51.01 1m10 s ALA 592 Cb -0.10 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.78 1m10 s ALA 592 CO 0.10 -2.16 1.97 0.45 0.00 0.00 0.00 175.76 176.11 1m10 s SER 593 N 1.33 5.77 0.21 0.00 0.15 -0.72 -4.44 113.70 115.99 1m10 s SER 593 Ca 0.19 1.63 -0.03 0.00 0.70 0.00 0.00 55.95 58.44 1m10 s SER 593 Cb -0.11 -2.52 0.17 0.00 -1.71 0.00 0.00 66.02 61.85 1m10 s SER 593 CO -0.05 -1.75 1.56 0.71 1.20 0.00 0.00 173.24 174.91 1m10 h THR 594 N 6.86 1.30 -0.58 6.45 1.35 -1.96 -2.40 112.91 123.93 1m10 h THR 594 Ca -0.37 -1.62 -0.02 0.00 -0.55 0.00 0.00 66.41 63.85 1m10 h THR 594 Cb 1.20 1.59 -0.03 0.00 -1.73 0.00 0.00 68.15 69.18 1m10 h THR 594 CO 0.99 0.51 0.30 0.28 -0.25 0.00 0.00 175.52 177.35 1m10 h SER 595 N 0.48 0.72 0.42 5.36 0.02 -1.87 -2.50 113.55 116.18 1m10 h SER 595 Ca 0.03 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1m10 h SER 595 Cb 0.95 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1m10 h SER 595 CO 0.09 0.60 -0.20 -0.33 -1.14 0.00 0.00 176.83 175.84 1m10 h GLU 596 N 0.81 -0.55 -0.14 3.45 4.39 -1.75 -1.53 114.58 119.26 1m10 h GLU 596 Ca 0.20 0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.98 1m10 h GLU 596 Cb 0.06 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1m10 h GLU 596 CO -0.03 -0.24 0.13 -0.24 -1.16 0.00 0.00 179.01 177.47 1m10 h VAL 597 N -0.87 0.67 0.02 3.13 3.04 -1.36 0.29 116.25 121.16 1m10 h VAL 597 Ca -0.06 0.00 -0.24 0.00 -1.01 0.00 0.00 66.70 65.39 1m10 h VAL 597 Cb 0.56 0.90 -0.03 0.00 -2.01 0.00 0.00 31.29 30.71 1m10 h VAL 597 CO 0.10 0.00 -1.19 -0.07 -1.01 0.00 0.00 177.57 175.39 1m10 h LEU 598 N 0.00 0.06 -0.55 3.16 3.38 -1.42 -0.14 115.31 119.80 1m10 h LEU 598 Ca 0.07 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1m10 h LEU 598 Cb 0.32 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1m10 h LEU 598 CO -0.00 1.06 -0.15 0.50 0.09 0.00 0.00 178.44 179.94 1m10 h LYS 599 N 0.01 1.01 0.26 1.13 3.64 0.01 0.50 116.57 123.13 1m10 h LYS 599 Ca -0.09 -0.39 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 1m10 h LYS 599 Cb 1.85 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.62 1m10 h LYS 599 CO 0.13 1.08 -0.12 -0.92 -2.27 0.00 0.00 179.45 177.34 1m10 h TYR 600 N 0.89 -0.32 -0.71 1.91 3.20 -0.49 -2.58 116.97 118.87 1m10 h TYR 600 Ca 0.13 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1m10 h TYR 600 Cb 0.72 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.06 1m10 h TYR 600 CO 0.05 -0.06 0.40 1.15 -1.64 0.00 0.00 178.16 178.06 1m10 h THR 601 N -0.56 1.21 -0.68 1.81 2.02 -0.92 1.26 112.91 117.06 1m10 h THR 601 Ca -0.04 -0.52 0.05 0.00 0.77 0.00 0.00 66.41 66.67 1m10 h THR 601 Cb 0.41 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 1m10 h THR 601 CO 0.06 0.23 0.40 0.25 0.37 0.00 0.00 175.52 176.83 1m10 h LEU 602 N 0.97 0.62 0.00 2.58 5.85 -0.86 -0.89 115.31 123.58 1m10 h LEU 602 Ca 0.25 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.87 1m10 h LEU 602 Cb 0.02 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1m10 h LEU 602 CO -0.04 0.41 -2.01 0.49 -0.34 0.00 0.00 178.44 176.96 1m10 n PHE 603 N -4.74 0.00 0.68 1.25 3.72 -0.98 -3.56 117.46 113.84 1m10 n PHE 603 Ca 0.08 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.55 1m10 n PHE 603 Cb 0.14 -0.60 -0.06 0.00 -0.94 0.00 0.00 39.48 38.01 1m10 n PHE 603 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1m10 n GLN 604 N -2.35 2.10 -0.04 -1.08 1.13 0.43 -4.13 117.38 113.44 1m10 n GLN 604 Ca -0.13 -0.18 -0.09 0.00 -1.94 0.00 0.00 57.00 54.65 1m10 n GLN 604 Cb 0.72 -1.20 -0.03 0.00 0.11 0.00 0.00 30.24 29.84 1m10 n GLN 604 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1m10 n ILE 605 N -1.06 0.54 -1.65 5.09 5.41 -0.81 -4.78 119.36 122.09 1m10 n ILE 605 Ca 0.04 -0.11 -0.29 0.00 1.00 0.00 0.00 62.75 63.39 1m10 n ILE 605 Cb 0.25 -1.63 0.06 0.00 -0.71 0.00 0.00 39.64 37.60 1m10 n ILE 605 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1m10 n PHE 606 N -3.43 2.95 0.36 1.39 3.72 -0.40 -4.74 117.46 117.31 1m10 n PHE 606 Ca -0.17 -2.61 -0.16 0.00 -0.05 0.00 0.00 57.45 54.47 1m10 n PHE 606 Cb 0.61 -0.91 -0.08 0.00 -0.94 0.00 0.00 39.48 38.16 1m10 n PHE 606 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1m10 h SER 607 N 2.05 -0.80 -1.96 4.37 4.64 -1.71 -3.45 113.55 116.68 1m10 h SER 607 Ca 0.49 0.01 -0.44 0.00 -0.47 0.00 0.00 61.79 61.37 1m10 h SER 607 Cb 1.19 0.21 0.01 0.00 -0.31 0.00 0.00 62.40 63.50 1m10 h SER 607 CO 1.17 -0.44 -0.30 -0.75 -0.87 0.00 0.00 176.83 175.64 1m10 s LYS 608 N -4.94 3.10 -0.50 4.77 2.47 -1.26 -5.07 119.74 118.31 1m10 s LYS 608 Ca -0.15 -0.92 0.02 0.00 -1.56 0.00 0.00 55.97 53.35 1m10 s LYS 608 Cb 0.02 -2.77 0.13 0.00 -1.46 0.00 0.00 37.83 33.74 1m10 s LYS 608 CO 0.47 -0.00 0.26 0.42 0.16 0.00 0.00 175.35 176.66 1m10 s ILE 609 N -2.25 2.87 -0.01 5.43 1.01 -1.26 -4.99 121.20 122.01 1m10 s ILE 609 Ca 0.46 -2.96 -0.07 0.00 0.00 0.00 0.00 60.65 58.07 1m10 s ILE 609 Cb -0.10 -2.97 -0.04 0.00 0.01 0.00 0.00 42.46 39.36 1m10 s ILE 609 CO 0.32 -0.77 0.63 0.44 0.00 0.00 0.00 174.94 175.56 1m10 h ASP 610 N 6.95 -0.23 -3.07 3.58 3.45 -1.98 -3.38 116.42 121.74 1m10 h ASP 610 Ca -0.06 0.01 -0.75 0.00 0.43 0.00 0.00 57.03 56.66 1m10 h ASP 610 Cb 0.94 0.06 -0.22 0.00 -0.56 0.00 0.00 39.33 39.55 1m10 h ASP 610 CO 0.67 -0.07 0.58 -0.13 -1.57 0.00 0.00 179.24 178.72 1m10 s ARG 611 N -2.73 3.77 0.44 3.56 0.52 -1.26 -4.90 118.95 118.35 1m10 s ARG 611 Ca -0.04 -2.37 0.15 0.00 -0.52 0.00 0.00 55.73 52.95 1m10 s ARG 611 Cb 0.00 -4.71 0.98 0.00 0.52 0.00 0.00 34.95 31.74 1m10 s ARG 611 CO 0.12 -1.51 1.96 -1.00 0.02 0.00 0.00 175.30 174.88 1m10 h PRO 612 N 7.86 0.00 0.00 3.54 0.13 -2.01 -3.02 132.00 138.50 1m10 h PRO 612 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1m10 h PRO 612 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1m10 h PRO 612 CO 0.98 0.23 -0.11 0.39 -0.23 0.00 0.00 178.00 179.26 1m10 n GLU 613 N -4.18 0.24 -2.26 0.86 4.71 -1.26 -4.87 120.64 113.88 1m10 n GLU 613 Ca -0.02 0.18 -0.29 0.00 -0.01 0.00 0.00 57.16 57.02 1m10 n GLU 613 Cb 0.29 -1.76 0.02 0.00 -1.01 0.00 0.00 31.44 28.97 1m10 n GLU 613 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1m10 s ALA 614 N -3.10 3.22 0.54 0.62 0.00 -1.14 -4.87 121.76 117.03 1m10 s ALA 614 Ca 0.10 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.63 1m10 s ALA 614 Cb 0.13 -2.79 0.02 0.00 0.00 0.00 0.00 23.12 20.48 1m10 s ALA 614 CO 0.61 -0.68 0.79 -1.12 0.00 0.00 0.00 175.76 175.37 1m10 s SER 615 N -4.22 5.46 0.00 0.00 0.01 -1.12 -4.97 113.70 108.86 1m10 s SER 615 Ca 0.53 0.27 0.01 0.00 1.31 0.00 0.00 55.95 58.07 1m10 s SER 615 Cb -0.11 -1.27 -0.01 0.00 0.21 0.00 0.00 66.02 64.85 1m10 s SER 615 CO 0.48 -1.04 -0.03 -0.13 0.41 0.00 0.00 173.24 172.93 1m10 s ARG 616 N -4.80 0.23 -0.04 12.44 0.52 -1.26 -2.10 118.95 123.95 1m10 s ARG 616 Ca 0.54 -0.18 -0.04 0.00 -0.52 0.00 0.00 55.73 55.52 1m10 s ARG 616 Cb -0.10 -0.18 0.01 0.00 0.52 0.00 0.00 34.95 35.20 1m10 s ARG 616 CO 0.40 0.04 0.12 0.42 0.02 0.00 0.00 175.30 176.31 1m10 s ILE 617 N -0.27 0.01 -0.55 1.52 1.01 -0.85 -1.02 121.20 121.05 1m10 s ILE 617 Ca -0.01 -0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.60 1m10 s ILE 617 Cb -0.02 -0.20 0.14 0.00 0.01 0.00 0.00 42.46 42.38 1m10 s ILE 617 CO -0.00 -0.04 0.31 0.00 0.00 0.00 0.00 174.94 175.21 1m10 s ALA 618 N -0.08 3.40 -0.17 9.38 0.00 0.55 -0.99 121.76 133.86 1m10 s ALA 618 Ca -0.01 -3.34 -0.29 0.00 0.00 0.00 0.00 51.96 48.31 1m10 s ALA 618 Cb -0.02 -2.22 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1m10 s ALA 618 CO 0.00 -2.04 1.78 -1.17 0.00 0.00 0.00 175.76 174.33 1m10 s LEU 619 N -0.41 3.94 -0.59 0.00 2.96 -0.09 -2.94 118.68 121.55 1m10 s LEU 619 Ca 0.18 1.88 -0.08 0.00 -0.22 0.00 0.00 54.13 55.89 1m10 s LEU 619 Cb -0.23 -3.53 0.15 0.00 0.50 0.00 0.00 46.19 43.08 1m10 s LEU 619 CO -0.02 -1.32 0.46 -0.22 -1.32 0.00 0.00 176.35 173.93 1m10 s LEU 620 N 5.52 5.77 -0.84 -0.68 2.96 -1.11 -1.63 118.68 128.67 1m10 s LEU 620 Ca 0.79 -2.38 -0.25 0.00 -0.22 0.00 0.00 54.13 52.07 1m10 s LEU 620 Cb -0.30 -2.00 0.03 0.00 0.50 0.00 0.00 46.19 44.42 1m10 s LEU 620 CO 0.32 -0.56 1.41 -0.76 -1.32 0.00 0.00 176.35 175.44 1m10 s LEU 621 N 0.66 3.29 -0.12 -0.68 1.43 0.32 -1.18 118.68 122.40 1m10 s LEU 621 Ca 0.12 -0.76 -0.11 0.00 -1.03 0.00 0.00 54.13 52.35 1m10 s LEU 621 Cb -0.21 -2.56 -0.05 0.00 0.03 0.00 0.00 46.19 43.40 1m10 s LEU 621 CO -0.03 -1.80 0.23 -0.04 0.23 0.00 0.00 176.35 174.93 1m10 s MET 622 N 5.62 3.83 0.00 1.70 -1.94 -1.23 -1.98 119.30 125.31 1m10 s MET 622 Ca 0.43 0.02 0.00 0.00 -1.71 0.00 0.00 55.69 54.42 1m10 s MET 622 Cb -0.05 -3.28 0.00 0.00 2.01 0.00 0.00 34.83 33.50 1m10 s MET 622 CO 0.06 0.57 0.00 0.00 -0.01 0.00 0.00 175.02 175.64 1m10 n ALA 623 N 2.53 0.95 -3.25 3.03 0.00 -1.26 -1.34 120.51 121.18 1m10 n ALA 623 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1m10 n ALA 623 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1m10 n ALA 623 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1m10 n SER 624 N -0.52 0.70 -3.96 0.00 3.41 -1.19 -3.29 113.62 108.76 1m10 n SER 624 Ca 0.00 -0.72 -0.26 0.00 -0.26 0.00 0.00 58.87 57.64 1m10 n SER 624 Cb 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.78 1m10 n SER 624 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1m10 s GLN 625 N -1.15 1.59 0.47 4.33 -0.21 -1.11 -2.19 119.66 121.39 1m10 s GLN 625 Ca 0.00 -0.32 -0.21 0.00 0.02 0.00 0.00 55.36 54.85 1m10 s GLN 625 Cb 0.00 -1.49 -0.09 0.00 1.00 0.00 0.00 33.01 32.44 1m10 s GLN 625 CO 0.00 -0.13 1.04 -1.83 -2.12 0.00 0.00 175.29 172.25 1m10 s GLU 626 N 1.20 3.88 -0.07 2.91 -1.05 -1.26 -4.86 118.70 119.46 1m10 s GLU 626 Ca -0.04 1.38 -0.29 0.00 -0.15 0.00 0.00 54.97 55.86 1m10 s GLU 626 Cb -0.14 -2.18 -0.07 0.00 -0.44 0.00 0.00 34.13 31.31 1m10 s GLU 626 CO -0.03 -0.36 1.98 -2.14 0.95 0.00 0.00 175.26 175.66 1m10 s PRO 627 N -3.10 3.81 0.53 -4.83 0.02 -1.26 -4.84 135.00 125.32 1m10 s PRO 627 Ca 0.65 2.30 0.26 0.00 0.02 0.00 0.00 61.00 64.24 1m10 s PRO 627 Cb -0.17 -4.20 0.89 0.00 0.02 0.00 0.00 34.50 31.04 1m10 s PRO 627 CO 0.21 -1.32 1.16 1.04 -0.33 0.00 0.00 177.00 177.76 1m10 n GLN 628 N 7.88 0.01 0.31 5.54 6.02 -1.26 -0.47 117.38 135.41 1m10 n GLN 628 Ca 0.22 0.90 0.20 0.00 -0.01 0.00 0.00 57.00 58.31 1m10 n GLN 628 Cb 0.43 -2.22 1.00 0.00 1.02 0.00 0.00 30.24 30.47 1m10 n GLN 628 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1m10 h ARG 629 N 0.00 0.00 0.00 -1.09 3.08 -2.04 -2.55 114.38 111.78 1m10 h ARG 629 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.53 1m10 h ARG 629 Cb 2.67 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.72 1m10 h ARG 629 CO -0.01 0.02 -0.72 -1.33 -1.07 0.00 0.00 179.97 176.86 1m10 n MET 630 N -3.21 0.19 -0.01 0.04 2.81 0.38 -4.25 117.12 113.06 1m10 n MET 630 Ca -0.02 0.03 0.13 0.00 -1.81 0.00 0.00 57.70 56.03 1m10 n MET 630 Cb 0.15 -1.59 0.65 0.00 -0.71 0.00 0.00 33.22 31.72 1m10 n MET 630 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1m10 n SER 631 N -1.86 0.73 -0.31 7.83 7.64 -0.96 -4.41 113.62 122.28 1m10 n SER 631 Ca 0.04 -1.35 0.16 0.00 1.01 0.00 0.00 58.87 58.72 1m10 n SER 631 Cb 0.40 -0.02 0.33 0.00 -1.01 0.00 0.00 64.21 63.92 1m10 n SER 631 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1m10 h ARG 632 N 1.07 0.12 -0.10 1.43 2.43 -1.74 -1.43 114.38 116.16 1m10 h ARG 632 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1m10 h ARG 632 Cb 0.23 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1m10 h ARG 632 CO 0.00 0.08 0.00 0.09 -1.51 0.00 0.00 179.97 178.63 1m10 n ASN 633 N -5.31 2.39 -0.12 -3.80 3.02 -1.26 -4.76 115.26 105.41 1m10 n ASN 633 Ca 0.24 -1.67 -0.03 0.00 -0.03 0.00 0.00 54.58 53.09 1m10 n ASN 633 Cb 0.79 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.87 1m10 n ASN 633 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1m10 n PHE 634 N 0.81 -0.13 -0.27 3.10 7.35 -0.54 -0.02 117.46 127.75 1m10 n PHE 634 Ca 0.10 0.37 0.09 0.00 -0.76 0.00 0.00 57.45 57.24 1m10 n PHE 634 Cb 0.38 -0.43 0.23 0.00 0.35 0.00 0.00 39.48 40.01 1m10 n PHE 634 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1m10 h VAL 635 N 0.00 0.51 -0.46 -2.13 2.07 -1.86 -1.48 116.25 112.90 1m10 h VAL 635 Ca 0.05 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.50 1m10 h VAL 635 Cb 0.12 0.14 -0.08 0.00 -1.52 0.00 0.00 31.29 29.95 1m10 h VAL 635 CO -0.28 0.06 -0.51 0.03 0.02 0.00 0.00 177.57 176.90 1m10 h ARG 636 N 0.34 -0.29 -0.38 1.57 2.47 -0.78 0.25 114.38 117.56 1m10 h ARG 636 Ca 0.47 0.02 0.08 0.00 -1.26 0.00 0.00 59.98 59.30 1m10 h ARG 636 Cb 0.84 0.07 -0.08 0.00 -1.65 0.00 0.00 29.97 29.14 1m10 h ARG 636 CO -0.51 -0.19 -0.20 1.88 0.56 0.00 0.00 179.97 181.51 1m10 h TYR 637 N -0.30 -0.51 -0.73 3.04 0.05 -1.07 0.70 116.97 118.15 1m10 h TYR 637 Ca 0.08 0.04 0.07 0.00 0.05 0.00 0.00 58.73 58.97 1m10 h TYR 637 Cb 0.51 0.28 -0.05 0.00 1.01 0.00 0.00 36.73 38.49 1m10 h TYR 637 CO -0.77 -0.28 0.48 0.28 -1.05 0.00 0.00 178.16 176.82 1m10 h VAL 638 N -0.14 1.02 0.20 -2.88 2.07 -1.00 0.27 116.25 115.80 1m10 h VAL 638 Ca 0.19 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1m10 h VAL 638 Cb 0.43 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1m10 h VAL 638 CO -0.46 0.14 -0.10 1.56 0.02 0.00 0.00 177.57 178.73 1m10 h GLN 639 N 0.75 -0.27 -0.55 1.57 1.08 0.10 -1.60 115.11 116.20 1m10 h GLN 639 Ca 0.31 0.02 0.11 0.00 -1.45 0.00 0.00 58.65 57.64 1m10 h GLN 639 Cb 0.27 0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.73 1m10 h GLN 639 CO -0.11 0.13 0.37 0.78 -0.95 0.00 0.00 178.83 179.05 1m10 h GLY 640 N -0.81 0.41 0.48 3.46 0.00 0.80 0.38 103.07 107.79 1m10 h GLY 640 Ca -0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 1m10 h GLY 640 CO 0.05 0.07 -0.13 1.41 0.00 0.00 0.00 176.54 177.94 1m10 h LEU 641 N 0.29 -0.30 -0.87 3.11 3.38 -0.46 -2.85 115.31 117.60 1m10 h LEU 641 Ca 0.25 -0.23 0.15 0.00 0.09 0.00 0.00 57.88 58.15 1m10 h LEU 641 Cb 0.62 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.35 1m10 h LEU 641 CO -0.06 0.17 0.46 0.50 0.09 0.00 0.00 178.44 179.61 1m10 h LYS 642 N -0.88 0.62 -0.25 1.13 3.64 -0.75 0.94 116.57 121.02 1m10 h LYS 642 Ca -0.04 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1m10 h LYS 642 Cb 0.51 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1m10 h LYS 642 CO 0.06 0.41 0.25 -0.22 -2.27 0.00 0.00 179.45 177.68 1m10 h LYS 643 N 0.64 0.00 -0.65 1.90 3.64 -0.19 0.40 116.57 122.31 1m10 h LYS 643 Ca 0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1m10 h LYS 643 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1m10 h LYS 643 CO -0.37 0.00 0.00 1.63 -2.27 0.00 0.00 179.45 178.44 1m10 n LYS 644 N -3.92 3.80 -2.32 1.90 5.02 0.32 -4.89 118.16 118.07 1m10 n LYS 644 Ca 0.03 -2.45 -0.17 0.00 -2.02 0.00 0.00 58.31 53.70 1m10 n LYS 644 Cb 0.39 -1.99 -0.01 0.00 -0.02 0.00 0.00 35.03 33.40 1m10 n LYS 644 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1m10 n LYS 645 N 0.64 -1.36 -3.61 1.97 4.01 0.14 -4.97 118.16 114.97 1m10 n LYS 645 Ca 0.22 0.83 -0.36 0.00 -0.51 0.00 0.00 58.31 58.49 1m10 n LYS 645 Cb 0.91 -5.28 -0.08 0.00 -0.51 0.00 0.00 35.03 30.08 1m10 n LYS 645 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1m10 s VAL 646 N -2.85 5.34 -0.20 -0.18 1.01 -0.83 -4.17 120.40 118.52 1m10 s VAL 646 Ca 0.00 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 1m10 s VAL 646 Cb 0.00 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 1m10 s VAL 646 CO 0.00 0.38 0.15 -0.63 0.00 0.00 0.00 175.10 175.00 1m10 s ILE 647 N 0.63 5.39 -0.28 2.22 1.01 -0.19 -3.83 121.20 126.14 1m10 s ILE 647 Ca 0.12 0.22 -0.07 0.00 0.00 0.00 0.00 60.65 60.92 1m10 s ILE 647 Cb -0.13 -3.49 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 1m10 s ILE 647 CO 0.02 0.42 0.09 -0.69 0.00 0.00 0.00 174.94 174.78 1m10 s VAL 648 N 0.46 4.14 -0.87 2.92 1.01 -1.26 -0.33 120.40 126.48 1m10 s VAL 648 Ca 0.09 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1m10 s VAL 648 Cb -0.11 -3.08 0.22 0.00 0.00 0.00 0.00 36.38 33.41 1m10 s VAL 648 CO -0.01 0.15 0.76 -0.63 0.00 0.00 0.00 175.10 175.38 1m10 s ILE 649 N 1.55 4.57 0.28 2.22 1.01 -1.15 -4.36 121.20 125.32 1m10 s ILE 649 Ca 0.04 -3.52 -0.29 0.00 0.00 0.00 0.00 60.65 56.87 1m10 s ILE 649 Cb -0.17 -3.84 -0.10 0.00 0.01 0.00 0.00 42.46 38.36 1m10 s ILE 649 CO 0.03 -1.06 1.41 -2.16 0.00 0.00 0.00 174.94 173.16 1m10 s PRO 650 N -0.97 4.28 -0.62 2.79 0.04 -1.26 -2.77 135.00 136.48 1m10 s PRO 650 Ca 0.25 2.30 0.05 0.00 0.04 0.00 0.00 61.00 63.64 1m10 s PRO 650 Cb -0.10 -3.09 0.17 0.00 0.04 0.00 0.00 34.50 31.52 1m10 s PRO 650 CO -0.10 -0.37 0.45 0.08 0.04 0.00 0.00 177.00 177.11 1m10 s VAL 651 N -0.39 2.18 0.60 -0.36 1.01 -0.33 -2.10 120.40 121.00 1m10 s VAL 651 Ca 0.56 -3.82 -0.18 0.00 0.00 0.00 0.00 61.98 58.54 1m10 s VAL 651 Cb -0.42 -2.44 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 1m10 s VAL 651 CO 0.47 -1.07 0.75 0.61 0.00 0.00 0.00 175.10 175.87 1m10 n GLY 652 N 2.22 -0.88 3.29 4.51 0.00 0.30 -3.47 105.19 111.15 1m10 n GLY 652 Ca 0.22 -0.17 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 1m10 n GLY 652 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m10 s ILE 653 N -1.62 -0.02 0.30 -0.61 1.01 -0.45 -1.93 121.20 117.88 1m10 s ILE 653 Ca 0.73 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.44 1m10 s ILE 653 Cb -0.42 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.44 1m10 s ILE 653 CO 0.50 0.02 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1m10 n GLY 654 N 3.77 -2.73 0.16 6.18 0.00 0.17 -3.83 105.19 108.90 1m10 n GLY 654 Ca -0.20 -1.26 0.08 0.00 0.00 0.00 0.00 46.02 44.65 1m10 n GLY 654 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1m10 n PRO 655 N -3.34 0.11 -0.36 1.61 -0.02 -1.26 -2.37 135.00 129.37 1m10 n PRO 655 Ca -0.04 0.59 0.08 0.00 -2.02 0.00 0.00 63.50 62.11 1m10 n PRO 655 Cb 0.36 -2.05 0.24 0.00 -0.02 0.00 0.00 33.50 32.03 1m10 n PRO 655 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1m10 n HIS 656 N -2.11 0.85 -2.04 6.00 8.25 -1.25 -4.98 115.22 119.94 1m10 n HIS 656 Ca -0.01 -0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 56.41 1m10 n HIS 656 Cb 0.23 -0.15 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 1m10 n HIS 656 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m10 s ALA 657 N -1.65 3.68 -1.16 -1.41 0.00 -1.00 -2.77 121.76 117.46 1m10 s ALA 657 Ca 0.36 1.23 -0.22 0.00 0.00 0.00 0.00 51.96 53.33 1m10 s ALA 657 Cb 0.23 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1m10 s ALA 657 CO 0.17 -0.76 1.86 1.21 0.00 0.00 0.00 175.76 178.24 1m10 s ASN 658 N 1.31 5.57 0.25 0.00 3.84 -0.93 -4.82 114.94 120.16 1m10 s ASN 658 Ca 0.68 -1.70 -0.03 0.00 0.21 0.00 0.00 52.86 52.02 1m10 s ASN 658 Cb -0.40 -2.58 0.44 0.00 -0.55 0.00 0.00 41.25 38.16 1m10 s ASN 658 CO 0.31 -2.48 1.79 -0.07 -2.79 0.00 0.00 177.10 173.85 1m10 h LEU 659 N 16.21 0.59 -1.77 3.21 3.38 -1.91 -1.34 115.31 133.68 1m10 h LEU 659 Ca 0.25 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.34 1m10 h LEU 659 Cb 0.94 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1m10 h LEU 659 CO 1.29 0.30 0.25 0.50 0.09 0.00 0.00 178.44 180.87 1m10 h LYS 660 N 0.70 0.28 0.03 1.13 1.63 -1.98 0.98 116.57 119.33 1m10 h LYS 660 Ca 0.42 -0.02 -0.21 0.00 -0.85 0.00 0.00 60.65 59.99 1m10 h LYS 660 Cb 0.48 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 1m10 h LYS 660 CO -0.30 0.19 -0.99 1.96 -3.45 0.00 0.00 179.45 176.86 1m10 h GLN 661 N 0.29 0.12 -0.00 1.90 4.20 -1.68 0.22 115.11 120.16 1m10 h GLN 661 Ca 0.16 -0.16 -0.14 0.00 0.06 0.00 0.00 58.65 58.56 1m10 h GLN 661 Cb 0.26 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1m10 h GLN 661 CO -0.03 1.01 -0.66 0.82 -0.67 0.00 0.00 178.83 179.30 1m10 h ILE 662 N 0.05 1.47 0.06 2.54 2.04 -0.15 -2.43 117.51 121.09 1m10 h ILE 662 Ca -0.05 -2.25 -0.11 0.00 1.00 0.00 0.00 64.86 63.46 1m10 h ILE 662 Cb 1.68 2.21 0.01 0.00 -0.74 0.00 0.00 36.82 39.99 1m10 h ILE 662 CO 0.14 0.64 -0.47 0.03 0.00 0.00 0.00 178.15 178.50 1m10 h ARG 663 N 0.01 0.21 -0.41 2.37 2.47 0.98 -2.30 114.38 117.71 1m10 h ARG 663 Ca -0.01 -0.31 0.12 0.00 -1.26 0.00 0.00 59.98 58.53 1m10 h ARG 663 Cb 1.16 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 29.57 1m10 h ARG 663 CO 0.09 1.10 0.32 -0.07 0.56 0.00 0.00 179.97 181.96 1m10 h LEU 664 N -0.52 0.00 0.14 3.04 3.38 -0.55 -2.46 115.31 118.35 1m10 h LEU 664 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1m10 h LEU 664 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1m10 h LEU 664 CO 0.09 0.00 -0.07 0.40 0.09 0.00 0.00 178.44 178.95 1m10 h ILE 665 N 0.00 0.00 -0.63 1.22 2.04 -1.42 -3.22 117.51 115.49 1m10 h ILE 665 Ca 0.20 -0.25 0.25 0.00 1.00 0.00 0.00 64.86 66.06 1m10 h ILE 665 Cb 0.83 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.80 1m10 h ILE 665 CO -0.00 0.00 0.27 -0.62 0.00 0.00 0.00 178.15 177.80 1m10 n GLU 666 N -3.20 -0.04 -0.13 2.37 1.02 -0.87 0.64 120.64 120.42 1m10 n GLU 666 Ca -0.02 0.89 0.10 0.00 -0.02 0.00 0.00 57.16 58.11 1m10 n GLU 666 Cb 0.08 -1.56 0.30 0.00 -0.02 0.00 0.00 31.44 30.23 1m10 n GLU 666 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1m10 n LYS 667 N -4.52 1.99 0.13 3.49 2.85 -1.07 -3.87 118.16 117.17 1m10 n LYS 667 Ca 0.22 -1.50 0.12 0.00 -1.05 0.00 0.00 58.31 56.10 1m10 n LYS 667 Cb 0.75 -1.42 0.12 0.00 -0.65 0.00 0.00 35.03 33.84 1m10 n LYS 667 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 177.40 177.72 1m10 h GLN 668 N 2.89 0.00 -2.23 -1.58 5.75 0.19 -3.47 115.11 116.65 1m10 h GLN 668 Ca 0.00 0.00 0.11 0.00 -0.15 0.00 0.00 58.65 58.61 1m10 h GLN 668 Cb 0.64 0.00 -0.16 0.00 1.07 0.00 0.00 27.48 29.03 1m10 h GLN 668 CO 0.00 0.00 0.50 0.00 -2.65 0.00 0.00 178.83 176.68 1m10 s ALA 669 N -3.25 -1.83 0.11 3.38 0.00 -1.25 -5.06 121.76 113.86 1m10 s ALA 669 Ca 0.04 1.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.91 1m10 s ALA 669 Cb 0.09 0.36 -0.06 0.00 0.00 0.00 0.00 23.12 23.51 1m10 s ALA 669 CO 0.72 -0.67 1.47 -1.00 0.00 0.00 0.00 175.76 176.28 1m10 h PRO 670 N 2.03 0.74 0.00 0.00 0.13 -1.92 -3.04 132.00 129.93 1m10 h PRO 670 Ca -0.22 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1m10 h PRO 670 Cb 1.24 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1m10 h PRO 670 CO 0.31 0.95 0.00 0.93 -0.23 0.00 0.00 178.00 179.96 1m10 h GLU 671 N 0.51 0.00 -2.31 0.86 3.07 -1.97 -3.29 114.58 111.45 1m10 h GLU 671 Ca 0.07 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.80 1m10 h GLU 671 Cb 0.75 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.62 1m10 h GLU 671 CO 0.06 0.00 -0.11 0.09 -1.40 0.00 0.00 179.01 177.65 1m10 n ASN 672 N -2.55 3.59 -4.74 1.42 4.13 -1.15 -4.79 115.26 111.17 1m10 n ASN 672 Ca 0.01 -2.17 -0.41 0.00 1.68 0.00 0.00 54.58 53.69 1m10 n ASN 672 Cb 0.21 -0.97 -0.03 0.00 -1.54 0.00 0.00 39.78 37.45 1m10 n ASN 672 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1m10 s LYS 673 N 1.61 4.33 0.55 3.52 2.20 -1.24 -3.17 119.74 127.54 1m10 s LYS 673 Ca 0.45 2.17 0.03 0.00 -0.36 0.00 0.00 55.97 58.26 1m10 s LYS 673 Cb 0.22 -3.15 0.04 0.00 -1.51 0.00 0.00 37.83 33.42 1m10 s LYS 673 CO 0.00 -0.33 0.76 0.00 -0.36 0.00 0.00 175.35 175.42 1m10 s ALA 674 N 0.05 4.02 -0.16 3.13 0.00 -1.26 -4.22 121.76 123.32 1m10 s ALA 674 Ca 0.58 -1.46 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 1m10 s ALA 674 Cb -0.39 -1.97 0.06 0.00 0.00 0.00 0.00 23.12 20.82 1m10 s ALA 674 CO 0.41 -0.75 0.36 -0.06 0.00 0.00 0.00 175.76 175.72 1m10 s PHE 675 N -2.73 -0.56 -0.04 0.00 0.40 -0.89 -5.00 117.98 109.15 1m10 s PHE 675 Ca 0.58 1.19 0.05 0.00 -0.60 0.00 0.00 56.93 58.16 1m10 s PHE 675 Cb -0.10 0.19 -0.02 0.00 0.51 0.00 0.00 43.02 43.60 1m10 s PHE 675 CO 0.38 -0.35 -0.19 0.08 0.70 0.00 0.00 175.22 175.84 1m10 s VAL 676 N 1.75 2.63 -0.03 -0.44 1.01 -1.26 -0.54 120.40 123.52 1m10 s VAL 676 Ca -0.06 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1m10 s VAL 676 Cb -0.10 -1.99 0.03 0.00 0.00 0.00 0.00 36.38 34.32 1m10 s VAL 676 CO -0.11 0.59 -0.01 -0.76 0.00 0.00 0.00 175.10 174.80 1m10 s LEU 677 N -0.65 1.17 0.58 3.92 1.02 -0.81 -4.99 118.68 118.92 1m10 s LEU 677 Ca 0.10 -0.05 0.28 0.00 0.02 0.00 0.00 54.13 54.48 1m10 s LEU 677 Cb -0.11 -0.28 1.52 0.00 0.02 0.00 0.00 46.19 47.34 1m10 s LEU 677 CO 0.00 -0.10 1.96 0.77 0.02 0.00 0.00 176.35 179.01 1m10 h SER 678 N 7.30 0.00 -5.51 2.29 4.64 -1.93 0.51 113.55 120.85 1m10 h SER 678 Ca -0.40 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.13 1m10 h SER 678 Cb 1.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.17 1m10 h SER 678 CO 0.46 0.00 0.65 -0.94 -0.87 0.00 0.00 176.83 176.13 1m10 s SER 679 N -5.49 -0.02 0.39 4.97 1.04 -1.26 -3.25 113.70 110.07 1m10 s SER 679 Ca -0.04 -0.51 0.10 0.00 0.48 0.00 0.00 55.95 55.97 1m10 s SER 679 Cb 0.16 0.41 0.78 0.00 0.10 0.00 0.00 66.02 67.47 1m10 s SER 679 CO 0.57 -0.80 1.91 -0.37 0.98 0.00 0.00 173.24 175.54 1m10 h VAL 680 N 2.00 1.18 0.00 5.02 -1.51 -1.92 -1.38 116.25 119.64 1m10 h VAL 680 Ca -0.26 -0.79 0.00 0.00 -1.23 0.00 0.00 66.70 64.41 1m10 h VAL 680 Cb 1.21 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 1m10 h VAL 680 CO 0.33 0.25 0.00 0.44 -1.23 0.00 0.00 177.57 177.36 1m10 h ASP 681 N 0.22 0.00 -0.17 4.19 3.32 -1.94 -1.56 116.42 120.48 1m10 h ASP 681 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1m10 h ASP 681 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1m10 h ASP 681 CO 0.02 0.00 0.00 1.21 -1.72 0.00 0.00 179.24 178.75 1m10 n GLU 682 N -3.08 1.98 0.13 3.56 2.13 -0.52 -4.36 120.64 120.49 1m10 n GLU 682 Ca -0.03 -1.46 -0.10 0.00 0.66 0.00 0.00 57.16 56.23 1m10 n GLU 682 Cb 0.08 -1.45 -0.06 0.00 0.27 0.00 0.00 31.44 30.28 1m10 n GLU 682 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1m10 h LEU 683 N 3.11 -0.34 -0.40 4.31 3.38 -1.39 -2.61 115.31 121.38 1m10 h LEU 683 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1m10 h LEU 683 Cb 0.67 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1m10 h LEU 683 CO 0.00 0.14 0.33 1.21 0.09 0.00 0.00 178.44 180.21 1m10 n GLU 684 N -5.05 0.04 -0.08 1.13 4.07 -1.26 0.82 120.64 120.31 1m10 n GLU 684 Ca -0.08 0.41 -0.22 0.00 -0.06 0.00 0.00 57.16 57.22 1m10 n GLU 684 Cb 0.25 -1.97 -0.12 0.00 -0.06 0.00 0.00 31.44 29.54 1m10 n GLU 684 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 1m10 h GLN 685 N 0.00 0.05 0.00 5.31 4.20 -1.77 -3.39 115.11 119.52 1m10 h GLN 685 Ca 0.00 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1m10 h GLN 685 Cb 0.66 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.48 1m10 h GLN 685 CO 0.00 1.04 -0.55 1.96 -0.67 0.00 0.00 178.83 180.61 1m10 h GLN 686 N -0.80 0.00 0.00 1.46 1.08 0.04 -3.42 115.11 113.47 1m10 h GLN 686 Ca -0.35 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.85 1m10 h GLN 686 Cb 1.43 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.86 1m10 h GLN 686 CO -0.15 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.60 1m10 n ARG 687 N -2.81 0.00 -0.27 1.46 0.63 0.24 -1.20 116.66 114.71 1m10 n ARG 687 Ca 0.02 0.28 -0.09 0.00 -0.92 0.00 0.00 57.85 57.13 1m10 n ARG 687 Cb 0.53 -0.51 -0.08 0.00 0.45 0.00 0.00 32.46 32.86 1m10 n ARG 687 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1m10 h ASP 688 N 0.00 -1.63 -0.93 6.15 3.32 -1.86 0.15 116.42 121.62 1m10 h ASP 688 Ca 0.00 0.24 0.27 0.00 0.02 0.00 0.00 57.03 57.56 1m10 h ASP 688 Cb 0.00 0.71 -0.15 0.00 0.22 0.00 0.00 39.33 40.11 1m10 h ASP 688 CO 0.00 -0.22 0.34 -0.08 -1.72 0.00 0.00 179.24 177.57 1m10 h GLU 689 N -0.08 0.22 0.35 3.56 4.81 -1.50 -0.01 114.58 121.93 1m10 h GLU 689 Ca 0.11 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1m10 h GLU 689 Cb 0.36 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1m10 h GLU 689 CO -0.66 0.15 -0.17 0.82 -0.73 0.00 0.00 179.01 178.41 1m10 h ILE 690 N 0.23 0.00 0.00 2.32 2.04 0.74 -2.51 117.51 120.33 1m10 h ILE 690 Ca 0.63 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 66.37 1m10 h ILE 690 Cb 1.34 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1m10 h ILE 690 CO -0.66 0.00 0.33 0.55 0.00 0.00 0.00 178.15 178.37 1m10 n VAL 691 N -3.59 0.68 0.00 1.67 3.14 -0.60 -0.87 118.33 118.76 1m10 n VAL 691 Ca -0.06 0.66 0.00 0.00 -2.96 0.00 0.00 64.34 61.98 1m10 n VAL 691 Cb 0.19 -1.66 0.00 0.00 -1.06 0.00 0.00 33.84 31.30 1m10 n VAL 691 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1m10 n SER 692 N -1.75 0.00 -0.66 6.55 7.64 -0.07 -2.59 113.62 122.74 1m10 n SER 692 Ca -0.00 0.69 0.50 0.00 1.01 0.00 0.00 58.87 61.07 1m10 n SER 692 Cb 0.34 -0.48 0.77 0.00 -1.01 0.00 0.00 64.21 63.83 1m10 n SER 692 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1m10 n TYR 693 N -1.93 0.04 0.13 1.43 9.36 -0.05 0.18 117.16 126.31 1m10 n TYR 693 Ca 0.00 0.04 -0.12 0.00 3.32 0.00 0.00 57.90 61.14 1m10 n TYR 693 Cb 0.00 -0.50 -0.08 0.00 -0.63 0.00 0.00 39.34 38.13 1m10 n TYR 693 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1m10 h LEU 694 N 0.00 -0.32 -0.75 2.98 3.38 -1.51 -2.98 115.31 116.11 1m10 h LEU 694 Ca 0.89 -0.22 0.17 0.00 0.09 0.00 0.00 57.88 58.81 1m10 h LEU 694 Cb 3.53 0.08 -0.13 0.00 0.09 0.00 0.00 40.66 44.23 1m10 h LEU 694 CO -0.03 0.12 -0.04 0.00 0.09 0.00 0.00 178.44 178.58 1m10 n ASP 696 N -5.38 0.00 -0.10 0.00 10.43 -0.90 -3.17 116.55 117.43 1m10 n ASP 696 Ca 0.13 -0.34 -0.13 0.00 2.57 0.00 0.00 54.79 57.02 1m10 n ASP 696 Cb 0.45 -0.10 -0.12 0.00 1.84 0.00 0.00 41.12 43.19 1m10 n ASP 696 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1m10 n LEU 697 N -1.10 1.70 -4.89 0.64 4.77 0.22 -5.01 117.00 113.34 1m10 n LEU 697 Ca 0.11 -0.07 -0.25 0.00 -0.03 0.00 0.00 56.01 55.77 1m10 n LEU 697 Cb 0.08 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 40.86 1m10 n LEU 697 CO 0.11 0.70 -0.14 0.00 -1.33 0.00 0.00 177.39 176.73 1m10 s ALA 698 N -2.45 3.79 0.48 -1.18 0.00 -0.91 -4.91 121.76 116.58 1m10 s ALA 698 Ca -0.22 -1.16 -0.22 0.00 0.00 0.00 0.00 51.96 50.36 1m10 s ALA 698 Cb 0.07 -1.58 -0.07 0.00 0.00 0.00 0.00 23.12 21.54 1m10 s ALA 698 CO 0.62 0.45 1.16 -2.14 0.00 0.00 0.00 175.76 175.85 1m10 s PRO 699 N -3.36 3.66 0.97 0.00 0.02 -1.26 -4.84 135.00 130.18 1m10 s PRO 699 Ca 0.33 1.75 -0.13 0.00 0.02 0.00 0.00 61.00 62.97 1m10 s PRO 699 Cb -0.10 -2.32 0.05 0.00 0.02 0.00 0.00 34.50 32.15 1m10 s PRO 699 CO 0.26 -0.63 0.38 -1.91 -0.33 0.00 0.00 177.00 174.78 1m10 n GLU 700 N -0.67 -0.46 -4.40 5.54 2.13 -1.26 -1.44 120.64 120.08 1m10 n GLU 700 Ca 0.08 -0.09 -0.19 0.00 0.66 0.00 0.00 57.16 57.62 1m10 n GLU 700 Cb 0.49 -1.85 -0.14 0.00 0.27 0.00 0.00 31.44 30.20 1m10 n GLU 700 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1m10 s ALA 701 N -2.38 0.86 -0.10 4.31 0.00 -1.14 -4.17 121.76 119.13 1m10 s ALA 701 Ca 0.57 -0.49 -0.15 0.00 0.00 0.00 0.00 51.96 51.90 1m10 s ALA 701 Cb -0.20 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 1m10 s ALA 701 CO 0.67 0.20 0.36 -1.25 0.00 0.00 0.00 175.76 175.74 1m10 s PRO 702 N -0.39 4.11 0.00 0.00 0.04 -1.26 -4.84 135.00 132.66 1m10 s PRO 702 Ca 0.03 0.26 0.06 0.00 0.04 0.00 0.00 61.00 61.39 1m10 s PRO 702 Cb -0.05 -3.35 0.36 0.00 0.04 0.00 0.00 34.50 31.50 1m10 s PRO 702 CO -0.00 0.40 0.82 -2.30 0.04 0.00 0.00 177.00 175.96