#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d20 n GLU 502 N 0.00 0.00 0.00 0.00 2.13 -1.26 -3.86 120.64 117.64 2d20 n GLU 502 Ca 0.00 -0.06 0.10 0.00 0.66 0.00 0.00 57.16 57.86 2d20 n GLU 502 Cb 0.00 -0.33 -0.06 0.00 0.27 0.00 0.00 31.44 31.32 2d20 n GLU 502 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2d20 n SER 503 N 0.00 1.41 -4.27 4.31 3.41 -1.26 -4.85 113.62 112.37 2d20 n SER 503 Ca 0.00 -1.20 -0.19 0.00 -0.26 0.00 0.00 58.87 57.22 2d20 n SER 503 Cb 0.29 0.74 -0.11 0.00 -0.26 0.00 0.00 64.21 64.87 2d20 n SER 503 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2d20 s THR 504 N -2.55 1.46 0.11 6.66 -4.23 -1.26 -5.06 115.64 110.77 2d20 s THR 504 Ca 0.12 -1.82 -0.21 0.00 -1.18 0.00 0.00 61.69 58.60 2d20 s THR 504 Cb 0.15 -1.66 -0.09 0.00 1.34 0.00 0.00 72.50 72.25 2d20 s THR 504 CO 0.65 -0.43 1.76 -0.07 -0.54 0.00 0.00 174.62 175.99 2d20 h LEU 505 N 3.34 0.12 -0.34 4.79 3.38 -1.87 -1.17 115.31 123.55 2d20 h LEU 505 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2d20 h LEU 505 Cb 1.20 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2d20 h LEU 505 CO 0.52 0.09 0.21 1.23 0.09 0.00 0.00 178.44 180.59 2d20 h GLY 506 N 0.16 0.49 1.20 0.83 0.00 -1.01 -0.64 103.07 104.10 2d20 h GLY 506 Ca 0.06 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.13 2d20 h GLY 506 CO -0.03 0.19 0.17 0.00 0.00 0.00 0.00 176.54 176.86 2d20 h ALA 507 N 1.10 1.09 -0.44 3.60 0.00 -1.81 -0.75 119.26 122.05 2d20 h ALA 507 Ca 0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2d20 h ALA 507 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2d20 h ALA 507 CO -0.02 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.80 2d20 h ALA 508 N 1.22 0.60 -0.48 0.00 0.00 -0.93 -2.72 119.26 116.95 2d20 h ALA 508 Ca 0.21 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2d20 h ALA 508 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2d20 h ALA 508 CO -0.00 0.43 0.10 0.00 0.00 0.00 0.00 179.25 179.77 2d20 h ALA 509 N 0.89 1.28 0.00 0.00 0.00 -0.85 -1.81 119.26 118.78 2d20 h ALA 509 Ca 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2d20 h ALA 509 Cb 0.55 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2d20 h ALA 509 CO 0.03 0.50 -0.01 0.00 0.00 0.00 0.00 179.25 179.77 2d20 h ALA 510 N 1.41 1.11 0.00 0.00 0.00 -0.73 -0.30 119.26 120.74 2d20 h ALA 510 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2d20 h ALA 510 Cb 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2d20 h ALA 510 CO 0.00 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.30 2d20 n GLN 511 N -3.25 0.03 -0.09 0.00 6.02 -0.68 -1.66 117.38 117.75 2d20 n GLN 511 Ca -0.03 0.29 0.07 0.00 -0.01 0.00 0.00 57.00 57.33 2d20 n GLN 511 Cb 0.11 -1.56 0.10 0.00 1.02 0.00 0.00 30.24 29.91 2d20 n GLN 511 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2d20 n SER 512 N -1.61 2.03 -0.60 1.08 3.41 -0.21 -4.96 113.62 112.75 2d20 n SER 512 Ca 0.03 -2.74 -0.08 0.00 -0.26 0.00 0.00 58.87 55.83 2d20 n SER 512 Cb 0.17 -0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 2d20 n SER 512 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d20 n GLY 513 N -1.10 0.98 3.78 5.00 0.00 -0.67 -5.02 105.19 108.17 2d20 n GLY 513 Ca 0.11 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.18 2d20 n GLY 513 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d20 s ARG 514 N -2.64 2.21 0.32 1.61 0.52 -0.66 -4.96 118.95 115.36 2d20 s ARG 514 Ca 0.00 -2.04 0.10 0.00 -0.52 0.00 0.00 55.73 53.27 2d20 s ARG 514 Cb 0.00 -1.89 -0.06 0.00 0.52 0.00 0.00 34.95 33.52 2d20 s ARG 514 CO 0.00 -0.31 -0.12 1.52 0.02 0.00 0.00 175.30 176.41 2d20 s TYR 515 N -2.72 2.38 -0.15 -0.53 -0.85 -1.13 -2.33 117.35 112.03 2d20 s TYR 515 Ca 0.30 -0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 56.38 2d20 s TYR 515 Cb 0.02 -1.27 0.05 0.00 0.38 0.00 0.00 41.96 41.14 2d20 s TYR 515 CO 0.17 0.62 0.03 0.12 -1.52 0.00 0.00 175.55 174.97 2d20 s PHE 516 N -2.57 0.75 0.34 -3.49 2.19 -1.26 -2.24 117.98 111.71 2d20 s PHE 516 Ca 0.32 -0.52 0.00 0.00 0.33 0.00 0.00 56.93 57.06 2d20 s PHE 516 Cb 0.00 -0.89 0.00 0.00 -1.31 0.00 0.00 43.02 40.83 2d20 s PHE 516 CO 0.16 -0.49 0.01 0.41 1.83 0.00 0.00 175.22 177.14 2d20 n GLY 517 N 5.12 3.74 3.40 13.12 0.00 0.10 -1.85 105.19 128.83 2d20 n GLY 517 Ca -0.08 -2.32 -0.11 0.00 0.00 0.00 0.00 46.02 43.52 2d20 n GLY 517 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2d20 s THR 518 N -2.21 0.00 -0.14 2.61 -1.32 -0.88 -1.08 115.64 112.63 2d20 s THR 518 Ca 0.01 -1.70 -0.14 0.00 -1.21 0.00 0.00 61.69 58.65 2d20 s THR 518 Cb -0.00 -2.37 -0.05 0.00 -1.51 0.00 0.00 72.50 68.57 2d20 s THR 518 CO 0.00 0.00 0.31 0.00 -2.21 0.00 0.00 174.62 172.73 2d20 s ALA 519 N -4.00 3.61 -0.10 11.08 0.00 -1.08 -1.58 121.76 129.69 2d20 s ALA 519 Ca 0.31 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.85 2d20 s ALA 519 Cb 0.03 -2.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.73 2d20 s ALA 519 CO 0.12 0.15 -0.07 0.42 0.00 0.00 0.00 175.76 176.38 2d20 s ILE 520 N 0.24 3.68 -0.22 0.00 -1.09 0.55 -4.18 121.20 120.18 2d20 s ILE 520 Ca 0.18 -0.47 -0.06 0.00 -2.23 0.00 0.00 60.65 58.07 2d20 s ILE 520 Cb -0.13 -2.54 -0.03 0.00 -1.58 0.00 0.00 42.46 38.18 2d20 s ILE 520 CO 0.05 0.56 0.03 0.00 -1.23 0.00 0.00 174.94 174.36 2d20 s ALA 521 N -0.39 3.10 0.36 9.38 0.00 -1.26 -1.21 121.76 131.74 2d20 s ALA 521 Ca 0.06 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 51.05 2d20 s ALA 521 Cb -0.12 -1.91 0.78 0.00 0.00 0.00 0.00 23.12 21.87 2d20 s ALA 521 CO 0.02 -0.28 1.93 0.66 0.00 0.00 0.00 175.76 178.09 2d20 h SER 522 N 7.78 0.65 0.53 0.00 4.64 -1.97 -1.67 113.55 123.51 2d20 h SER 522 Ca -0.37 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2d20 h SER 522 Cb 1.17 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2d20 h SER 522 CO 0.60 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 2d20 n GLY 523 N -1.45 -1.03 0.61 -0.77 0.00 -1.26 -2.54 105.19 98.75 2d20 n GLY 523 Ca 0.13 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.18 2d20 n GLY 523 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d20 n LYS 524 N -1.47 1.51 0.00 1.61 5.02 -0.63 -4.48 118.16 119.72 2d20 n LYS 524 Ca 0.04 -1.33 0.06 0.00 -2.02 0.00 0.00 58.31 55.06 2d20 n LYS 524 Cb 0.18 -1.33 0.26 0.00 -0.02 0.00 0.00 35.03 34.13 2d20 n LYS 524 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2d20 n LEU 525 N 0.66 0.00 -0.49 -0.35 4.77 -1.05 -1.34 117.00 119.19 2d20 n LEU 525 Ca 0.09 0.48 0.14 0.00 -0.03 0.00 0.00 56.01 56.69 2d20 n LEU 525 Cb 0.42 -0.48 0.45 0.00 -2.33 0.00 0.00 43.42 41.47 2d20 n LEU 525 CO 0.14 -0.28 0.80 0.61 -1.33 0.00 0.00 177.39 177.32 2d20 n GLY 526 N -0.26 -0.00 3.45 -0.72 0.00 -1.26 -4.76 105.19 101.64 2d20 n GLY 526 Ca 0.03 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 45.15 2d20 n GLY 526 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d20 s ASP 527 N -2.10 6.24 0.33 1.61 -1.08 -0.45 -4.96 116.67 116.27 2d20 s ASP 527 Ca 0.34 -0.86 0.05 0.00 -0.52 0.00 0.00 52.55 51.56 2d20 s ASP 527 Cb 0.21 -2.33 0.69 0.00 -1.46 0.00 0.00 42.92 40.02 2d20 s ASP 527 CO 0.37 -1.03 1.89 0.28 0.52 0.00 0.00 175.17 177.20 2d20 h SER 528 N 9.13 0.76 -0.60 -0.34 0.02 -1.86 -1.25 113.55 119.41 2d20 h SER 528 Ca -0.28 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.60 2d20 h SER 528 Cb 1.09 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 2d20 h SER 528 CO 1.02 0.44 -0.01 0.00 -1.14 0.00 0.00 176.83 177.14 2d20 h ALA 529 N 1.57 0.83 0.56 3.77 0.00 -1.95 -1.14 119.26 122.90 2d20 h ALA 529 Ca 0.41 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2d20 h ALA 529 Cb 0.46 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2d20 h ALA 529 CO -0.18 0.67 -0.27 -0.92 0.00 0.00 0.00 179.25 178.56 2d20 h TYR 530 N 0.97 -0.70 -0.07 0.00 3.20 -1.61 -2.90 116.97 115.88 2d20 h TYR 530 Ca 0.17 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2d20 h TYR 530 Cb 0.58 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 2d20 h TYR 530 CO 0.04 -0.38 -0.25 1.79 -1.64 0.00 0.00 178.16 177.72 2d20 h THR 531 N -0.89 1.21 -0.27 1.81 1.35 -1.28 -1.09 112.91 113.75 2d20 h THR 531 Ca -0.08 -0.98 -0.01 0.00 -0.55 0.00 0.00 66.41 64.79 2d20 h THR 531 Cb 0.62 1.44 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 2d20 h THR 531 CO 0.13 0.29 0.14 0.74 -0.25 0.00 0.00 175.52 176.56 2d20 h THR 532 N 0.11 1.14 -0.01 6.82 2.02 -1.18 0.13 112.91 121.93 2d20 h THR 532 Ca 0.02 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 2d20 h THR 532 Cb 0.50 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 2d20 h THR 532 CO 0.04 0.14 -0.00 0.40 0.37 0.00 0.00 175.52 176.46 2d20 h ILE 533 N 0.31 1.30 -0.42 3.11 2.04 -1.29 -2.71 117.51 119.85 2d20 h ILE 533 Ca 0.09 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.09 2d20 h ILE 533 Cb 0.10 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 2d20 h ILE 533 CO -0.01 0.23 0.24 0.00 0.00 0.00 0.00 178.15 178.61 2d20 h ALA 534 N 0.64 0.53 -0.42 1.87 0.00 -1.13 -0.98 119.26 119.76 2d20 h ALA 534 Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2d20 h ALA 534 Cb 0.38 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2d20 h ALA 534 CO 0.00 -0.10 -0.13 1.03 0.00 0.00 0.00 179.25 180.05 2d20 h SER 535 N 0.48 0.76 -0.12 0.00 0.87 -1.04 -2.89 113.55 111.62 2d20 h SER 535 Ca 0.17 -0.23 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 2d20 h SER 535 Cb 0.03 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.78 2d20 h SER 535 CO -0.09 0.91 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.83 2d20 h ARG 536 N 0.69 0.34 0.00 2.24 2.43 -1.18 -3.38 114.38 115.52 2d20 h ARG 536 Ca 0.11 -0.21 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 2d20 h ARG 536 Cb 0.61 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2d20 h ARG 536 CO 0.04 0.80 -0.91 0.93 -1.51 0.00 0.00 179.97 179.32 2d20 h GLU 537 N -0.08 0.00 -6.69 0.20 4.39 -1.23 -3.45 114.58 107.71 2d20 h GLU 537 Ca 0.01 0.00 -0.69 0.00 0.34 0.00 0.00 59.36 59.02 2d20 h GLU 537 Cb 0.77 0.00 -0.25 0.00 -0.10 0.00 0.00 28.75 29.17 2d20 h GLU 537 CO 0.05 0.10 -0.86 -0.06 -1.16 0.00 0.00 179.01 177.07 2d20 s PHE 538 N -3.22 2.38 -0.19 4.33 0.08 -1.09 -0.50 117.98 119.78 2d20 s PHE 538 Ca 0.00 -0.37 0.09 0.00 0.12 0.00 0.00 56.93 56.77 2d20 s PHE 538 Cb 0.09 -1.41 0.19 0.00 -0.57 0.00 0.00 43.02 41.31 2d20 s PHE 538 CO 0.77 0.15 1.13 0.27 -0.10 0.00 0.00 175.22 177.45 2d20 n ASN 539 N 1.75 2.44 -3.81 1.36 0.23 -0.77 -4.82 115.26 111.64 2d20 n ASN 539 Ca -0.17 -2.46 -0.13 0.00 -0.53 0.00 0.00 54.58 51.30 2d20 n ASN 539 Cb 0.52 -0.23 -0.13 0.00 -2.08 0.00 0.00 39.78 37.86 2d20 n ASN 539 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 2d20 s MET 540 N -1.80 0.17 -0.02 -3.83 0.00 -1.24 -2.02 119.30 110.57 2d20 s MET 540 Ca 0.18 0.24 0.04 0.00 0.00 0.00 0.00 55.69 56.15 2d20 s MET 540 Cb 0.14 0.05 -0.01 0.00 0.00 0.00 0.00 34.83 35.02 2d20 s MET 540 CO 0.04 -0.04 -0.12 0.08 0.00 0.00 0.00 175.02 174.98 2d20 s VAL 541 N 0.24 1.00 -0.06 10.11 1.01 -0.30 -2.06 120.40 130.33 2d20 s VAL 541 Ca -0.01 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.48 2d20 s VAL 541 Cb -0.02 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.51 2d20 s VAL 541 CO -0.01 0.29 -0.18 -0.89 0.00 0.00 0.00 175.10 174.31 2d20 s THR 542 N -0.17 1.55 -0.05 3.92 2.01 -0.61 -0.87 115.64 121.41 2d20 s THR 542 Ca 0.03 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 60.97 2d20 s THR 542 Cb -0.06 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2d20 s THR 542 CO -0.00 0.44 1.23 0.00 -0.69 0.00 0.00 174.62 175.61 2d20 s ALA 543 N 0.23 3.51 0.29 7.40 0.00 -1.26 -0.33 121.76 131.59 2d20 s ALA 543 Ca -0.09 0.66 -0.03 0.00 0.00 0.00 0.00 51.96 52.51 2d20 s ALA 543 Cb -0.14 -3.53 0.41 0.00 0.00 0.00 0.00 23.12 19.86 2d20 s ALA 543 CO 0.04 -0.79 1.95 1.49 0.00 0.00 0.00 175.76 178.45 2d20 h GLU 544 N 7.52 1.10 0.00 0.00 4.81 -1.49 -3.40 114.58 123.12 2d20 h GLU 544 Ca -0.35 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2d20 h GLU 544 Cb 1.16 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.30 2d20 h GLU 544 CO 0.88 0.75 0.00 0.09 -0.73 0.00 0.00 179.01 180.00 2d20 n ASN 545 N -4.39 0.00 0.23 1.04 3.02 -1.26 -4.94 115.26 108.95 2d20 n ASN 545 Ca 0.09 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.80 2d20 n ASN 545 Cb 0.04 0.00 0.82 0.00 -0.61 0.00 0.00 39.78 40.04 2d20 n ASN 545 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2d20 h GLU 546 N 0.00 0.00 -0.30 3.52 3.07 -1.89 -2.48 114.58 116.51 2d20 h GLU 546 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2d20 h GLU 546 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2d20 h GLU 546 CO 0.00 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.28 2d20 n MET 547 N -2.59 2.87 -1.57 2.33 2.81 -1.25 -3.30 117.12 116.41 2d20 n MET 547 Ca -0.02 -2.18 -0.29 0.00 -1.81 0.00 0.00 57.70 53.40 2d20 n MET 547 Cb 0.07 -1.37 0.17 0.00 -0.71 0.00 0.00 33.22 31.38 2d20 n MET 547 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2d20 s LYS 548 N -1.41 0.51 0.14 0.03 1.02 -0.93 -3.41 119.74 115.68 2d20 s LYS 548 Ca 0.25 -0.00 -0.17 0.00 0.02 0.00 0.00 55.97 56.07 2d20 s LYS 548 Cb 0.16 -1.79 -0.01 0.00 -0.52 0.00 0.00 37.83 35.67 2d20 s LYS 548 CO 0.13 -2.57 1.78 0.82 -0.92 0.00 0.00 175.35 174.59 2d20 h ILE 549 N -1.76 1.11 -0.28 2.17 2.04 -1.79 -1.78 117.51 117.22 2d20 h ILE 549 Ca -0.47 -0.24 -0.08 0.00 1.00 0.00 0.00 64.86 65.07 2d20 h ILE 549 Cb 1.30 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2d20 h ILE 549 CO 0.49 0.11 -0.15 -2.24 0.00 0.00 0.00 178.15 176.36 2d20 h ASP 550 N 0.48 0.48 0.79 1.72 2.03 -1.83 -1.20 116.42 118.89 2d20 h ASP 550 Ca 0.13 -0.13 -0.15 0.00 -0.73 0.00 0.00 57.03 56.14 2d20 h ASP 550 Cb -0.02 -0.13 -0.02 0.00 -0.83 0.00 0.00 39.33 38.33 2d20 h ASP 550 CO -0.03 0.66 -0.72 0.00 -1.03 0.00 0.00 179.24 178.12 2d20 h ALA 551 N 1.39 0.76 0.00 4.15 0.00 -1.77 -3.26 119.26 120.52 2d20 h ALA 551 Ca 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2d20 h ALA 551 Cb 0.53 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2d20 h ALA 551 CO 0.03 0.91 -1.72 0.25 0.00 0.00 0.00 179.25 178.72 2d20 n THR 552 N -3.61 0.09 -3.15 0.00 -2.24 -0.69 -4.61 114.28 100.07 2d20 n THR 552 Ca -0.01 -0.45 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 2d20 n THR 552 Cb 0.72 0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.95 2d20 n THR 552 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2d20 n GLU 553 N -2.23 0.61 0.18 -0.78 2.13 -0.47 -0.43 120.64 119.65 2d20 n GLU 553 Ca -0.02 -2.95 0.16 0.00 0.66 0.00 0.00 57.16 55.00 2d20 n GLU 553 Cb 0.54 -1.34 0.76 0.00 0.27 0.00 0.00 31.44 31.66 2d20 n GLU 553 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 2d20 h PRO 554 N 4.35 0.00 -4.48 5.31 0.13 -1.60 -3.42 132.00 132.29 2d20 h PRO 554 Ca 0.08 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.95 2d20 h PRO 554 Cb 0.92 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.84 2d20 h PRO 554 CO 0.41 0.00 -0.73 -0.65 -0.23 0.00 0.00 178.00 176.80 2d20 s GLN 555 N -4.83 0.51 -0.04 0.86 -1.52 -1.25 -4.84 119.66 108.55 2d20 s GLN 555 Ca -0.05 -0.76 -0.32 0.00 -1.95 0.00 0.00 55.36 52.28 2d20 s GLN 555 Cb 0.17 -0.23 -0.10 0.00 -0.22 0.00 0.00 33.01 32.63 2d20 s GLN 555 CO 0.62 0.03 1.93 -2.13 -0.25 0.00 0.00 175.29 175.50 2d20 n ARG 556 N 1.42 2.47 -0.46 2.91 0.63 -1.26 -0.98 116.66 121.40 2d20 n ARG 556 Ca -0.23 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.61 2d20 n ARG 556 Cb 0.55 -2.81 0.00 0.00 0.45 0.00 0.00 32.46 30.64 2d20 n ARG 556 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2d20 n GLY 557 N 4.51 1.50 3.16 5.14 0.00 -1.26 -4.99 105.19 113.26 2d20 n GLY 557 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 2d20 n GLY 557 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2d20 s GLN 558 N -0.21 2.20 0.29 1.61 0.74 -0.15 -5.08 119.66 119.05 2d20 s GLN 558 Ca 0.00 -1.79 -0.16 0.00 0.05 0.00 0.00 55.36 53.45 2d20 s GLN 558 Cb 0.00 -3.72 -0.09 0.00 1.10 0.00 0.00 33.01 30.30 2d20 s GLN 558 CO 0.00 -1.12 0.72 -0.06 -0.55 0.00 0.00 175.29 174.28 2d20 s PHE 559 N 1.23 3.46 -0.06 1.67 0.08 -1.26 -3.47 117.98 119.63 2d20 s PHE 559 Ca 0.07 1.26 -0.03 0.00 0.12 0.00 0.00 56.93 58.35 2d20 s PHE 559 Cb -0.24 -2.55 0.04 0.00 -0.57 0.00 0.00 43.02 39.70 2d20 s PHE 559 CO -0.03 0.18 0.11 1.21 -0.10 0.00 0.00 175.22 176.59 2d20 s ASN 560 N -2.08 0.92 -0.14 1.36 3.84 0.42 -4.96 114.94 114.30 2d20 s ASN 560 Ca 0.50 0.20 0.17 0.00 0.21 0.00 0.00 52.86 53.95 2d20 s ASN 560 Cb -0.12 0.06 0.39 0.00 -0.55 0.00 0.00 41.25 41.03 2d20 s ASN 560 CO 0.19 -0.24 1.27 0.49 -2.79 0.00 0.00 177.10 176.01 2d20 n PHE 561 N 5.27 0.44 -0.32 0.43 3.72 -1.26 -4.08 117.46 121.67 2d20 n PHE 561 Ca -0.05 -0.91 -0.02 0.00 -0.05 0.00 0.00 57.45 56.42 2d20 n PHE 561 Cb 0.50 -0.22 0.13 0.00 -0.94 0.00 0.00 39.48 38.96 2d20 n PHE 561 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2d20 h SER 562 N 0.88 1.07 0.02 4.37 4.64 -1.95 0.97 113.55 123.55 2d20 h SER 562 Ca 0.00 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 2d20 h SER 562 Cb 1.17 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2d20 h SER 562 CO 0.10 0.82 -0.16 0.00 -0.87 0.00 0.00 176.83 176.72 2d20 h ALA 563 N 1.36 -0.01 -0.78 5.18 0.00 -1.86 -3.24 119.26 119.91 2d20 h ALA 563 Ca 0.32 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.73 2d20 h ALA 563 Cb -0.06 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2d20 h ALA 563 CO -0.06 0.05 0.52 0.78 0.00 0.00 0.00 179.25 180.54 2d20 h GLY 564 N -0.80 1.10 2.00 0.00 0.00 -1.53 -2.78 103.07 101.06 2d20 h GLY 564 Ca -0.03 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 2d20 h GLY 564 CO 0.03 0.41 -0.29 -0.55 0.00 0.00 0.00 176.54 176.14 2d20 h ASP 565 N 1.06 0.00 -0.65 0.19 3.32 -0.94 -0.20 116.42 119.20 2d20 h ASP 565 Ca 0.29 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.25 2d20 h ASP 565 Cb -0.12 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2d20 h ASP 565 CO -0.06 0.29 0.07 0.03 -1.72 0.00 0.00 179.24 177.85 2d20 h ARG 566 N 0.00 1.11 -0.09 3.56 3.08 -1.51 0.42 114.38 120.95 2d20 h ARG 566 Ca -0.00 -0.32 -0.05 0.00 0.07 0.00 0.00 59.98 59.68 2d20 h ARG 566 Cb 0.55 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2d20 h ARG 566 CO 0.04 1.04 -0.13 0.28 -1.07 0.00 0.00 179.97 180.13 2d20 h VAL 567 N 1.03 1.38 -0.23 2.04 2.07 -1.39 -2.62 116.25 118.52 2d20 h VAL 567 Ca 0.19 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 66.40 2d20 h VAL 567 Cb 0.49 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 32.28 2d20 h VAL 567 CO 0.02 0.38 0.05 0.22 0.02 0.00 0.00 177.57 178.26 2d20 h TYR 568 N -0.18 0.09 -0.58 1.57 3.20 -0.85 -1.14 116.97 119.08 2d20 h TYR 568 Ca 0.01 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.94 2d20 h TYR 568 Cb 0.67 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 2d20 h TYR 568 CO 0.10 0.03 0.32 -0.91 -1.64 0.00 0.00 178.16 176.06 2d20 h ASN 569 N 0.14 0.50 -0.40 -2.11 2.35 -0.20 -1.52 115.58 114.35 2d20 h ASN 569 Ca 0.10 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 2d20 h ASN 569 Cb 0.10 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 2d20 h ASN 569 CO -0.13 0.34 0.25 -0.25 -1.65 0.00 0.00 177.43 175.98 2d20 h TRP 570 N 0.63 0.51 0.51 1.19 7.01 -1.13 -0.30 115.95 124.37 2d20 h TRP 570 Ca 0.25 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.23 2d20 h TRP 570 Cb 0.10 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 2d20 h TRP 570 CO -0.08 0.35 -0.36 0.00 -2.79 0.00 0.00 178.44 175.57 2d20 h ALA 571 N 1.12 -0.86 -0.85 2.65 0.00 -0.70 -1.87 119.26 118.74 2d20 h ALA 571 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2d20 h ALA 571 Cb -0.02 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2d20 h ALA 571 CO -0.03 -1.01 0.45 -0.39 0.00 0.00 0.00 179.25 178.27 2d20 h VAL 572 N -0.84 1.25 0.00 0.00 -1.51 -1.23 0.30 116.25 114.22 2d20 h VAL 572 Ca -0.06 -0.65 -0.00 0.00 -1.23 0.00 0.00 66.70 64.76 2d20 h VAL 572 Cb 0.71 0.12 -0.00 0.00 -2.13 0.00 0.00 31.29 29.99 2d20 h VAL 572 CO 0.02 0.29 -0.02 -0.61 -1.23 0.00 0.00 177.57 176.02 2d20 h GLN 573 N 1.19 0.00 -0.48 5.19 5.75 -0.91 -2.10 115.11 123.75 2d20 h GLN 573 Ca 0.30 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.71 2d20 h GLN 573 Cb 0.05 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.55 2d20 h GLN 573 CO -0.04 0.02 0.08 0.09 -2.65 0.00 0.00 178.83 176.32 2d20 n ASN 574 N -4.42 4.37 -0.91 -0.69 3.02 -0.60 -4.97 115.26 111.07 2d20 n ASN 574 Ca -0.03 -3.16 -0.11 0.00 -0.03 0.00 0.00 54.58 51.25 2d20 n ASN 574 Cb 0.11 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 38.60 2d20 n ASN 574 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d20 n GLY 575 N -0.27 0.86 3.80 7.41 0.00 -0.79 -5.02 105.19 111.18 2d20 n GLY 575 Ca 0.30 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 2d20 n GLY 575 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d20 s LYS 576 N -3.33 2.97 0.72 1.61 3.01 -0.00 -4.90 119.74 119.81 2d20 s LYS 576 Ca 0.00 -0.70 -0.04 0.00 -1.01 0.00 0.00 55.97 54.21 2d20 s LYS 576 Cb 0.00 -2.75 0.10 0.00 -1.01 0.00 0.00 37.83 34.17 2d20 s LYS 576 CO 0.00 0.55 1.01 -0.65 0.51 0.00 0.00 175.35 176.77 2d20 s GLN 577 N -2.61 1.84 -0.01 1.68 -0.21 -0.86 -3.90 119.66 115.59 2d20 s GLN 577 Ca 0.30 -0.69 0.04 0.00 0.02 0.00 0.00 55.36 55.03 2d20 s GLN 577 Cb -0.12 -2.24 -0.01 0.00 1.00 0.00 0.00 33.01 31.64 2d20 s GLN 577 CO 0.23 -1.39 -0.11 0.08 -2.12 0.00 0.00 175.29 171.97 2d20 s VAL 578 N -3.21 0.90 -0.22 1.09 1.01 -1.26 -1.15 120.40 117.55 2d20 s VAL 578 Ca 0.64 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 62.06 2d20 s VAL 578 Cb -0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 2d20 s VAL 578 CO 0.45 0.25 0.04 -0.13 0.00 0.00 0.00 175.10 175.71 2d20 s ARG 579 N -0.28 3.67 0.19 2.72 0.52 -0.05 -1.54 118.95 124.18 2d20 s ARG 579 Ca 0.04 -0.48 -0.29 0.00 -0.52 0.00 0.00 55.73 54.49 2d20 s ARG 579 Cb -0.04 -3.22 -0.08 0.00 0.52 0.00 0.00 34.95 32.13 2d20 s ARG 579 CO -0.00 -0.06 0.90 0.20 0.02 0.00 0.00 175.30 176.36 2d20 s GLY 580 N 1.24 3.04 -0.22 -3.53 0.00 0.17 -4.14 107.32 103.87 2d20 s GLY 580 Ca 0.04 0.54 -0.08 0.00 0.00 0.00 0.00 44.72 45.22 2d20 s GLY 580 CO 0.03 1.18 0.48 -1.58 0.00 0.00 0.00 173.10 173.21 2d20 s HIS 581 N -0.85 -0.92 0.01 1.90 5.04 -1.26 -0.50 115.29 118.70 2d20 s HIS 581 Ca 0.41 1.73 0.01 0.00 -1.54 0.00 0.00 55.06 55.67 2d20 s HIS 581 Cb -0.25 0.44 -0.01 0.00 0.04 0.00 0.00 32.58 32.80 2d20 s HIS 581 CO 0.30 -0.52 -0.03 0.99 -2.34 0.00 0.00 174.74 173.14 2d20 s THR 582 N 2.54 0.24 0.06 0.89 2.01 -1.22 -3.24 115.64 116.92 2d20 s THR 582 Ca -0.04 -0.42 -0.10 0.00 0.31 0.00 0.00 61.69 61.44 2d20 s THR 582 Cb -0.11 -0.26 -0.30 0.00 0.01 0.00 0.00 72.50 71.84 2d20 s THR 582 CO -0.15 -0.13 1.11 -0.07 -0.69 0.00 0.00 174.62 174.69 2d20 h LEU 583 N 5.54 0.65 -6.82 4.42 3.38 -1.44 -3.35 115.31 117.69 2d20 h LEU 583 Ca -0.29 -0.66 -0.21 0.00 0.09 0.00 0.00 57.88 56.82 2d20 h LEU 583 Cb 1.20 -0.21 -0.32 0.00 0.09 0.00 0.00 40.66 41.43 2d20 h LEU 583 CO 0.47 1.50 -0.52 0.00 0.09 0.00 0.00 178.44 179.98 2d20 s ALA 584 N -2.75 -0.74 0.24 1.53 0.00 0.04 -4.70 121.76 115.38 2d20 s ALA 584 Ca -0.07 0.81 -0.22 0.00 0.00 0.00 0.00 51.96 52.48 2d20 s ALA 584 Cb 0.06 -1.37 0.04 0.00 0.00 0.00 0.00 23.12 21.85 2d20 s ALA 584 CO 0.91 -1.03 0.83 1.67 0.00 0.00 0.00 175.76 178.15 2d20 s TRP 585 N 2.46 -0.13 -0.09 0.00 1.48 -1.26 -3.25 118.94 118.15 2d20 s TRP 585 Ca 0.06 -0.29 0.21 0.00 -1.06 0.00 0.00 56.10 55.02 2d20 s TRP 585 Cb -0.14 0.70 0.51 0.00 -1.16 0.00 0.00 33.47 33.37 2d20 s TRP 585 CO -0.13 -1.10 1.65 1.12 -4.06 0.00 0.00 176.95 174.43 2d20 h HIS 586 N 2.00 0.00 -3.15 1.66 2.07 -1.89 -3.46 115.15 112.39 2d20 h HIS 586 Ca -0.22 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.77 2d20 h HIS 586 Cb 1.24 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.21 2d20 h HIS 586 CO 0.54 0.27 -0.19 0.45 -3.07 0.00 0.00 177.93 175.92 2d20 s SER 587 N -6.27 6.45 -1.43 3.10 0.15 -1.26 -4.39 113.70 110.05 2d20 s SER 587 Ca 0.03 0.66 -0.10 0.00 0.70 0.00 0.00 55.95 57.23 2d20 s SER 587 Cb 0.08 -2.12 0.07 0.00 -1.71 0.00 0.00 66.02 62.34 2d20 s SER 587 CO 0.68 -0.13 0.69 0.00 1.20 0.00 0.00 173.24 175.68 2d20 n GLN 588 N -0.72 -4.41 -2.78 5.44 6.02 -1.26 -4.87 117.38 114.80 2d20 n GLN 588 Ca -0.02 0.60 -0.37 0.00 -0.01 0.00 0.00 57.00 57.19 2d20 n GLN 588 Cb 0.54 -5.40 -0.06 0.00 1.02 0.00 0.00 30.24 26.33 2d20 n GLN 588 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2d20 s GLN 589 N -6.19 4.59 0.66 -1.09 -0.21 -1.26 -3.15 119.66 113.02 2d20 s GLN 589 Ca 0.48 1.33 -0.15 0.00 0.02 0.00 0.00 55.36 57.05 2d20 s GLN 589 Cb -0.24 -2.82 0.00 0.00 1.00 0.00 0.00 33.01 30.95 2d20 s GLN 589 CO 0.60 0.29 1.11 -1.25 -2.12 0.00 0.00 175.29 173.91 2d20 s PRO 590 N -2.02 2.79 0.30 2.91 0.04 -1.26 -4.75 135.00 133.00 2d20 s PRO 590 Ca 0.50 1.38 0.05 0.00 0.04 0.00 0.00 61.00 62.96 2d20 s PRO 590 Cb -0.19 -1.95 0.76 0.00 0.04 0.00 0.00 34.50 33.16 2d20 s PRO 590 CO 0.24 -1.26 1.69 0.78 0.04 0.00 0.00 177.00 178.49 2d20 h GLY 591 N -0.02 1.58 2.00 0.56 0.00 -1.95 -0.51 103.07 104.73 2d20 h GLY 591 Ca -0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 2d20 h GLY 591 CO 0.54 -0.29 -0.10 0.11 0.00 0.00 0.00 176.54 176.80 2d20 h TRP 592 N 0.39 0.00 0.03 5.60 5.08 -1.91 -2.34 115.95 122.80 2d20 h TRP 592 Ca 0.58 0.00 -0.27 0.00 1.08 0.00 0.00 58.89 60.28 2d20 h TRP 592 Cb 1.12 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.25 2d20 h TRP 592 CO -0.13 0.10 -1.42 1.98 -1.28 0.00 0.00 178.44 177.69 2d20 h MET 593 N 0.00 0.06 0.00 0.12 4.05 -1.46 -3.27 114.93 114.42 2d20 h MET 593 Ca -0.00 -0.10 -0.03 0.00 -0.28 0.00 0.00 59.70 59.30 2d20 h MET 593 Cb 0.18 0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.02 2d20 h MET 593 CO 0.01 0.82 -0.12 1.96 0.23 0.00 0.00 176.91 179.82 2d20 h GLN 594 N 0.02 0.00 -0.00 0.39 4.20 -0.88 -1.44 115.11 117.40 2d20 h GLN 594 Ca -0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.53 2d20 h GLN 594 Cb 1.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.70 2d20 h GLN 594 CO 0.12 0.12 -0.00 0.43 -0.67 0.00 0.00 178.83 178.82 2d20 n SER 595 N -4.02 0.00 -4.90 1.46 7.64 -0.99 -4.88 113.62 107.93 2d20 n SER 595 Ca -0.02 -0.01 -0.31 0.00 1.01 0.00 0.00 58.87 59.54 2d20 n SER 595 Cb 0.21 -0.33 -0.04 0.00 -1.01 0.00 0.00 64.21 63.03 2d20 n SER 595 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2d20 s LEU 596 N -2.66 4.22 0.24 -3.43 1.43 -0.54 -5.09 118.68 112.84 2d20 s LEU 596 Ca 0.25 0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 53.85 2d20 s LEU 596 Cb 0.20 -3.39 0.00 0.00 0.03 0.00 0.00 46.19 43.04 2d20 s LEU 596 CO 0.48 -0.01 0.50 -0.94 0.23 0.00 0.00 176.35 176.61 2d20 s SER 597 N -2.60 -0.12 0.80 2.29 1.04 -1.26 -4.80 113.70 109.04 2d20 s SER 597 Ca 0.42 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2d20 s SER 597 Cb -0.12 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.60 2d20 s SER 597 CO 0.25 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.94 2d20 n GLY 598 N -0.38 1.51 0.32 7.32 0.00 -1.26 -2.42 105.19 110.29 2d20 n GLY 598 Ca -0.03 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.55 2d20 n GLY 598 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d20 h SER 599 N 7.41 0.37 -0.54 1.61 4.64 -1.97 -0.85 113.55 124.23 2d20 h SER 599 Ca 0.00 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 2d20 h SER 599 Cb 0.00 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 2d20 h SER 599 CO 0.00 0.25 0.09 0.74 -0.87 0.00 0.00 176.83 177.04 2d20 h THR 600 N 0.43 1.25 -0.42 2.95 2.02 -1.97 -1.37 112.91 115.80 2d20 h THR 600 Ca 0.19 -0.95 -0.12 0.00 0.77 0.00 0.00 66.41 66.30 2d20 h THR 600 Cb 0.22 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2d20 h THR 600 CO -0.05 0.34 -0.20 0.25 0.37 0.00 0.00 175.52 176.24 2d20 h LEU 601 N 0.78 0.90 -0.49 2.58 6.46 -1.02 -2.24 115.31 122.27 2d20 h LEU 601 Ca 0.16 -0.40 0.05 0.00 -0.12 0.00 0.00 57.88 57.57 2d20 h LEU 601 Cb 0.40 -0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 40.04 2d20 h LEU 601 CO 0.01 1.10 0.23 -0.09 -0.62 0.00 0.00 178.44 179.07 2d20 h ARG 602 N 0.70 0.44 -0.19 1.25 9.65 -0.88 0.60 114.38 125.94 2d20 h ARG 602 Ca 0.09 -0.03 -0.15 0.00 -1.10 0.00 0.00 59.98 58.80 2d20 h ARG 602 Cb 0.76 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 2d20 h ARG 602 CO 0.06 0.29 -0.51 0.37 2.80 0.00 0.00 179.97 182.98 2d20 h GLN 603 N 0.45 0.54 -0.64 0.20 5.75 -1.22 -2.31 115.11 117.88 2d20 h GLN 603 Ca 0.22 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.37 2d20 h GLN 603 Cb 0.16 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.70 2d20 h GLN 603 CO -0.17 0.92 0.27 0.00 -2.65 0.00 0.00 178.83 177.19 2d20 h ALA 604 N 1.03 1.27 -0.33 3.38 0.00 -0.83 0.33 119.26 124.10 2d20 h ALA 604 Ca 0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2d20 h ALA 604 Cb 1.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2d20 h ALA 604 CO 0.09 0.54 0.10 1.98 0.00 0.00 0.00 179.25 181.97 2d20 h MET 605 N 0.92 0.52 -0.33 0.00 1.85 -0.64 -0.20 114.93 117.04 2d20 h MET 605 Ca 0.22 -0.11 -0.02 0.00 -0.61 0.00 0.00 59.70 59.18 2d20 h MET 605 Cb 0.16 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.10 2d20 h MET 605 CO -0.02 0.55 0.12 0.82 -0.40 0.00 0.00 176.91 177.98 2d20 h ILE 606 N 0.39 1.19 -0.83 1.77 2.04 -0.88 -1.91 117.51 119.28 2d20 h ILE 606 Ca 0.11 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 2d20 h ILE 606 Cb 0.25 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2d20 h ILE 606 CO -0.00 0.21 0.51 0.44 0.00 0.00 0.00 178.15 179.31 2d20 h ASP 607 N 0.39 0.98 -0.25 1.72 3.32 -0.19 -1.72 116.42 120.67 2d20 h ASP 607 Ca 0.11 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2d20 h ASP 607 Cb 0.21 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 2d20 h ASP 607 CO -0.01 0.74 0.05 -0.74 -1.72 0.00 0.00 179.24 177.56 2d20 h HIS 608 N 1.14 0.42 -0.32 4.55 2.76 -0.77 -1.12 115.15 121.81 2d20 h HIS 608 Ca 0.30 -0.05 0.03 0.00 -2.20 0.00 0.00 60.37 58.45 2d20 h HIS 608 Cb -0.07 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 28.74 2d20 h HIS 608 CO 0.00 0.51 0.11 0.82 -1.30 0.00 0.00 177.93 178.07 2d20 h ILE 609 N 0.22 0.91 -0.77 6.26 2.04 -1.02 -1.48 117.51 123.67 2d20 h ILE 609 Ca 0.08 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 2d20 h ILE 609 Cb 0.30 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2d20 h ILE 609 CO 0.00 0.05 0.32 0.78 0.00 0.00 0.00 178.15 179.30 2d20 h ASN 610 N 0.25 1.05 -0.21 1.72 2.35 -1.21 -1.21 115.58 118.32 2d20 h ASN 610 Ca 0.14 -0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 2d20 h ASN 610 Cb 0.11 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 2d20 h ASN 610 CO -0.14 0.92 0.02 1.23 -1.65 0.00 0.00 177.43 177.81 2d20 h GLY 611 N 1.10 0.39 0.57 2.83 0.00 -0.84 -1.10 103.07 106.02 2d20 h GLY 611 Ca 0.26 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 2d20 h GLY 611 CO -0.02 0.25 -0.11 -2.08 0.00 0.00 0.00 176.54 174.57 2d20 h VAL 612 N 0.14 1.42 -0.13 4.60 2.07 -1.24 -2.72 116.25 120.39 2d20 h VAL 612 Ca 0.06 -1.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.10 2d20 h VAL 612 Cb 0.35 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2d20 h VAL 612 CO 0.01 0.39 -0.20 0.24 0.02 0.00 0.00 177.57 178.03 2d20 h MET 613 N -0.33 0.22 -0.72 1.57 2.07 -1.30 -2.54 114.93 113.90 2d20 h MET 613 Ca 0.00 -0.06 -0.06 0.00 -2.07 0.00 0.00 59.70 57.51 2d20 h MET 613 Cb 0.69 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 30.37 2d20 h MET 613 CO 0.02 0.42 0.21 0.78 1.07 0.00 0.00 176.91 179.41 2d20 h GLY 614 N 0.85 1.22 1.23 8.32 0.00 -1.18 0.23 103.07 113.74 2d20 h GLY 614 Ca 0.04 -0.73 -0.06 0.00 0.00 0.00 0.00 47.33 46.57 2d20 h GLY 614 CO 0.03 0.69 0.13 0.84 0.00 0.00 0.00 176.54 178.23 2d20 h HIS 615 N 1.07 0.99 -0.62 5.60 6.17 -1.13 -3.00 115.15 124.23 2d20 h HIS 615 Ca 0.23 -0.11 0.00 0.00 0.71 0.00 0.00 60.37 61.20 2d20 h HIS 615 Cb 0.33 -0.28 0.00 0.00 2.52 0.00 0.00 27.41 29.98 2d20 h HIS 615 CO 0.03 0.83 0.00 0.66 0.71 0.00 0.00 177.93 180.15 2d20 n TYR 616 N -4.25 1.36 -1.67 5.26 4.01 -1.04 -5.02 117.16 115.82 2d20 n TYR 616 Ca 0.04 -0.61 -0.56 0.00 -0.16 0.00 0.00 57.90 56.62 2d20 n TYR 616 Cb 0.25 -0.22 -0.07 0.00 -0.31 0.00 0.00 39.34 39.00 2d20 n TYR 616 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2d20 n LYS 617 N 1.04 1.17 -0.95 -0.72 4.81 0.77 -1.06 118.16 123.23 2d20 n LYS 617 Ca 0.25 0.43 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 2d20 n LYS 617 Cb 0.85 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.80 2d20 n LYS 617 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2d20 n GLY 618 N 3.65 0.64 0.33 3.14 0.00 -1.26 -4.85 105.19 106.83 2d20 n GLY 618 Ca 0.24 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.30 2d20 n GLY 618 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d20 n LYS 619 N -2.12 0.64 -4.36 1.61 5.02 -0.22 -4.98 118.16 113.75 2d20 n LYS 619 Ca 0.00 -0.94 -0.34 0.00 -2.02 0.00 0.00 58.31 55.01 2d20 n LYS 619 Cb 0.04 -1.14 -0.15 0.00 -0.02 0.00 0.00 35.03 33.76 2d20 n LYS 619 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2d20 s ILE 620 N -0.85 2.99 0.06 -0.18 -1.09 -1.25 -4.60 121.20 116.29 2d20 s ILE 620 Ca 0.10 -0.65 -0.20 0.00 -2.23 0.00 0.00 60.65 57.67 2d20 s ILE 620 Cb 0.07 -2.30 -0.12 0.00 -1.58 0.00 0.00 42.46 38.54 2d20 s ILE 620 CO 0.13 0.49 1.44 0.00 -1.23 0.00 0.00 174.94 175.77 2d20 h ALA 621 N 7.42 0.24 -3.50 9.38 0.00 -1.64 -3.39 119.26 127.77 2d20 h ALA 621 Ca -0.35 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.10 2d20 h ALA 621 Cb 1.18 -0.06 -0.26 0.00 0.00 0.00 0.00 17.79 18.65 2d20 h ALA 621 CO 0.59 0.02 -0.67 -0.65 0.00 0.00 0.00 179.25 178.53 2d20 s GLN 622 N -4.70 0.10 -0.11 0.00 -0.21 -1.23 -1.82 119.66 111.69 2d20 s GLN 622 Ca -0.14 -0.07 0.04 0.00 0.02 0.00 0.00 55.36 55.20 2d20 s GLN 622 Cb 0.06 0.04 0.00 0.00 1.00 0.00 0.00 33.01 34.11 2d20 s GLN 622 CO 0.74 -0.02 -0.23 -1.58 -2.12 0.00 0.00 175.29 172.08 2d20 s TRP 623 N -0.27 2.52 -0.77 0.91 0.52 0.05 0.42 118.94 122.32 2d20 s TRP 623 Ca -0.03 -1.09 -0.24 0.00 0.02 0.00 0.00 56.10 54.76 2d20 s TRP 623 Cb -0.02 -1.70 0.06 0.00 -1.15 0.00 0.00 33.47 30.66 2d20 s TRP 623 CO -0.00 -0.46 1.16 -0.51 0.02 0.00 0.00 176.95 177.16 2d20 s ASP 624 N 0.48 6.27 0.06 2.95 1.01 0.35 -0.55 116.67 127.23 2d20 s ASP 624 Ca -0.16 -0.99 -0.19 0.00 0.71 0.00 0.00 52.55 51.92 2d20 s ASP 624 Cb -0.17 -2.49 -0.12 0.00 1.01 0.00 0.00 42.92 41.15 2d20 s ASP 624 CO 0.06 -1.55 1.41 0.58 0.21 0.00 0.00 175.17 175.88 2d20 h VAL 625 N 6.09 1.31 -4.03 -1.27 2.07 -1.56 -2.20 116.25 116.66 2d20 h VAL 625 Ca -0.17 -1.20 -0.40 0.00 0.82 0.00 0.00 66.70 65.76 2d20 h VAL 625 Cb 1.05 1.68 -0.26 0.00 -1.52 0.00 0.00 31.29 32.24 2d20 h VAL 625 CO 1.24 0.36 -0.78 -0.69 0.02 0.00 0.00 177.57 177.72 2d20 s VAL 626 N -4.52 0.84 0.04 2.57 1.01 -1.24 -0.78 120.40 118.32 2d20 s VAL 626 Ca -0.14 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 2d20 s VAL 626 Cb 0.06 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2d20 s VAL 626 CO 0.76 0.05 0.05 -0.55 0.00 0.00 0.00 175.10 175.41 2d20 s SER 627 N -0.75 0.26 -1.36 3.32 0.15 -1.20 -1.46 113.70 112.65 2d20 s SER 627 Ca 0.01 -0.64 -0.11 0.00 0.70 0.00 0.00 55.95 55.91 2d20 s SER 627 Cb -0.06 0.21 0.09 0.00 -1.71 0.00 0.00 66.02 64.55 2d20 s SER 627 CO 0.00 -0.51 0.57 1.41 1.20 0.00 0.00 173.24 175.91 2d20 n HIS 628 N 0.70 -1.81 1.05 3.44 8.25 -0.65 -4.58 115.22 121.63 2d20 n HIS 628 Ca -0.18 0.55 0.14 0.00 -0.26 0.00 0.00 57.72 57.96 2d20 n HIS 628 Cb 0.59 -2.99 0.53 0.00 1.12 0.00 0.00 29.99 29.24 2d20 n HIS 628 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2d20 n ALA 629 N -3.73 2.68 -2.78 -1.41 0.00 -1.26 -4.83 120.51 109.17 2d20 n ALA 629 Ca 0.01 -0.18 -0.29 0.00 0.00 0.00 0.00 53.44 52.98 2d20 n ALA 629 Cb 0.53 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 2d20 n ALA 629 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2d20 s PHE 630 N -2.94 3.17 0.60 0.00 0.40 -1.26 -0.57 117.98 117.38 2d20 s PHE 630 Ca 0.15 0.04 -0.12 0.00 -0.60 0.00 0.00 56.93 56.40 2d20 s PHE 630 Cb 0.19 -1.58 -0.05 0.00 0.51 0.00 0.00 43.02 42.09 2d20 s PHE 630 CO 0.57 0.52 1.02 0.45 0.70 0.00 0.00 175.22 178.48 2d20 s SER 631 N -2.62 6.31 0.00 1.36 0.15 -0.17 -4.42 113.70 114.30 2d20 s SER 631 Ca 0.30 1.45 0.19 0.00 0.70 0.00 0.00 55.95 58.58 2d20 s SER 631 Cb -0.11 -2.48 0.28 0.00 -1.71 0.00 0.00 66.02 62.00 2d20 s SER 631 CO 0.22 -0.81 1.22 0.47 1.20 0.00 0.00 173.24 175.54 2d20 n ASP 632 N -2.53 2.95 0.00 5.45 8.00 -1.26 -4.56 116.55 124.60 2d20 n ASP 632 Ca 0.06 -1.87 0.07 0.00 0.71 0.00 0.00 54.79 53.76 2d20 n ASP 632 Cb 0.54 -0.14 0.36 0.00 -0.02 0.00 0.00 41.12 41.86 2d20 n ASP 632 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2d20 n ASP 633 N 1.14 0.00 0.00 -2.24 5.68 -1.26 -4.85 116.55 115.01 2d20 n ASP 633 Ca 0.14 -0.03 0.00 0.00 -0.50 0.00 0.00 54.79 54.40 2d20 n ASP 633 Cb 0.51 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 2d20 n ASP 633 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2d20 n GLY 634 N -0.13 0.81 0.10 6.12 0.00 -1.26 -4.92 105.19 105.90 2d20 n GLY 634 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 2d20 n GLY 634 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d20 h SER 635 N 0.00 0.00 -0.05 1.61 4.64 -1.89 -3.44 113.55 114.42 2d20 h SER 635 Ca 0.00 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.22 2d20 h SER 635 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2d20 h SER 635 CO 0.00 0.04 -0.02 0.61 -0.87 0.00 0.00 176.83 176.59 2d20 n GLY 636 N 1.30 0.49 1.55 -0.77 0.00 -1.26 -4.96 105.19 101.53 2d20 n GLY 636 Ca 0.04 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 2d20 n GLY 636 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d20 n GLY 637 N -2.42 1.54 3.79 -0.02 0.00 -1.26 -4.42 105.19 102.39 2d20 n GLY 637 Ca -0.01 -2.11 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 2d20 n GLY 637 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d20 s ARG 638 N -3.18 4.30 0.32 1.61 1.81 -1.26 -1.00 118.95 121.54 2d20 s ARG 638 Ca 0.25 1.42 -0.28 0.00 -1.72 0.00 0.00 55.73 55.40 2d20 s ARG 638 Cb -0.02 -2.58 -0.09 0.00 -0.45 0.00 0.00 34.95 31.80 2d20 s ARG 638 CO 0.16 -0.00 1.15 0.50 -0.68 0.00 0.00 175.30 176.42 2d20 s ARG 639 N -2.43 4.43 -0.19 3.54 3.52 0.26 -4.36 118.95 123.73 2d20 s ARG 639 Ca 0.56 1.86 -0.28 0.00 -0.13 0.00 0.00 55.73 57.74 2d20 s ARG 639 Cb -0.20 -3.01 -0.00 0.00 -1.56 0.00 0.00 34.95 30.18 2d20 s ARG 639 CO 0.25 0.01 0.98 0.34 -0.81 0.00 0.00 175.30 176.06 2d20 s ASP 640 N -0.92 7.09 0.24 -2.12 2.15 -1.26 -4.71 116.67 117.14 2d20 s ASP 640 Ca 0.49 1.35 -0.16 0.00 0.43 0.00 0.00 52.55 54.65 2d20 s ASP 640 Cb -0.32 -2.52 0.01 0.00 -0.30 0.00 0.00 42.92 39.79 2d20 s ASP 640 CO 0.42 -0.56 0.55 -0.94 -0.17 0.00 0.00 175.17 174.47 2d20 s SER 641 N 1.18 -0.19 0.36 -0.34 1.04 -1.26 -5.00 113.70 109.49 2d20 s SER 641 Ca 0.43 -0.69 0.04 0.00 0.48 0.00 0.00 55.95 56.21 2d20 s SER 641 Cb -0.16 0.62 0.70 0.00 0.10 0.00 0.00 66.02 67.28 2d20 s SER 641 CO 0.10 -1.16 2.01 -0.55 0.98 0.00 0.00 173.24 174.63 2d20 h ASN 642 N 2.18 0.67 -0.10 7.02 -1.07 -1.94 -1.28 115.58 121.05 2d20 h ASN 642 Ca -0.25 -0.01 -0.01 0.00 0.07 0.00 0.00 56.30 56.10 2d20 h ASN 642 Cb 1.25 -0.16 -0.00 0.00 -2.07 0.00 0.00 38.32 37.34 2d20 h ASN 642 CO 0.33 0.47 0.04 -0.07 0.07 0.00 0.00 177.43 178.28 2d20 h LEU 643 N 0.78 0.14 -1.32 6.14 3.38 -1.95 -2.71 115.31 119.77 2d20 h LEU 643 Ca 0.23 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2d20 h LEU 643 Cb -0.03 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2d20 h LEU 643 CO -0.06 0.25 0.20 -0.61 0.09 0.00 0.00 178.44 178.31 2d20 h GLN 644 N 0.02 0.66 0.00 1.13 5.75 -1.72 -1.63 115.11 119.33 2d20 h GLN 644 Ca 0.03 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 2d20 h GLN 644 Cb 0.15 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.58 2d20 h GLN 644 CO -0.00 0.54 0.00 0.54 -2.65 0.00 0.00 178.83 177.26 2d20 n ARG 645 N -4.37 0.12 0.13 1.69 1.74 -0.53 -1.54 116.66 113.91 2d20 n ARG 645 Ca 0.04 0.44 0.13 0.00 -0.77 0.00 0.00 57.85 57.68 2d20 n ARG 645 Cb 0.14 -1.77 0.37 0.00 -1.02 0.00 0.00 32.46 30.18 2d20 n ARG 645 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 2d20 h THR 646 N 0.00 0.00 0.00 0.55 1.35 -1.07 -3.44 112.91 110.30 2d20 h THR 646 Ca 0.00 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2d20 h THR 646 Cb 0.22 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 2d20 h THR 646 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2d20 n GLY 647 N 1.14 4.88 0.32 5.82 0.00 -0.59 -4.88 105.19 111.88 2d20 n GLY 647 Ca 0.05 -1.02 0.18 0.00 0.00 0.00 0.00 46.02 45.23 2d20 n GLY 647 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2d20 h ASN 648 N 0.00 0.00 -0.01 1.61 -1.24 -1.91 -1.73 115.58 112.30 2d20 h ASN 648 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2d20 h ASN 648 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2d20 h ASN 648 CO 0.00 0.00 0.00 -0.90 -1.29 0.00 0.00 177.43 175.24 2d20 n ASP 649 N -3.48 0.13 -0.17 1.15 5.75 -1.26 -4.13 116.55 114.54 2d20 n ASP 649 Ca -0.02 -1.54 0.02 0.00 -0.01 0.00 0.00 54.79 53.24 2d20 n ASP 649 Cb 0.15 -0.01 0.29 0.00 -1.03 0.00 0.00 41.12 40.53 2d20 n ASP 649 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 2d20 h TRP 650 N 0.16 0.84 -0.17 2.11 5.08 -1.63 -1.04 115.95 121.31 2d20 h TRP 650 Ca 0.00 0.02 -0.03 0.00 1.08 0.00 0.00 58.89 59.96 2d20 h TRP 650 Cb 0.04 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 25.90 2d20 h TRP 650 CO 0.01 0.52 0.00 0.82 -1.28 0.00 0.00 178.44 178.51 2d20 h ILE 651 N 0.90 1.25 -0.57 0.12 2.04 -1.85 -1.02 117.51 118.38 2d20 h ILE 651 Ca 0.26 -0.83 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2d20 h ILE 651 Cb -0.05 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 2d20 h ILE 651 CO -0.06 0.25 0.32 -0.08 0.00 0.00 0.00 178.15 178.58 2d20 h GLU 652 N 0.05 0.61 -0.80 2.37 4.81 -1.75 -1.76 114.58 118.11 2d20 h GLU 652 Ca 0.05 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2d20 h GLU 652 Cb 0.37 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2d20 h GLU 652 CO 0.01 0.40 0.35 0.28 -0.73 0.00 0.00 179.01 179.32 2d20 h VAL 653 N 0.63 1.26 -0.59 0.32 2.07 -1.05 -0.69 116.25 118.19 2d20 h VAL 653 Ca 0.24 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 2d20 h VAL 653 Cb 0.09 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 2d20 h VAL 653 CO -0.13 0.32 0.35 0.00 0.02 0.00 0.00 177.57 178.13 2d20 h ALA 654 N 1.22 0.76 -0.41 1.67 0.00 -0.52 -0.10 119.26 121.87 2d20 h ALA 654 Ca 0.27 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 2d20 h ALA 654 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2d20 h ALA 654 CO -0.03 0.24 -0.19 0.74 0.00 0.00 0.00 179.25 180.01 2d20 h PHE 655 N 0.80 0.98 -0.79 0.00 0.04 -1.01 -0.45 116.94 116.50 2d20 h PHE 655 Ca 0.21 -0.24 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 2d20 h PHE 655 Cb -0.01 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 37.88 2d20 h PHE 655 CO -0.02 1.01 0.40 0.00 -0.60 0.00 0.00 178.31 179.10 2d20 h ARG 656 N 0.66 1.13 -0.29 1.51 3.08 -0.90 -1.09 114.38 118.48 2d20 h ARG 656 Ca 0.09 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2d20 h ARG 656 Cb 0.75 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 2d20 h ARG 656 CO 0.06 0.86 0.11 1.15 -1.07 0.00 0.00 179.97 181.08 2d20 h THR 657 N 1.11 1.18 -0.69 2.04 2.02 -0.83 -2.99 112.91 114.75 2d20 h THR 657 Ca 0.27 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2d20 h THR 657 Cb 0.09 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2d20 h THR 657 CO -0.04 0.19 0.43 0.00 0.37 0.00 0.00 175.52 176.47 2d20 h ALA 658 N 0.96 0.88 -0.66 6.16 0.00 -0.73 -1.61 119.26 124.26 2d20 h ALA 658 Ca 0.10 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2d20 h ALA 658 Cb 0.19 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2d20 h ALA 658 CO -0.01 0.34 0.39 -0.09 0.00 0.00 0.00 179.25 179.88 2d20 h ARG 659 N 0.94 0.72 -0.27 0.00 9.65 -1.13 -1.82 114.38 122.46 2d20 h ARG 659 Ca 0.25 -0.04 -0.13 0.00 -1.10 0.00 0.00 59.98 58.96 2d20 h ARG 659 Cb -0.05 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.36 2d20 h ARG 659 CO -0.05 0.47 -0.36 0.00 2.80 0.00 0.00 179.97 182.83 2d20 h ALA 660 N 1.31 0.86 -0.46 2.80 0.00 -1.35 -2.62 119.26 119.80 2d20 h ALA 660 Ca 0.28 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2d20 h ALA 660 Cb 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2d20 h ALA 660 CO -0.14 0.64 -0.12 0.00 0.00 0.00 0.00 179.25 179.63 2d20 h ALA 661 N 1.09 0.92 -1.54 0.00 0.00 -0.77 -3.40 119.26 115.56 2d20 h ALA 661 Ca 0.05 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.41 2d20 h ALA 661 Cb 0.86 -0.18 -0.26 0.00 0.00 0.00 0.00 17.79 18.22 2d20 h ALA 661 CO 0.07 0.62 -0.57 0.34 0.00 0.00 0.00 179.25 179.71 2d20 s ASP 662 N -6.69 -0.02 0.32 0.00 -1.08 -0.73 -4.67 116.67 103.79 2d20 s ASP 662 Ca -0.10 -1.13 0.23 0.00 -0.52 0.00 0.00 52.55 51.04 2d20 s ASP 662 Cb 0.14 1.19 1.15 0.00 -1.46 0.00 0.00 42.92 43.94 2d20 s ASP 662 CO 0.83 -0.23 1.70 -2.65 0.52 0.00 0.00 175.17 175.34 2d20 n PRO 663 N 4.43 0.17 0.11 4.34 -0.02 -0.99 -2.64 135.00 140.39 2d20 n PRO 663 Ca 0.10 0.58 0.12 0.00 -2.02 0.00 0.00 63.50 62.28 2d20 n PRO 663 Cb 0.50 -1.95 0.18 0.00 -0.02 0.00 0.00 33.50 32.21 2d20 n PRO 663 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2d20 h ALA 664 N 2.08 0.71 -2.58 3.55 0.00 -1.95 -3.46 119.26 117.61 2d20 h ALA 664 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 2d20 h ALA 664 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2d20 h ALA 664 CO 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.23 2d20 s ALA 665 N -3.21 3.53 -0.01 0.00 0.00 -1.08 -4.93 121.76 116.06 2d20 s ALA 665 Ca 0.06 -0.03 -0.28 0.00 0.00 0.00 0.00 51.96 51.70 2d20 s ALA 665 Cb 0.11 -2.62 -0.03 0.00 0.00 0.00 0.00 23.12 20.58 2d20 s ALA 665 CO 0.70 0.41 0.90 0.15 0.00 0.00 0.00 175.76 177.93 2d20 s LYS 666 N -1.91 4.53 -0.26 0.00 1.02 -0.75 -4.92 119.74 117.46 2d20 s LYS 666 Ca 0.39 1.28 -0.14 0.00 0.02 0.00 0.00 55.97 57.52 2d20 s LYS 666 Cb -0.16 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.66 2d20 s LYS 666 CO 0.20 -0.00 0.31 -0.51 -0.92 0.00 0.00 175.35 174.42 2d20 s LEU 667 N 0.89 4.06 0.16 3.17 1.43 -1.26 -0.77 118.68 126.36 2d20 s LEU 667 Ca 0.48 0.24 0.09 0.00 -1.03 0.00 0.00 54.13 53.91 2d20 s LEU 667 Cb -0.20 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 2d20 s LEU 667 CO 0.25 -0.10 -0.15 0.00 0.23 0.00 0.00 176.35 176.58 2d20 s TYR 669 N -1.52 3.05 -0.00 0.00 5.04 -0.53 -1.45 117.35 121.94 2d20 s TYR 669 Ca 0.22 -0.38 0.06 0.00 -2.44 0.00 0.00 57.07 54.53 2d20 s TYR 669 Cb -0.09 -2.06 -0.03 0.00 0.35 0.00 0.00 41.96 40.13 2d20 s TYR 669 CO 0.12 -0.17 -0.20 1.21 -1.34 0.00 0.00 175.55 175.18 2d20 s ASN 670 N 0.82 3.63 0.23 4.32 2.47 -0.53 0.38 114.94 126.26 2d20 s ASN 670 Ca 0.00 -0.37 -0.23 0.00 0.42 0.00 0.00 52.86 52.68 2d20 s ASN 670 Cb -0.14 -0.59 0.04 0.00 -1.45 0.00 0.00 41.25 39.10 2d20 s ASN 670 CO 0.02 0.30 0.80 -0.62 -3.72 0.00 0.00 177.10 173.89 2d20 s ASP 671 N -0.97 -0.24 0.33 -4.21 -1.08 -0.96 -1.63 116.67 107.91 2d20 s ASP 671 Ca 0.12 -0.52 0.10 0.00 -0.52 0.00 0.00 52.55 51.73 2d20 s ASP 671 Cb -0.10 0.64 -0.06 0.00 -1.46 0.00 0.00 42.92 41.94 2d20 s ASP 671 CO 0.02 -1.18 -0.11 -0.72 0.52 0.00 0.00 175.17 173.70 2d20 s TYR 672 N -3.68 2.39 -1.58 -5.34 1.13 -1.26 -1.42 117.35 107.59 2d20 s TYR 672 Ca 0.11 -0.45 -0.04 0.00 -1.41 0.00 0.00 57.07 55.28 2d20 s TYR 672 Cb -0.04 -1.30 0.01 0.00 -1.10 0.00 0.00 41.96 39.53 2d20 s TYR 672 CO 0.05 0.61 0.59 0.09 -2.51 0.00 0.00 175.55 174.38 2d20 n ASN 673 N -0.77 -6.18 -0.37 -0.18 3.02 -1.26 -4.86 115.26 104.67 2d20 n ASN 673 Ca -0.05 -0.28 0.06 0.00 -0.03 0.00 0.00 54.58 54.29 2d20 n ASN 673 Cb 0.62 -4.99 0.11 0.00 -0.61 0.00 0.00 39.78 34.91 2d20 n ASN 673 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2d20 n ILE 674 N -4.51 1.33 0.01 2.41 -5.35 -1.26 -4.30 119.36 107.69 2d20 n ILE 674 Ca -0.12 -1.77 -0.19 0.00 -0.27 0.00 0.00 62.75 60.40 2d20 n ILE 674 Cb 0.63 0.04 -0.14 0.00 -1.74 0.00 0.00 39.64 38.42 2d20 n ILE 674 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2d20 h GLU 675 N 0.23 0.24 -6.16 6.28 3.07 -1.94 -3.44 114.58 112.87 2d20 h GLU 675 Ca -0.02 -0.41 -0.58 0.00 -0.50 0.00 0.00 59.36 57.85 2d20 h GLU 675 Cb 1.17 0.15 -0.06 0.00 -0.84 0.00 0.00 28.75 29.17 2d20 h GLU 675 CO 0.01 1.11 0.79 1.21 -1.40 0.00 0.00 179.01 180.73 2d20 s ASN 676 N -6.93 7.00 0.37 1.42 3.84 -1.26 -4.12 114.94 115.26 2d20 s ASN 676 Ca -0.18 1.19 0.09 0.00 0.21 0.00 0.00 52.86 54.17 2d20 s ASN 676 Cb 0.07 -2.53 0.82 0.00 -0.55 0.00 0.00 41.25 39.05 2d20 s ASN 676 CO 0.79 -0.76 1.92 -0.25 -2.79 0.00 0.00 177.10 176.02 2d20 h TRP 677 N 7.77 0.74 0.00 0.43 2.91 -1.87 -2.57 115.95 123.36 2d20 h TRP 677 Ca -0.20 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.84 2d20 h TRP 677 Cb 1.06 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.47 2d20 h TRP 677 CO 0.79 0.33 0.00 1.79 -1.03 0.00 0.00 178.44 180.32 2d20 h THR 678 N 0.68 0.00 -3.84 2.65 1.35 -1.95 -3.41 112.91 108.38 2d20 h THR 678 Ca 0.38 -0.23 -0.50 0.00 -0.55 0.00 0.00 66.41 65.50 2d20 h THR 678 Cb 0.54 0.97 0.02 0.00 -1.73 0.00 0.00 68.15 67.96 2d20 h THR 678 CO -0.15 0.00 0.48 0.26 -0.25 0.00 0.00 175.52 175.87 2d20 s TRP 679 N -3.42 3.45 0.38 4.73 0.51 -0.97 -4.93 118.94 118.69 2d20 s TRP 679 Ca 0.03 1.66 0.06 0.00 -2.12 0.00 0.00 56.10 55.73 2d20 s TRP 679 Cb 0.09 -3.31 0.79 0.00 -0.81 0.00 0.00 33.47 30.23 2d20 s TRP 679 CO 0.39 -0.73 2.00 0.00 -0.51 0.00 0.00 176.95 178.10 2d20 h ALA 680 N 3.51 1.71 -0.27 0.98 0.00 -1.87 -2.41 119.26 120.91 2d20 h ALA 680 Ca -0.47 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2d20 h ALA 680 Cb 1.22 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2d20 h ALA 680 CO 0.66 0.22 0.13 -0.22 0.00 0.00 0.00 179.25 180.03 2d20 h LYS 681 N 0.67 0.39 -0.44 0.00 3.64 -1.85 0.02 116.57 118.99 2d20 h LYS 681 Ca 0.24 -0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 2d20 h LYS 681 Cb 0.12 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.82 2d20 h LYS 681 CO -0.07 0.39 0.15 1.15 -2.27 0.00 0.00 179.45 178.80 2d20 h THR 682 N 0.30 0.85 0.00 1.00 2.02 -1.63 -1.25 112.91 114.21 2d20 h THR 682 Ca 0.09 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 67.07 2d20 h THR 682 Cb 0.13 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2d20 h THR 682 CO -0.01 0.06 -0.45 1.56 0.37 0.00 0.00 175.52 177.04 2d20 h GLN 683 N 0.32 0.00 -0.40 6.66 4.20 -1.26 -1.28 115.11 123.35 2d20 h GLN 683 Ca 0.21 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.78 2d20 h GLN 683 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2d20 h GLN 683 CO -0.22 0.45 -0.29 0.78 -0.67 0.00 0.00 178.83 178.89 2d20 h GLY 684 N 1.66 0.97 1.01 3.46 0.00 -0.24 -1.22 103.07 108.71 2d20 h GLY 684 Ca -0.00 -0.94 -0.09 0.00 0.00 0.00 0.00 47.33 46.30 2d20 h GLY 684 CO 0.06 0.85 -0.05 -2.08 0.00 0.00 0.00 176.54 175.32 2d20 h VAL 685 N 0.71 1.27 -0.39 4.60 2.07 -1.04 -2.39 116.25 121.08 2d20 h VAL 685 Ca 0.08 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.50 2d20 h VAL 685 Cb 0.87 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 2d20 h VAL 685 CO 0.08 0.39 0.15 0.22 0.02 0.00 0.00 177.57 178.43 2d20 h TYR 686 N 0.70 0.27 -0.94 1.57 3.20 -1.07 -1.20 116.97 119.50 2d20 h TYR 686 Ca 0.13 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2d20 h TYR 686 Cb 0.57 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.73 2d20 h TYR 686 CO 0.04 0.12 0.62 -0.91 -1.64 0.00 0.00 178.16 176.39 2d20 h ASN 687 N 0.32 1.09 -0.14 -2.11 2.35 -1.05 0.56 115.58 116.61 2d20 h ASN 687 Ca 0.17 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 2d20 h ASN 687 Cb 0.14 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 2d20 h ASN 687 CO -0.16 0.80 -0.01 -0.03 -1.65 0.00 0.00 177.43 176.37 2d20 h MET 688 N 1.28 0.25 -0.84 0.81 4.05 -0.92 -0.55 114.93 119.02 2d20 h MET 688 Ca 0.35 -0.09 -0.03 0.00 -0.28 0.00 0.00 59.70 59.65 2d20 h MET 688 Cb -0.14 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.61 2d20 h MET 688 CO -0.07 0.51 0.40 0.28 0.23 0.00 0.00 176.91 178.25 2d20 h VAL 689 N -0.02 1.26 -0.35 -5.77 2.07 -0.99 0.79 116.25 113.23 2d20 h VAL 689 Ca 0.04 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2d20 h VAL 689 Cb 0.40 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2d20 h VAL 689 CO 0.01 0.31 0.22 -0.09 0.02 0.00 0.00 177.57 178.04 2d20 h ARG 690 N 1.19 0.47 -0.34 1.57 2.43 -0.74 -1.11 114.38 117.86 2d20 h ARG 690 Ca 0.29 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.43 2d20 h ARG 690 Cb 0.12 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2d20 h ARG 690 CO -0.04 0.35 0.21 0.22 -1.51 0.00 0.00 179.97 179.21 2d20 h ASP 691 N 0.46 0.36 -0.16 -3.80 3.58 -0.50 -1.01 116.42 115.35 2d20 h ASP 691 Ca 0.13 -0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.61 2d20 h ASP 691 Cb -0.01 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 40.92 2d20 h ASP 691 CO -0.02 0.26 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.27 2d20 h PHE 692 N 0.44 -0.15 -0.67 0.28 -1.00 -0.52 -1.16 116.94 114.16 2d20 h PHE 692 Ca 0.13 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.89 2d20 h PHE 692 Cb -0.03 0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.59 2d20 h PHE 692 CO -0.06 -0.11 0.25 0.87 -1.61 0.00 0.00 178.31 177.65 2d20 h LYS 693 N -0.04 0.99 -0.28 1.51 1.79 -0.99 0.20 116.57 119.74 2d20 h LYS 693 Ca 0.09 -0.17 -0.07 0.00 -2.18 0.00 0.00 60.65 58.32 2d20 h LYS 693 Cb 0.17 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 2d20 h LYS 693 CO -0.19 0.82 -0.12 1.96 -1.08 0.00 0.00 179.45 180.84 2d20 h GLN 694 N 0.97 0.47 -0.54 3.15 4.20 -0.71 -2.98 115.11 119.67 2d20 h GLN 694 Ca 0.22 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2d20 h GLN 694 Cb 0.20 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2d20 h GLN 694 CO -0.02 0.59 0.00 0.54 -0.67 0.00 0.00 178.83 179.27 2d20 n ARG 695 N -4.21 2.58 -1.00 1.46 1.74 -0.48 -4.96 116.66 111.78 2d20 n ARG 695 Ca 0.01 -2.42 -0.00 0.00 -0.77 0.00 0.00 57.85 54.67 2d20 n ARG 695 Cb 0.31 -1.54 -0.00 0.00 -1.02 0.00 0.00 32.46 30.22 2d20 n ARG 695 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d20 n GLY 696 N 1.57 0.46 3.70 -0.13 0.00 -0.42 -5.00 105.19 105.37 2d20 n GLY 696 Ca 0.22 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2d20 n GLY 696 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d20 s VAL 697 N -2.00 3.36 -0.40 1.61 1.01 0.56 -4.91 120.40 119.64 2d20 s VAL 697 Ca 0.00 0.85 -0.28 0.00 0.00 0.00 0.00 61.98 62.55 2d20 s VAL 697 Cb 0.00 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 2d20 s VAL 697 CO 0.00 0.02 1.85 -2.16 0.00 0.00 0.00 175.10 174.81 2d20 s PRO 698 N 2.06 3.10 -0.09 2.72 0.04 -1.26 -4.41 135.00 137.16 2d20 s PRO 698 Ca 0.67 1.24 -0.04 0.00 0.04 0.00 0.00 61.00 62.90 2d20 s PRO 698 Cb -0.36 -4.26 0.04 0.00 0.04 0.00 0.00 34.50 29.96 2d20 s PRO 698 CO 0.29 -2.14 0.21 -1.50 0.04 0.00 0.00 177.00 173.90 2d20 s ILE 699 N 7.69 -0.06 -0.20 0.56 2.07 -1.26 -4.64 121.20 125.36 2d20 s ILE 699 Ca 0.78 0.17 0.09 0.00 -1.41 0.00 0.00 60.65 60.28 2d20 s ILE 699 Cb -0.20 -0.33 -0.13 0.00 0.13 0.00 0.00 42.46 41.94 2d20 s ILE 699 CO 0.30 0.07 0.29 0.47 -1.91 0.00 0.00 174.94 174.16 2d20 n ASP 700 N 4.27 1.75 -3.49 4.50 8.00 0.02 -4.89 116.55 126.70 2d20 n ASP 700 Ca -0.25 -0.32 -0.11 0.00 0.71 0.00 0.00 54.79 54.81 2d20 n ASP 700 Cb 0.52 1.24 -0.02 0.00 -0.02 0.00 0.00 41.12 42.83 2d20 n ASP 700 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d20 s VAL 702 N -3.77 1.35 -0.19 0.00 1.01 -0.72 -1.45 120.40 116.63 2d20 s VAL 702 Ca 0.02 -0.57 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 2d20 s VAL 702 Cb -0.01 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2d20 s VAL 702 CO -0.11 0.41 0.13 -0.83 0.00 0.00 0.00 175.10 174.69 2d20 s GLY 703 N 0.91 2.05 -0.39 4.51 0.00 0.16 -1.97 107.32 112.58 2d20 s GLY 703 Ca -0.09 -0.69 -0.08 0.00 0.00 0.00 0.00 44.72 43.87 2d20 s GLY 703 CO 0.00 0.07 0.20 -1.36 0.00 0.00 0.00 173.10 172.02 2d20 s PHE 704 N 0.19 3.33 0.31 1.90 0.40 0.37 -2.26 117.98 122.22 2d20 s PHE 704 Ca 0.09 -1.57 0.07 0.00 -0.60 0.00 0.00 56.93 54.91 2d20 s PHE 704 Cb -0.11 -2.76 0.77 0.00 0.51 0.00 0.00 43.02 41.42 2d20 s PHE 704 CO -0.01 -0.82 1.76 1.96 0.70 0.00 0.00 175.22 178.81 2d20 h GLN 705 N 8.31 0.70 -5.75 0.44 4.20 -1.53 -1.95 115.11 119.52 2d20 h GLN 705 Ca -0.22 -0.04 -0.35 0.00 0.06 0.00 0.00 58.65 58.10 2d20 h GLN 705 Cb 1.08 -0.16 0.14 0.00 0.30 0.00 0.00 27.48 28.84 2d20 h GLN 705 CO 0.70 0.46 -0.80 0.43 -0.67 0.00 0.00 178.83 178.96 2d20 n SER 706 N -4.80 -2.25 -4.41 1.46 7.64 -1.26 -1.57 113.62 108.44 2d20 n SER 706 Ca 0.24 -0.69 -0.45 0.00 1.01 0.00 0.00 58.87 58.99 2d20 n SER 706 Cb 0.61 -4.83 -0.03 0.00 -1.01 0.00 0.00 64.21 58.94 2d20 n SER 706 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2d20 s HIS 707 N -3.44 3.18 -0.07 1.43 3.76 -1.26 -2.63 115.29 116.25 2d20 s HIS 707 Ca 0.05 -1.33 -0.11 0.00 -0.15 0.00 0.00 55.06 53.51 2d20 s HIS 707 Cb -0.01 -4.12 -0.05 0.00 1.11 0.00 0.00 32.58 29.51 2d20 s HIS 707 CO 0.75 -1.35 0.28 -0.06 -0.85 0.00 0.00 174.74 173.51 2d20 s PHE 708 N 2.29 3.65 0.33 1.40 0.08 -0.27 -4.88 117.98 120.57 2d20 s PHE 708 Ca 0.23 0.75 -0.18 0.00 0.12 0.00 0.00 56.93 57.85 2d20 s PHE 708 Cb -0.12 -2.14 0.04 0.00 -0.57 0.00 0.00 43.02 40.23 2d20 s PHE 708 CO -0.04 0.65 0.78 0.54 -0.10 0.00 0.00 175.22 177.05 2d20 s ASN 709 N -0.91 -0.10 0.14 1.36 2.20 -1.05 -0.74 114.94 115.84 2d20 s ASN 709 Ca 0.19 -0.90 0.14 0.00 -0.94 0.00 0.00 52.86 51.35 2d20 s ASN 709 Cb -0.14 0.78 0.65 0.00 -2.00 0.00 0.00 41.25 40.54 2d20 s ASN 709 CO 0.08 -1.51 1.42 -1.54 -2.94 0.00 0.00 177.10 172.61 2d20 n SER 710 N -1.01 0.29 0.06 3.54 3.41 -1.26 -0.37 113.62 118.29 2d20 n SER 710 Ca -0.06 0.61 -0.14 0.00 -0.26 0.00 0.00 58.87 59.01 2d20 n SER 710 Cb 0.60 -0.66 -0.14 0.00 -0.26 0.00 0.00 64.21 63.75 2d20 n SER 710 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2d20 h GLY 711 N 0.96 0.21 -6.22 5.00 0.00 -1.99 -3.39 103.07 97.65 2d20 h GLY 711 Ca 0.00 -0.53 -0.58 0.00 0.00 0.00 0.00 47.33 46.22 2d20 h GLY 711 CO 0.00 0.47 -1.01 1.44 0.00 0.00 0.00 176.54 177.44 2d20 n SER 712 N -3.40 0.05 -4.77 0.19 7.64 -0.39 -5.13 113.62 107.81 2d20 n SER 712 Ca -0.12 -2.57 -0.35 0.00 1.01 0.00 0.00 58.87 56.83 2d20 n SER 712 Cb 1.02 -0.60 0.01 0.00 -1.01 0.00 0.00 64.21 63.63 2d20 n SER 712 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2d20 s PRO 713 N -0.62 3.29 0.40 1.43 0.04 0.51 -2.53 135.00 137.52 2d20 s PRO 713 Ca 0.34 1.59 -0.26 0.00 0.04 0.00 0.00 61.00 62.70 2d20 s PRO 713 Cb 0.10 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 2d20 s PRO 713 CO -0.15 -0.90 1.35 -0.47 0.04 0.00 0.00 177.00 176.87 2d20 s TYR 714 N -1.83 2.75 -0.02 0.56 5.04 -1.26 -4.92 117.35 117.65 2d20 s TYR 714 Ca 0.72 1.35 0.04 0.00 -2.44 0.00 0.00 57.07 56.74 2d20 s TYR 714 Cb -0.24 -3.77 -0.01 0.00 0.35 0.00 0.00 41.96 38.30 2d20 s TYR 714 CO 0.29 -2.35 -0.14 1.21 -1.34 0.00 0.00 175.55 173.22 2d20 s ASN 715 N -0.58 1.68 0.67 4.32 3.84 -1.26 -5.02 114.94 118.58 2d20 s ASN 715 Ca 0.56 -0.26 0.38 0.00 0.21 0.00 0.00 52.86 53.75 2d20 s ASN 715 Cb -0.40 -0.31 2.10 0.00 -0.55 0.00 0.00 41.25 42.08 2d20 s ASN 715 CO 0.53 0.15 2.19 0.77 -2.79 0.00 0.00 177.10 177.94 2d20 h SER 716 N 6.03 0.00 0.00 -4.21 4.64 -1.98 -0.70 113.55 117.33 2d20 h SER 716 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2d20 h SER 716 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2d20 h SER 716 CO 0.49 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.99 2d20 n ASN 717 N -3.02 0.00 -0.01 4.97 0.23 -1.26 -2.63 115.26 113.54 2d20 n ASN 717 Ca -0.02 -0.63 0.03 0.00 -0.53 0.00 0.00 54.58 53.43 2d20 n ASN 717 Cb 0.20 0.00 0.40 0.00 -2.08 0.00 0.00 39.78 38.31 2d20 n ASN 717 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2d20 h PHE 718 N 0.00 0.54 -0.70 -2.53 3.57 -1.27 -0.95 116.94 115.60 2d20 h PHE 718 Ca 0.00 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2d20 h PHE 718 Cb 0.00 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2d20 h PHE 718 CO 0.00 0.36 0.28 -0.09 -2.23 0.00 0.00 178.31 176.63 2d20 h ARG 719 N 0.57 1.03 -0.00 1.11 2.43 -1.76 -0.37 114.38 117.39 2d20 h ARG 719 Ca 0.15 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 2d20 h ARG 719 Cb -0.03 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 2d20 h ARG 719 CO -0.03 0.84 -0.57 1.79 -1.51 0.00 0.00 179.97 180.49 2d20 h THR 720 N 1.01 1.41 -0.10 0.20 1.35 -1.43 -0.76 112.91 114.59 2d20 h THR 720 Ca 0.24 -1.95 -0.01 0.00 -0.55 0.00 0.00 66.41 64.14 2d20 h THR 720 Cb 0.19 2.05 -0.00 0.00 -1.73 0.00 0.00 68.15 68.66 2d20 h THR 720 CO -0.02 0.56 0.01 0.74 -0.25 0.00 0.00 175.52 176.56 2d20 h THR 721 N 0.01 1.22 -0.51 6.82 2.02 -0.54 0.17 112.91 122.11 2d20 h THR 721 Ca -0.01 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.48 2d20 h THR 721 Cb 1.01 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.90 2d20 h THR 721 CO 0.07 0.20 0.34 -0.07 0.37 0.00 0.00 175.52 176.43 2d20 h LEU 722 N -0.08 0.59 -0.65 2.58 3.38 -0.92 -1.76 115.31 118.44 2d20 h LEU 722 Ca 0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2d20 h LEU 722 Cb 0.30 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2d20 h LEU 722 CO 0.00 0.43 0.34 1.56 0.09 0.00 0.00 178.44 180.86 2d20 h GLN 723 N 0.69 0.92 -0.35 1.13 4.20 -0.99 -0.47 115.11 120.24 2d20 h GLN 723 Ca 0.19 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 2d20 h GLN 723 Cb -0.08 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.51 2d20 h GLN 723 CO -0.04 0.72 0.22 -0.91 -0.67 0.00 0.00 178.83 178.14 2d20 h ASN 724 N 0.89 0.42 -0.54 1.46 2.35 -0.25 -1.45 115.58 118.45 2d20 h ASN 724 Ca 0.23 -0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 55.84 2d20 h ASN 724 Cb 0.08 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2d20 h ASN 724 CO -0.03 0.34 -0.04 -0.26 -1.65 0.00 0.00 177.43 175.78 2d20 h PHE 725 N 0.46 1.09 -0.37 1.19 -1.00 -1.14 -2.83 116.94 114.35 2d20 h PHE 725 Ca 0.13 -0.20 0.00 0.00 2.81 0.00 0.00 57.97 60.71 2d20 h PHE 725 Cb -0.01 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.25 2d20 h PHE 725 CO -0.04 1.00 0.24 0.00 -1.61 0.00 0.00 178.31 177.90 2d20 h ALA 726 N 0.94 1.74 0.00 2.45 0.00 -0.82 -0.56 119.26 123.01 2d20 h ALA 726 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2d20 h ALA 726 Cb 0.59 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2d20 h ALA 726 CO 0.04 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.53 2d20 n ALA 727 N -2.48 1.51 1.20 0.00 0.00 -0.57 -1.59 120.51 118.57 2d20 n ALA 727 Ca 0.03 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.73 2d20 n ALA 727 Cb 0.06 -1.38 0.63 0.00 0.00 0.00 0.00 19.45 18.76 2d20 n ALA 727 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2d20 n LEU 728 N -2.29 0.12 0.00 0.00 4.77 -0.22 -4.90 117.00 114.49 2d20 n LEU 728 Ca 0.01 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2d20 n LEU 728 Cb 0.18 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2d20 n LEU 728 CO 0.18 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 2d20 n GLY 729 N 1.40 1.26 3.31 -0.72 0.00 -0.62 -4.95 105.19 104.88 2d20 n GLY 729 Ca 0.10 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 2d20 n GLY 729 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d20 s VAL 730 N -2.00 1.68 0.67 1.61 -7.23 -1.24 -4.96 120.40 108.92 2d20 s VAL 730 Ca 0.00 -1.94 -0.08 0.00 -1.81 0.00 0.00 61.98 58.15 2d20 s VAL 730 Cb 0.00 -1.81 0.03 0.00 0.56 0.00 0.00 36.38 35.16 2d20 s VAL 730 CO 0.00 -0.41 1.00 -1.81 -0.31 0.00 0.00 175.10 173.57 2d20 s ASP 731 N -2.77 5.26 0.13 4.85 1.01 0.19 -4.18 116.67 121.16 2d20 s ASP 731 Ca 0.16 0.75 0.05 0.00 0.71 0.00 0.00 52.55 54.22 2d20 s ASP 731 Cb -0.04 -1.56 -0.04 0.00 1.01 0.00 0.00 42.92 42.28 2d20 s ASP 731 CO 0.06 -1.34 -0.13 0.68 0.21 0.00 0.00 175.17 174.65 2d20 s VAL 732 N -3.20 1.25 -0.11 -1.27 -7.23 -0.61 -1.75 120.40 107.49 2d20 s VAL 732 Ca 0.57 -1.78 -0.15 0.00 -1.81 0.00 0.00 61.98 58.81 2d20 s VAL 732 Cb -0.11 -1.57 0.04 0.00 0.56 0.00 0.00 36.38 35.29 2d20 s VAL 732 CO 0.47 -0.50 0.39 0.00 -0.31 0.00 0.00 175.10 175.14 2d20 s ALA 733 N -2.42 -0.97 -0.38 1.32 0.00 -0.83 -0.98 121.76 117.50 2d20 s ALA 733 Ca 0.10 0.91 -0.18 0.00 0.00 0.00 0.00 51.96 52.78 2d20 s ALA 733 Cb -0.03 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.68 2d20 s ALA 733 CO 0.02 -0.22 0.52 0.42 0.00 0.00 0.00 175.76 176.50 2d20 s ILE 734 N -0.30 5.00 -0.16 0.00 1.01 -0.90 -0.48 121.20 125.37 2d20 s ILE 734 Ca -0.04 0.15 0.18 0.00 0.00 0.00 0.00 60.65 60.94 2d20 s ILE 734 Cb -0.03 -4.02 -0.26 0.00 0.01 0.00 0.00 42.46 38.16 2d20 s ILE 734 CO 0.02 -0.33 0.21 0.35 0.00 0.00 0.00 174.94 175.19 2d20 n THR 735 N 5.51 1.19 -2.77 2.92 -2.24 -0.73 -0.69 114.28 117.46 2d20 n THR 735 Ca -0.05 -0.79 -0.03 0.00 -2.27 0.00 0.00 64.05 60.90 2d20 n THR 735 Cb 0.48 -0.45 0.05 0.00 -2.10 0.00 0.00 70.33 68.31 2d20 n THR 735 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2d20 n GLU 736 N -2.71 1.50 -1.69 -0.78 1.02 -0.61 -4.58 120.64 112.80 2d20 n GLU 736 Ca -0.26 -3.31 -0.44 0.00 -0.02 0.00 0.00 57.16 53.13 2d20 n GLU 736 Cb 1.05 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 31.06 2d20 n GLU 736 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2d20 n LEU 737 N -0.44 3.68 -3.63 -4.62 7.94 -0.07 -4.13 117.00 115.73 2d20 n LEU 737 Ca 0.07 1.04 -0.14 0.00 -1.11 0.00 0.00 56.01 55.87 2d20 n LEU 737 Cb 0.81 -1.50 -0.07 0.00 0.53 0.00 0.00 43.42 43.19 2d20 n LEU 737 CO 0.13 0.01 0.41 1.51 -1.11 0.00 0.00 177.39 178.34 2d20 s ASP 738 N 1.74 -0.73 -0.12 1.96 1.47 -1.08 -0.52 116.67 119.39 2d20 s ASP 738 Ca 0.79 1.39 0.00 0.00 1.18 0.00 0.00 52.55 55.92 2d20 s ASP 738 Cb -0.57 1.40 0.02 0.00 -0.34 0.00 0.00 42.92 43.44 2d20 s ASP 738 CO 0.37 -0.26 -0.11 -0.63 0.68 0.00 0.00 175.17 175.22 2d20 s ILE 739 N 0.30 1.26 -0.10 2.11 1.01 -0.86 -1.12 121.20 123.81 2d20 s ILE 739 Ca -0.00 -0.46 -0.35 0.00 0.00 0.00 0.00 60.65 59.84 2d20 s ILE 739 Cb -0.05 -1.21 -0.12 0.00 0.01 0.00 0.00 42.46 41.08 2d20 s ILE 739 CO 0.01 0.40 1.84 1.67 0.00 0.00 0.00 174.94 178.87 2d20 n GLN 740 N 4.67 2.02 0.00 2.79 7.27 0.08 0.10 117.38 134.31 2d20 n GLN 740 Ca -0.16 0.74 0.00 0.00 0.07 0.00 0.00 57.00 57.65 2d20 n GLN 740 Cb 0.50 -2.56 0.00 0.00 2.41 0.00 0.00 30.24 30.60 2d20 n GLN 740 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2d20 n GLY 741 N 4.31 2.15 3.86 1.69 0.00 0.31 -4.40 105.19 113.11 2d20 n GLY 741 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 2d20 n GLY 741 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d20 n ALA 742 N -0.70 -1.92 -1.68 4.61 0.00 0.12 -4.87 120.51 116.06 2d20 n ALA 742 Ca 0.00 -0.18 -0.46 0.00 0.00 0.00 0.00 53.44 52.80 2d20 n ALA 742 Cb 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 19.45 17.42 2d20 n ALA 742 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2d20 n SER 743 N -2.99 3.34 -0.27 0.00 2.88 -1.26 -4.48 113.62 110.84 2d20 n SER 743 Ca -0.26 1.05 -0.05 0.00 -1.33 0.00 0.00 58.87 58.28 2d20 n SER 743 Cb 0.66 -1.44 0.06 0.00 -0.75 0.00 0.00 64.21 62.74 2d20 n SER 743 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2d20 h SER 744 N 6.91 0.89 -0.73 -3.46 0.02 -1.78 -1.11 113.55 114.28 2d20 h SER 744 Ca -0.46 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.39 2d20 h SER 744 Cb 1.25 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.54 2d20 h SER 744 CO 0.91 0.67 0.23 0.28 -1.14 0.00 0.00 176.83 177.78 2d20 h SER 745 N 1.02 1.06 -0.37 3.07 0.02 -1.89 -1.00 113.55 115.46 2d20 h SER 745 Ca 0.27 -0.21 -0.13 0.00 -0.84 0.00 0.00 61.79 60.88 2d20 h SER 745 Cb -0.07 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.19 2d20 h SER 745 CO -0.05 0.98 -0.29 0.74 -1.14 0.00 0.00 176.83 177.07 2d20 h THR 746 N 1.08 1.28 -0.78 -2.27 2.02 -1.87 0.31 112.91 112.67 2d20 h THR 746 Ca 0.24 -1.46 -0.04 0.00 0.77 0.00 0.00 66.41 65.91 2d20 h THR 746 Cb 0.30 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 2d20 h THR 746 CO -0.01 0.48 0.31 1.88 0.37 0.00 0.00 175.52 178.56 2d20 h TYR 747 N 0.64 1.18 -0.43 3.16 0.05 -1.06 -1.17 116.97 119.34 2d20 h TYR 747 Ca 0.07 -0.09 -0.11 0.00 0.05 0.00 0.00 58.73 58.65 2d20 h TYR 747 Cb 0.87 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 2d20 h TYR 747 CO 0.06 0.89 -0.17 0.00 -1.05 0.00 0.00 178.16 177.90 2d20 h ALA 748 N 1.20 0.60 -0.41 3.88 0.00 -1.03 -2.06 119.26 121.44 2d20 h ALA 748 Ca 0.26 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2d20 h ALA 748 Cb 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2d20 h ALA 748 CO -0.02 0.54 0.27 0.00 0.00 0.00 0.00 179.25 180.03 2d20 h ALA 749 N 0.84 0.51 -0.45 0.00 0.00 -0.51 0.37 119.26 120.02 2d20 h ALA 749 Ca 0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2d20 h ALA 749 Cb 0.73 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2d20 h ALA 749 CO 0.06 -0.02 0.12 0.28 0.00 0.00 0.00 179.25 179.68 2d20 h VAL 750 N 0.55 1.23 -0.87 0.00 2.07 -1.20 -1.40 116.25 116.63 2d20 h VAL 750 Ca 0.15 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.88 2d20 h VAL 750 Cb -0.05 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2d20 h VAL 750 CO -0.03 0.28 0.57 0.74 0.02 0.00 0.00 177.57 179.15 2d20 h THR 751 N 0.59 1.22 0.00 2.57 2.02 -1.06 -1.99 112.91 116.26 2d20 h THR 751 Ca 0.14 -0.41 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 2d20 h THR 751 Cb 0.31 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2d20 h THR 751 CO -0.00 0.22 -0.36 0.78 0.37 0.00 0.00 175.52 176.52 2d20 h ASN 752 N 1.18 0.00 -0.41 4.18 2.35 -0.64 -2.03 115.58 120.20 2d20 h ASN 752 Ca 0.32 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.00 2d20 h ASN 752 Cb -0.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 2d20 h ASN 752 CO -0.07 0.36 -0.00 0.44 -1.65 0.00 0.00 177.43 176.51 2d20 h ASP 753 N 0.00 0.72 -0.54 5.81 3.32 -0.51 -1.07 116.42 124.14 2d20 h ASP 753 Ca -0.00 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.63 2d20 h ASP 753 Cb 0.79 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2d20 h ASP 753 CO 0.05 0.86 -0.09 0.00 -1.72 0.00 0.00 179.24 178.34 2d20 h LEU 755 N 0.92 0.00 0.00 0.00 3.38 -1.16 -2.64 115.31 115.81 2d20 h LEU 755 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2d20 h LEU 755 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2d20 h LEU 755 CO 0.04 0.06 -0.48 0.00 0.09 0.00 0.00 178.44 178.15 2d20 h ALA 756 N 1.94 0.73 -2.96 1.53 0.00 -0.79 -3.44 119.26 116.27 2d20 h ALA 756 Ca -0.00 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 2d20 h ALA 756 Cb 0.37 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.90 2d20 h ALA 756 CO 0.01 0.00 -0.58 0.08 0.00 0.00 0.00 179.25 178.76 2d20 s VAL 757 N -3.22 4.21 0.50 0.00 1.01 -1.00 -4.98 120.40 116.92 2d20 s VAL 757 Ca 0.05 -0.77 0.22 0.00 0.00 0.00 0.00 61.98 61.49 2d20 s VAL 757 Cb 0.10 -3.25 0.38 0.00 0.00 0.00 0.00 36.38 33.61 2d20 s VAL 757 CO 0.71 -0.05 1.98 0.77 0.00 0.00 0.00 175.10 178.51 2d20 h SER 758 N 8.31 0.11 -0.03 3.32 4.64 -1.85 -0.52 113.55 127.53 2d20 h SER 758 Ca -0.28 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2d20 h SER 758 Cb 1.12 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2d20 h SER 758 CO 0.62 0.06 0.00 0.54 -0.87 0.00 0.00 176.83 177.18 2d20 n ARG 759 N -4.41 1.45 -2.59 4.77 5.12 -1.26 -4.77 116.66 114.98 2d20 n ARG 759 Ca 0.10 -0.66 -0.43 0.00 -1.93 0.00 0.00 57.85 54.94 2d20 n ARG 759 Cb 0.55 -1.46 -0.02 0.00 -1.16 0.00 0.00 32.46 30.37 2d20 n ARG 759 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2d20 h LEU 761 N 11.09 0.08 0.00 0.00 3.38 -1.36 -3.48 115.31 125.03 2d20 h LEU 761 Ca -0.23 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2d20 h LEU 761 Cb 1.06 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2d20 h LEU 761 CO 1.11 0.46 0.00 0.61 0.09 0.00 0.00 178.44 180.70 2d20 n GLY 762 N -0.38 -2.32 3.11 0.83 0.00 -1.26 -2.83 105.19 102.34 2d20 n GLY 762 Ca -0.02 -1.26 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 2d20 n GLY 762 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d20 s ILE 763 N -2.32 1.21 -0.10 -0.61 1.01 -0.95 -2.12 121.20 117.33 2d20 s ILE 763 Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.06 2d20 s ILE 763 Cb 0.00 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.44 2d20 s ILE 763 CO 0.00 0.35 -0.20 -0.89 0.00 0.00 0.00 174.94 174.20 2d20 s THR 764 N -0.12 1.81 0.02 2.92 2.01 0.13 0.01 115.64 122.42 2d20 s THR 764 Ca 0.01 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.06 2d20 s THR 764 Cb -0.08 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 2d20 s THR 764 CO 0.01 0.50 0.32 0.68 -0.69 0.00 0.00 174.62 175.44 2d20 s VAL 765 N 0.50 5.21 -1.53 3.82 -7.23 -0.24 -0.89 120.40 120.04 2d20 s VAL 765 Ca -0.16 0.37 -0.11 0.00 -1.81 0.00 0.00 61.98 60.26 2d20 s VAL 765 Cb -0.17 -3.60 -0.02 0.00 0.56 0.00 0.00 36.38 33.15 2d20 s VAL 765 CO 0.06 0.39 2.60 1.87 -0.31 0.00 0.00 175.10 179.71 2d20 n TRP 766 N 1.22 2.90 0.00 2.82 -0.00 0.32 -2.62 117.44 122.09 2d20 n TRP 766 Ca -0.11 -3.02 0.00 0.00 -0.00 0.00 0.00 57.50 54.36 2d20 n TRP 766 Cb 0.53 -2.47 0.00 0.00 -0.00 0.00 0.00 31.31 29.37 2d20 n TRP 766 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2d20 n GLY 767 N 3.66 3.55 0.02 5.87 0.00 -1.26 -4.69 105.19 112.35 2d20 n GLY 767 Ca 0.66 -1.74 -0.02 0.00 0.00 0.00 0.00 46.02 44.92 2d20 n GLY 767 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d20 n VAL 768 N -1.72 0.43 -4.14 1.61 0.31 -1.26 -4.63 118.33 108.93 2d20 n VAL 768 Ca 0.00 0.41 -0.25 0.00 -0.01 0.00 0.00 64.34 64.49 2d20 n VAL 768 Cb 0.00 -1.77 -0.06 0.00 -0.91 0.00 0.00 33.84 31.10 2d20 n VAL 768 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2d20 s ARG 769 N -1.42 2.73 0.37 5.55 0.52 -1.26 -3.63 118.95 121.80 2d20 s ARG 769 Ca -0.05 -1.02 0.11 0.00 -0.52 0.00 0.00 55.73 54.25 2d20 s ARG 769 Cb 0.01 -2.51 0.88 0.00 0.52 0.00 0.00 34.95 33.84 2d20 s ARG 769 CO 0.08 0.45 1.86 -0.44 0.02 0.00 0.00 175.30 177.27 2d20 h ASP 770 N 2.23 0.60 0.55 0.23 3.32 -1.11 0.22 116.42 122.46 2d20 h ASP 770 Ca -0.47 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2d20 h ASP 770 Cb 1.21 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.69 2d20 h ASP 770 CO 0.61 0.28 0.00 0.35 -1.72 0.00 0.00 179.24 178.76 2d20 n THR 771 N -4.57 0.98 1.00 0.35 -2.24 -1.26 -1.86 114.28 106.69 2d20 n THR 771 Ca 0.18 0.27 0.11 0.00 -2.27 0.00 0.00 64.05 62.34 2d20 n THR 771 Cb 0.53 -1.12 -0.01 0.00 -2.10 0.00 0.00 70.33 67.64 2d20 n THR 771 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2d20 n ASP 772 N -1.82 0.87 -4.77 3.42 8.00 0.77 -4.98 116.55 118.03 2d20 n ASP 772 Ca 0.03 -0.79 -0.37 0.00 0.71 0.00 0.00 54.79 54.37 2d20 n ASP 772 Cb 0.18 0.77 -0.01 0.00 -0.02 0.00 0.00 41.12 42.04 2d20 n ASP 772 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2d20 s SER 773 N -2.99 6.23 0.01 -2.24 0.15 -0.77 -4.88 113.70 109.21 2d20 s SER 773 Ca 0.09 2.28 0.18 0.00 0.70 0.00 0.00 55.95 59.20 2d20 s SER 773 Cb 0.16 -2.60 0.78 0.00 -1.71 0.00 0.00 66.02 62.65 2d20 s SER 773 CO 0.81 -0.87 1.58 -2.67 1.20 0.00 0.00 173.24 173.30 2d20 n TRP 774 N -0.44 0.04 -2.86 3.44 4.27 -1.26 -2.86 117.44 117.76 2d20 n TRP 774 Ca 0.07 0.01 -0.15 0.00 -3.89 0.00 0.00 57.50 53.54 2d20 n TRP 774 Cb 0.48 -0.52 -0.00 0.00 -1.36 0.00 0.00 31.31 29.91 2d20 n TRP 774 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2d20 n ARG 775 N -1.53 1.45 -0.08 -2.67 1.74 -1.26 -4.95 116.66 109.36 2d20 n ARG 775 Ca 0.04 -3.54 0.18 0.00 -0.77 0.00 0.00 57.85 53.76 2d20 n ARG 775 Cb 0.21 -1.59 0.60 0.00 -1.02 0.00 0.00 32.46 30.67 2d20 n ARG 775 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2d20 h SER 776 N 2.96 0.19 0.08 0.55 4.64 -1.70 -0.71 113.55 119.55 2d20 h SER 776 Ca 0.03 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2d20 h SER 776 Cb 1.03 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2d20 h SER 776 CO 0.56 0.10 -0.02 1.23 -0.87 0.00 0.00 176.83 177.83 2d20 h GLY 777 N 0.20 0.00 -1.73 -0.77 0.00 -1.90 -0.50 103.07 98.37 2d20 h GLY 777 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 2d20 h GLY 777 CO -0.06 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.70 2d20 n ASP 778 N -3.59 2.55 -3.80 0.19 8.00 -0.27 -4.95 116.55 114.69 2d20 n ASP 778 Ca -0.03 -1.98 -0.13 0.00 0.71 0.00 0.00 54.79 53.36 2d20 n ASP 778 Cb 0.11 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 2d20 n ASP 778 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2d20 n THR 779 N 0.90 -0.70 1.37 -3.53 -2.24 -0.20 -0.53 114.28 109.34 2d20 n THR 779 Ca 0.16 -0.16 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2d20 n THR 779 Cb 0.41 -0.60 0.45 0.00 -2.10 0.00 0.00 70.33 68.49 2d20 n THR 779 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2d20 n PRO 780 N -2.09 1.66 -1.91 -0.78 -0.04 -1.26 -3.42 135.00 127.15 2d20 n PRO 780 Ca -0.03 -0.98 -0.07 0.00 -0.04 0.00 0.00 63.50 62.38 2d20 n PRO 780 Cb 0.16 -1.42 0.01 0.00 -0.04 0.00 0.00 33.50 32.21 2d20 n PRO 780 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2d20 n LEU 781 N 0.19 0.00 0.01 1.53 4.77 -1.26 -2.02 117.00 120.22 2d20 n LEU 781 Ca 0.17 -0.83 0.11 0.00 -0.03 0.00 0.00 56.01 55.43 2d20 n LEU 781 Cb 0.32 -0.07 0.12 0.00 -2.33 0.00 0.00 43.42 41.46 2d20 n LEU 781 CO 0.14 -0.46 0.25 0.18 -1.33 0.00 0.00 177.39 176.17 2d20 n LEU 782 N 0.00 0.64 -4.19 2.23 4.77 -1.26 -4.84 117.00 114.35 2d20 n LEU 782 Ca 0.02 -0.09 -0.24 0.00 -0.03 0.00 0.00 56.01 55.67 2d20 n LEU 782 Cb 0.19 -0.16 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 2d20 n LEU 782 CO 0.12 0.12 -0.50 -0.36 -1.33 0.00 0.00 177.39 175.44 2d20 s PHE 783 N -3.05 1.58 0.76 -1.77 0.40 -1.24 -1.60 117.98 113.06 2d20 s PHE 783 Ca 0.09 -0.34 -0.02 0.00 -0.60 0.00 0.00 56.93 56.06 2d20 s PHE 783 Cb 0.16 -0.97 0.15 0.00 0.51 0.00 0.00 43.02 42.88 2d20 s PHE 783 CO 0.76 0.03 1.04 0.27 0.70 0.00 0.00 175.22 178.02 2d20 n ASN 784 N 2.18 1.18 -0.24 1.36 0.23 -0.74 -0.67 115.26 118.56 2d20 n ASN 784 Ca -0.16 -2.05 0.05 0.00 -0.53 0.00 0.00 54.58 51.89 2d20 n ASN 784 Cb 0.54 -0.69 0.17 0.00 -2.08 0.00 0.00 39.78 37.72 2d20 n ASN 784 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2d20 h GLY 785 N -0.74 0.98 0.03 4.83 0.00 -1.92 0.67 103.07 106.92 2d20 h GLY 785 Ca -0.34 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2d20 h GLY 785 CO 0.35 -0.20 0.00 2.09 0.00 0.00 0.00 176.54 178.78 2d20 n ASP 786 N -5.17 0.00 0.00 0.19 5.68 -1.26 -4.86 116.55 111.13 2d20 n ASP 786 Ca 0.14 -1.82 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 2d20 n ASP 786 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 2d20 n ASP 786 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2d20 n GLY 787 N 0.43 0.73 3.80 6.12 0.00 0.23 -5.04 105.19 111.47 2d20 n GLY 787 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2d20 n GLY 787 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d20 s SER 788 N -2.46 7.10 0.21 1.61 1.04 -1.26 -4.75 113.70 115.19 2d20 s SER 788 Ca 0.00 1.76 -0.30 0.00 0.48 0.00 0.00 55.95 57.89 2d20 s SER 788 Cb 0.00 -2.56 -0.09 0.00 0.10 0.00 0.00 66.02 63.47 2d20 s SER 788 CO 0.00 -0.24 1.30 -0.54 0.98 0.00 0.00 173.24 174.74 2d20 s LYS 789 N -2.68 4.39 0.62 4.02 1.02 -1.26 -1.78 119.74 124.07 2d20 s LYS 789 Ca 0.57 2.05 -0.03 0.00 0.02 0.00 0.00 55.97 58.58 2d20 s LYS 789 Cb -0.13 -3.19 0.04 0.00 -0.52 0.00 0.00 37.83 34.03 2d20 s LYS 789 CO 0.18 -0.24 0.89 0.15 -0.92 0.00 0.00 175.35 175.41 2d20 s LYS 790 N -0.23 2.43 0.34 1.68 1.02 -0.63 -4.81 119.74 119.54 2d20 s LYS 790 Ca 0.56 -0.48 0.06 0.00 0.02 0.00 0.00 55.97 56.12 2d20 s LYS 790 Cb -0.36 -2.33 0.71 0.00 -0.52 0.00 0.00 37.83 35.32 2d20 s LYS 790 CO 0.39 -0.94 1.90 0.00 -0.92 0.00 0.00 175.35 175.78 2d20 h ALA 791 N -0.24 1.70 -0.08 5.17 0.00 -1.85 -0.50 119.26 123.46 2d20 h ALA 791 Ca -0.43 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 2d20 h ALA 791 Cb 1.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2d20 h ALA 791 CO 0.57 0.11 -0.11 0.00 0.00 0.00 0.00 179.25 179.82 2d20 h ALA 792 N 1.57 1.69 -0.19 0.00 0.00 -1.86 -2.50 119.26 117.96 2d20 h ALA 792 Ca 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2d20 h ALA 792 Cb 0.47 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2d20 h ALA 792 CO -0.17 0.23 0.12 -0.92 0.00 0.00 0.00 179.25 178.51 2d20 h TYR 793 N 0.11 0.24 -0.62 0.00 5.03 -1.28 -0.67 116.97 119.79 2d20 h TYR 793 Ca 0.02 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 2d20 h TYR 793 Cb 0.26 -0.08 -0.03 0.00 1.55 0.00 0.00 36.73 38.43 2d20 h TYR 793 CO 0.00 0.17 0.25 1.15 -1.32 0.00 0.00 178.16 178.41 2d20 h THR 794 N 0.25 1.22 -0.58 1.81 2.02 -1.46 -0.29 112.91 115.88 2d20 h THR 794 Ca 0.07 -0.68 -0.05 0.00 0.77 0.00 0.00 66.41 66.52 2d20 h THR 794 Cb -0.01 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2d20 h THR 794 CO -0.01 0.27 0.16 0.00 0.37 0.00 0.00 175.52 176.31 2d20 h ALA 795 N 1.38 0.76 -0.16 6.16 0.00 -1.03 -0.33 119.26 126.03 2d20 h ALA 795 Ca 0.21 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2d20 h ALA 795 Cb 0.17 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2d20 h ALA 795 CO -0.02 0.44 -0.09 0.28 0.00 0.00 0.00 179.25 179.86 2d20 h VAL 796 N 0.82 1.32 -0.54 0.00 2.07 -0.73 -2.05 116.25 117.13 2d20 h VAL 796 Ca 0.18 -1.16 0.03 0.00 0.82 0.00 0.00 66.70 66.58 2d20 h VAL 796 Cb 0.31 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 2d20 h VAL 796 CO -0.00 0.34 0.31 0.25 0.02 0.00 0.00 177.57 178.49 2d20 h LEU 797 N 0.00 0.48 -0.56 2.57 5.85 -0.96 -0.81 115.31 121.89 2d20 h LEU 797 Ca 0.03 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.78 2d20 h LEU 797 Cb 0.57 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2d20 h LEU 797 CO 0.03 0.33 0.35 -1.13 -0.34 0.00 0.00 178.44 177.68 2d20 h ASN 798 N 0.60 0.60 -0.27 1.25 -1.24 -1.03 -1.17 115.58 114.32 2d20 h ASN 798 Ca 0.23 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.22 2d20 h ASN 798 Cb 0.07 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 2d20 h ASN 798 CO -0.12 0.42 0.15 0.00 -1.29 0.00 0.00 177.43 176.59 2d20 h ALA 799 N 1.22 0.35 -0.77 1.57 0.00 -0.80 0.32 119.26 121.17 2d20 h ALA 799 Ca 0.21 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2d20 h ALA 799 Cb -0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2d20 h ALA 799 CO -0.07 -0.11 0.51 -0.07 0.00 0.00 0.00 179.25 179.51 2d20 h LEU 800 N 0.33 0.86 0.00 0.00 3.38 -0.90 -1.12 115.31 117.86 2d20 h LEU 800 Ca 0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2d20 h LEU 800 Cb 0.07 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2d20 h LEU 800 CO -0.01 0.62 0.00 0.59 0.09 0.00 0.00 178.44 179.72 2d20 n ASN 801 N -4.43 0.00 0.00 -0.43 3.02 -0.47 -4.74 115.26 108.21 2d20 n ASN 801 Ca 0.09 -1.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.08 2d20 n ASN 801 Cb 0.05 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2d20 n ASN 801 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d20 n GLY 802 N 0.67 1.02 0.82 7.41 0.00 -0.42 -5.06 105.19 109.63 2d20 n GLY 802 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.22 2d20 n GLY 802 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d20 n GLY 803 N -1.42 -2.70 0.00 -0.02 0.00 0.11 -4.95 105.19 96.21 2d20 n GLY 803 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2d20 n GLY 803 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d20 n GLY 813 N -3.44 1.30 3.91 -0.02 0.00 -0.37 -5.00 105.19 101.57 2d20 n GLY 813 Ca -0.04 -2.11 -0.27 0.00 0.00 0.00 0.00 46.02 43.60 2d20 n GLY 813 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d20 s GLN 814 N -1.61 3.31 -0.46 1.61 -0.21 -1.19 0.17 119.66 121.28 2d20 s GLN 814 Ca 0.00 0.13 0.02 0.00 0.02 0.00 0.00 55.36 55.54 2d20 s GLN 814 Cb 0.00 -2.33 0.14 0.00 1.00 0.00 0.00 33.01 31.82 2d20 s GLN 814 CO 0.00 -0.40 0.25 0.42 -2.12 0.00 0.00 175.29 173.45 2d20 s ILE 815 N -2.84 1.55 0.05 1.08 1.01 -1.26 -2.99 121.20 117.79 2d20 s ILE 815 Ca 0.50 -2.71 -0.28 0.00 0.00 0.00 0.00 60.65 58.16 2d20 s ILE 815 Cb -0.10 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.23 2d20 s ILE 815 CO 0.45 -0.90 0.88 -0.75 0.00 0.00 0.00 174.94 174.62 2d20 s LYS 816 N 0.20 4.58 -0.03 2.79 2.20 -0.84 -1.46 119.74 127.19 2d20 s LYS 816 Ca 0.18 1.28 -0.23 0.00 -0.36 0.00 0.00 55.97 56.84 2d20 s LYS 816 Cb -0.23 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 2d20 s LYS 816 CO -0.01 0.16 0.68 0.20 -0.36 0.00 0.00 175.35 176.02 2d20 s GLY 817 N 0.30 2.65 0.21 5.54 0.00 0.43 0.54 107.32 116.99 2d20 s GLY 817 Ca 0.45 0.13 -0.30 0.00 0.00 0.00 0.00 44.72 45.00 2d20 s GLY 817 CO 0.26 1.06 1.39 0.14 0.00 0.00 0.00 173.10 175.95 2d20 s VAL 818 N 0.41 2.94 0.00 1.40 1.01 -0.01 -0.65 120.40 125.50 2d20 s VAL 818 Ca 0.36 0.77 0.00 0.00 0.00 0.00 0.00 61.98 63.11 2d20 s VAL 818 Cb -0.18 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2d20 s VAL 818 CO 0.19 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.01 2d20 n GLY 819 N 2.43 2.55 0.19 4.51 0.00 -1.26 -4.29 105.19 109.31 2d20 n GLY 819 Ca 0.07 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2d20 n GLY 819 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d20 h SER 820 N 0.00 0.53 0.00 1.61 4.64 -1.85 -3.47 113.55 115.02 2d20 h SER 820 Ca 0.00 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2d20 h SER 820 Cb 0.00 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 2d20 h SER 820 CO 0.00 1.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.60 2d20 n GLY 821 N 0.39 0.65 3.94 -0.77 0.00 0.17 -4.93 105.19 104.65 2d20 n GLY 821 Ca -0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 2d20 n GLY 821 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d20 s ARG 822 N -0.30 3.47 0.22 1.61 0.52 -1.25 -4.72 118.95 118.50 2d20 s ARG 822 Ca 0.00 -0.53 -0.01 0.00 -0.52 0.00 0.00 55.73 54.67 2d20 s ARG 822 Cb 0.00 -2.89 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 2d20 s ARG 822 CO 0.00 0.44 0.42 0.00 0.02 0.00 0.00 175.30 176.18 2d20 s LEU 824 N -3.42 4.32 0.02 0.00 2.96 -0.53 -1.57 118.68 120.45 2d20 s LEU 824 Ca 0.39 2.34 0.04 0.00 -0.22 0.00 0.00 54.13 56.68 2d20 s LEU 824 Cb -0.11 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 2d20 s LEU 824 CO 0.29 -1.01 -0.13 -0.62 -1.32 0.00 0.00 176.35 173.57 2d20 s ASP 825 N 3.85 1.55 -0.41 3.68 -1.08 0.19 -4.51 116.67 119.94 2d20 s ASP 825 Ca 0.79 -0.37 -0.18 0.00 -0.52 0.00 0.00 52.55 52.27 2d20 s ASP 825 Cb -0.36 -0.12 0.01 0.00 -1.46 0.00 0.00 42.92 40.99 2d20 s ASP 825 CO 0.33 0.07 0.51 -0.69 0.52 0.00 0.00 175.17 175.92 2d20 s VAL 826 N -0.64 5.00 -0.36 1.11 1.01 -0.86 -0.65 120.40 125.01 2d20 s VAL 826 Ca 0.02 -0.03 -0.43 0.00 0.00 0.00 0.00 61.98 61.54 2d20 s VAL 826 Cb -0.07 -4.06 -0.19 0.00 0.00 0.00 0.00 36.38 32.06 2d20 s VAL 826 CO 0.01 -0.41 1.40 -2.65 0.00 0.00 0.00 175.10 173.44 2d20 n PRO 827 N 5.82 0.00 -1.61 2.72 -0.02 -1.26 -0.56 135.00 140.09 2d20 n PRO 827 Ca -0.05 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.25 2d20 n PRO 827 Cb 0.48 -1.43 -0.07 0.00 -0.02 0.00 0.00 33.50 32.46 2d20 n PRO 827 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2d20 n ASN 828 N 3.22 -4.80 -2.80 2.55 5.03 -1.26 -1.69 115.26 115.51 2d20 n ASN 828 Ca 0.27 0.41 -0.20 0.00 0.87 0.00 0.00 54.58 55.93 2d20 n ASN 828 Cb -0.02 -4.27 0.01 0.00 -1.02 0.00 0.00 39.78 34.47 2d20 n ASN 828 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2d20 n ALA 829 N 0.74 -0.86 -1.76 5.41 0.00 0.28 -4.93 120.51 119.38 2d20 n ALA 829 Ca -0.18 0.18 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2d20 n ALA 829 Cb 0.60 -2.74 0.00 0.00 0.00 0.00 0.00 19.45 17.31 2d20 n ALA 829 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2d20 s SER 830 N -2.40 5.75 -0.06 0.00 0.15 -0.68 -4.95 113.70 111.51 2d20 s SER 830 Ca 0.18 2.15 0.10 0.00 0.70 0.00 0.00 55.95 59.07 2d20 s SER 830 Cb -0.09 -2.58 0.21 0.00 -1.71 0.00 0.00 66.02 61.86 2d20 s SER 830 CO 0.22 -1.20 1.14 0.35 1.20 0.00 0.00 173.24 174.96 2d20 n THR 831 N -1.32 1.45 -2.60 6.45 -2.24 -1.26 -4.90 114.28 109.86 2d20 n THR 831 Ca 0.11 -1.51 -0.42 0.00 -2.27 0.00 0.00 64.05 59.96 2d20 n THR 831 Cb 0.51 0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 2d20 n THR 831 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2d20 s THR 832 N -1.83 4.57 0.34 4.28 2.01 -1.26 -5.00 115.64 118.75 2d20 s THR 832 Ca 0.19 1.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.75 2d20 s THR 832 Cb 0.15 -4.19 -0.11 0.00 0.01 0.00 0.00 72.50 68.36 2d20 s THR 832 CO 0.05 0.06 1.55 0.47 -0.69 0.00 0.00 174.62 176.05 2d20 n ASP 833 N 4.62 3.87 0.00 3.53 8.00 -1.26 -2.36 116.55 132.95 2d20 n ASP 833 Ca 0.09 1.19 0.00 0.00 0.71 0.00 0.00 54.79 56.78 2d20 n ASP 833 Cb 0.48 -1.62 0.00 0.00 -0.02 0.00 0.00 41.12 39.97 2d20 n ASP 833 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d20 n GLY 834 N 1.22 0.58 3.65 0.44 0.00 -0.02 -5.01 105.19 106.05 2d20 n GLY 834 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2d20 n GLY 834 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d20 s THR 835 N -2.34 4.32 0.25 2.61 2.01 -0.99 -4.82 115.64 116.68 2d20 s THR 835 Ca 0.00 1.56 -0.30 0.00 0.31 0.00 0.00 61.69 63.26 2d20 s THR 835 Cb 0.00 -4.15 -0.09 0.00 0.01 0.00 0.00 72.50 68.27 2d20 s THR 835 CO 0.00 -0.30 1.12 -1.58 -0.69 0.00 0.00 174.62 173.18 2d20 s GLN 836 N 3.69 4.60 0.64 4.92 0.74 -1.26 -1.93 119.66 131.06 2d20 s GLN 836 Ca 0.52 1.82 -0.09 0.00 0.05 0.00 0.00 55.36 57.66 2d20 s GLN 836 Cb -0.18 -3.21 0.01 0.00 1.10 0.00 0.00 33.01 30.73 2d20 s GLN 836 CO 0.16 0.13 1.00 0.14 -0.55 0.00 0.00 175.29 176.17 2d20 s VAL 837 N -0.84 3.71 0.27 1.34 -7.23 -0.46 -4.47 120.40 112.72 2d20 s VAL 837 Ca 0.47 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 60.94 2d20 s VAL 837 Cb -0.32 -3.51 0.00 0.00 0.56 0.00 0.00 36.38 33.11 2d20 s VAL 837 CO 0.40 -0.61 0.34 0.00 -0.31 0.00 0.00 175.10 174.92 2d20 n GLN 838 N -2.78 0.50 -4.00 4.82 10.64 0.17 -1.84 117.38 124.89 2d20 n GLN 838 Ca 0.06 -2.23 -0.35 0.00 -1.83 0.00 0.00 57.00 52.64 2d20 n GLN 838 Cb 0.57 2.08 -0.06 0.00 -0.86 0.00 0.00 30.24 31.97 2d20 n GLN 838 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2d20 s LEU 839 N 0.00 4.18 0.08 2.61 1.43 -0.05 0.57 118.68 127.50 2d20 s LEU 839 Ca 0.24 0.35 -0.26 0.00 -1.03 0.00 0.00 54.13 53.43 2d20 s LEU 839 Cb -0.00 -2.16 0.07 0.00 0.03 0.00 0.00 46.19 44.13 2d20 s LEU 839 CO 0.17 0.36 0.62 -0.47 0.23 0.00 0.00 176.35 177.26 2d20 s TYR 840 N -1.08 -0.57 -0.14 0.29 5.04 -0.61 -2.09 117.35 118.18 2d20 s TYR 840 Ca 0.18 0.63 -0.39 0.00 -2.44 0.00 0.00 57.07 55.04 2d20 s TYR 840 Cb -0.12 0.49 -0.16 0.00 0.35 0.00 0.00 41.96 42.51 2d20 s TYR 840 CO 0.08 -0.75 1.56 -0.25 -1.34 0.00 0.00 175.55 174.85 2d20 n ASP 841 N 0.14 1.95 -4.70 4.32 8.00 -1.26 -1.13 116.55 123.87 2d20 n ASP 841 Ca -0.18 1.10 -0.42 0.00 0.71 0.00 0.00 54.79 56.00 2d20 n ASP 841 Cb 0.62 -1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 40.55 2d20 n ASP 841 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d20 s HIS 843 N 2.24 -0.24 -1.02 0.00 -3.43 -1.26 -5.05 115.29 106.53 2d20 s HIS 843 Ca 0.70 -0.01 -0.25 0.00 -0.80 0.00 0.00 55.06 54.70 2d20 s HIS 843 Cb -0.38 0.28 -0.16 0.00 -1.43 0.00 0.00 32.58 30.89 2d20 s HIS 843 CO 0.31 -0.69 2.12 0.45 -2.00 0.00 0.00 174.74 174.93 2d20 s SER 844 N -2.64 4.07 -0.01 7.38 0.15 -1.26 -4.85 113.70 116.54 2d20 s SER 844 Ca 0.01 -0.88 -0.01 0.00 0.70 0.00 0.00 55.95 55.77 2d20 s SER 844 Cb 0.01 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2d20 s SER 844 CO -0.10 -3.98 0.02 0.00 1.20 0.00 0.00 173.24 170.38 2d20 s ALA 845 N 14.46 -0.05 0.45 5.45 0.00 -1.26 -5.05 121.76 135.77 2d20 s ALA 845 Ca 0.80 -0.00 0.12 0.00 0.00 0.00 0.00 51.96 52.87 2d20 s ALA 845 Cb -0.06 -0.02 1.03 0.00 0.00 0.00 0.00 23.12 24.07 2d20 s ALA 845 CO 0.13 -0.03 2.07 1.79 0.00 0.00 0.00 175.76 179.71 2d20 h THR 846 N 5.04 1.07 0.00 0.00 1.35 -1.95 -1.89 112.91 116.53 2d20 h THR 846 Ca -0.25 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 2d20 h THR 846 Cb 1.21 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2d20 h THR 846 CO 0.48 0.09 0.00 -0.46 -0.25 0.00 0.00 175.52 175.38 2d20 n ASN 847 N -4.46 0.46 0.00 5.36 6.94 -1.26 -1.76 115.26 120.54 2d20 n ASN 847 Ca -0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 54.58 53.19 2d20 n ASN 847 Cb 0.12 -0.23 0.00 0.00 -2.36 0.00 0.00 39.78 37.31 2d20 n ASN 847 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2d20 n GLN 848 N -0.06 -0.03 -3.20 -3.83 6.02 -0.72 -2.02 117.38 113.53 2d20 n GLN 848 Ca 0.00 -0.05 -0.44 0.00 -0.01 0.00 0.00 57.00 56.50 2d20 n GLN 848 Cb 0.11 -0.52 -0.06 0.00 1.02 0.00 0.00 30.24 30.79 2d20 n GLN 848 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2d20 s GLN 849 N -0.00 3.07 -0.07 -1.09 -1.52 -0.72 -3.96 119.66 115.37 2d20 s GLN 849 Ca 0.00 -1.13 -0.02 0.00 -1.95 0.00 0.00 55.36 52.27 2d20 s GLN 849 Cb 0.00 -4.15 -0.03 0.00 -0.22 0.00 0.00 33.01 28.60 2d20 s GLN 849 CO 0.00 -1.26 0.02 -1.58 -0.25 0.00 0.00 175.29 172.23 2d20 s TRP 850 N 2.38 3.20 -0.18 0.91 0.52 0.13 -4.45 118.94 121.45 2d20 s TRP 850 Ca 0.11 0.21 0.00 0.00 0.02 0.00 0.00 56.10 56.45 2d20 s TRP 850 Cb -0.22 -1.78 0.01 0.00 -1.15 0.00 0.00 33.47 30.33 2d20 s TRP 850 CO 0.09 0.50 -0.18 0.99 0.02 0.00 0.00 176.95 178.38 2d20 s THR 851 N -0.96 2.29 -0.30 2.01 2.01 0.24 -1.24 115.64 119.68 2d20 s THR 851 Ca 0.15 -0.87 -0.22 0.00 0.31 0.00 0.00 61.69 61.06 2d20 s THR 851 Cb -0.11 -1.97 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 2d20 s THR 851 CO 0.05 0.52 0.72 -0.47 -0.69 0.00 0.00 174.62 174.75 2d20 s TYR 852 N 1.21 3.22 0.55 4.92 5.04 -1.26 -0.82 117.35 130.21 2d20 s TYR 852 Ca 0.03 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.40 2d20 s TYR 852 Cb -0.14 -3.09 0.03 0.00 0.35 0.00 0.00 41.96 39.11 2d20 s TYR 852 CO -0.09 -0.51 0.78 0.95 -1.34 0.00 0.00 175.55 175.35 2d20 s THR 853 N 2.78 2.87 0.36 4.34 -4.23 -0.53 -4.95 115.64 116.28 2d20 s THR 853 Ca 0.29 -0.59 0.38 0.00 -1.18 0.00 0.00 61.69 60.60 2d20 s THR 853 Cb -0.15 -3.09 0.41 0.00 1.34 0.00 0.00 72.50 71.02 2d20 s THR 853 CO 0.12 -0.07 2.16 0.44 -0.54 0.00 0.00 174.62 176.73 2d20 h ASP 854 N 0.06 0.00 0.91 3.99 3.32 -1.96 -0.82 116.42 121.91 2d20 h ASP 854 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2d20 h ASP 854 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2d20 h ASP 854 CO 0.54 0.01 -0.28 0.00 -1.72 0.00 0.00 179.24 177.79 2d20 n ALA 855 N -2.10 2.81 -0.07 3.45 0.00 -1.26 -2.23 120.51 121.10 2d20 n ALA 855 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2d20 n ALA 855 Cb 0.20 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2d20 n ALA 855 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d20 n GLY 856 N 1.43 0.96 3.89 0.00 0.00 -0.31 -4.74 105.19 106.42 2d20 n GLY 856 Ca 0.06 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2d20 n GLY 856 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2d20 s GLU 857 N -0.86 3.63 -0.41 1.61 2.02 -1.26 0.26 118.70 123.70 2d20 s GLU 857 Ca 0.00 0.39 0.02 0.00 0.02 0.00 0.00 54.97 55.40 2d20 s GLU 857 Cb 0.00 -2.32 0.11 0.00 0.10 0.00 0.00 34.13 32.02 2d20 s GLU 857 CO 0.00 -0.22 0.15 -0.51 0.02 0.00 0.00 175.26 174.70 2d20 s LEU 858 N -4.54 4.84 0.22 1.80 1.43 -1.26 -1.46 118.68 119.71 2d20 s LEU 858 Ca 0.50 -2.32 -0.08 0.00 -1.03 0.00 0.00 54.13 51.20 2d20 s LEU 858 Cb -0.10 -1.70 -0.06 0.00 0.03 0.00 0.00 46.19 44.36 2d20 s LEU 858 CO 0.42 -0.39 0.50 -0.13 0.23 0.00 0.00 176.35 176.98 2d20 s ARG 859 N 0.69 3.72 -0.04 1.70 0.52 0.00 -1.22 118.95 124.33 2d20 s ARG 859 Ca 0.12 0.13 -0.07 0.00 -0.52 0.00 0.00 55.73 55.39 2d20 s ARG 859 Cb -0.21 -2.70 0.01 0.00 0.52 0.00 0.00 34.95 32.57 2d20 s ARG 859 CO -0.05 0.34 0.17 0.54 0.02 0.00 0.00 175.30 176.32 2d20 s VAL 860 N -1.82 0.04 0.00 3.52 0.11 -0.50 -0.60 120.40 121.15 2d20 s VAL 860 Ca 0.45 -0.33 0.00 0.00 -2.93 0.00 0.00 61.98 59.17 2d20 s VAL 860 Cb -0.11 -0.36 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 2d20 s VAL 860 CO 0.24 -0.18 0.00 -1.22 -3.33 0.00 0.00 175.10 170.60 2d20 n TYR 861 N 2.21 0.00 0.00 1.54 4.01 -1.26 -1.99 117.16 121.67 2d20 n TYR 861 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2d20 n TYR 861 Cb 0.57 -0.88 0.00 0.00 -0.31 0.00 0.00 39.34 38.73 2d20 n TYR 861 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d20 n GLY 862 N -1.84 2.91 0.34 2.72 0.00 -1.26 -4.71 105.19 103.35 2d20 n GLY 862 Ca 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 46.02 45.27 2d20 n GLY 862 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d20 n ASP 863 N 1.29 0.81 -4.62 1.61 2.03 -1.24 -5.05 116.55 111.38 2d20 n ASP 863 Ca 0.00 -2.34 -0.32 0.00 0.52 0.00 0.00 54.79 52.65 2d20 n ASP 863 Cb 0.00 -0.27 -0.10 0.00 -0.72 0.00 0.00 41.12 40.03 2d20 n ASP 863 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2d20 s LYS 864 N -0.97 2.63 0.02 -0.67 -0.14 -0.84 -2.58 119.74 117.19 2d20 s LYS 864 Ca 0.11 -0.69 0.08 0.00 -1.36 0.00 0.00 55.97 54.11 2d20 s LYS 864 Cb 0.09 -2.56 -0.02 0.00 -1.68 0.00 0.00 37.83 33.66 2d20 s LYS 864 CO 0.01 0.61 -0.24 0.00 -0.76 0.00 0.00 175.35 174.97 2d20 s LEU 866 N -0.97 4.38 0.01 0.00 2.96 -0.36 -1.77 118.68 122.94 2d20 s LEU 866 Ca 0.10 2.64 0.03 0.00 -0.22 0.00 0.00 54.13 56.68 2d20 s LEU 866 Cb -0.09 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 2d20 s LEU 866 CO 0.01 -0.94 -0.10 -0.62 -1.32 0.00 0.00 176.35 173.38 2d20 s ASP 867 N 2.32 1.20 -0.17 3.68 -1.08 0.47 -4.46 116.67 118.63 2d20 s ASP 867 Ca 0.76 -0.31 0.01 0.00 -0.52 0.00 0.00 52.55 52.49 2d20 s ASP 867 Cb -0.43 -0.09 0.01 0.00 -1.46 0.00 0.00 42.92 40.94 2d20 s ASP 867 CO 0.34 0.04 -0.18 0.00 0.52 0.00 0.00 175.17 175.89 2d20 s ALA 868 N -0.58 2.40 -2.12 3.66 0.00 -0.86 0.12 121.76 124.38 2d20 s ALA 868 Ca 0.01 -1.14 0.30 0.00 0.00 0.00 0.00 51.96 51.13 2d20 s ALA 868 Cb -0.06 -1.19 1.43 0.00 0.00 0.00 0.00 23.12 23.30 2d20 s ALA 868 CO 0.00 -0.19 1.96 0.00 0.00 0.00 0.00 175.76 177.54 2d20 n ALA 869 N 4.35 2.66 -3.86 0.00 0.00 -1.25 -4.83 120.51 117.58 2d20 n ALA 869 Ca -0.20 -0.31 -0.11 0.00 0.00 0.00 0.00 53.44 52.82 2d20 n ALA 869 Cb 0.51 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 2d20 n ALA 869 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d20 n GLY 870 N 1.13 2.25 0.00 0.00 0.00 -1.26 -5.07 105.19 102.23 2d20 n GLY 870 Ca 0.20 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2d20 n GLY 870 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2d20 n THR 871 N -0.48 0.00 -2.71 2.61 -2.24 -1.26 -4.86 114.28 105.33 2d20 n THR 871 Ca 0.00 -0.46 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 2d20 n THR 871 Cb 0.49 1.02 0.04 0.00 -2.10 0.00 0.00 70.33 69.78 2d20 n THR 871 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2d20 s GLY 872 N -0.62 1.83 0.53 3.38 0.00 -1.26 -4.81 107.32 106.37 2d20 s GLY 872 Ca 0.00 -1.48 -0.22 0.00 0.00 0.00 0.00 44.72 43.02 2d20 s GLY 872 CO 0.00 -1.17 1.36 -1.31 0.00 0.00 0.00 173.10 171.99 2d20 s ASN 873 N -4.47 5.37 0.00 1.64 0.01 -1.26 -2.33 114.94 113.90 2d20 s ASN 873 Ca 0.58 2.78 0.00 0.00 -0.71 0.00 0.00 52.86 55.51 2d20 s ASN 873 Cb -0.09 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.93 2d20 s ASN 873 CO 0.38 -1.51 0.00 0.61 -1.51 0.00 0.00 177.10 175.08 2d20 n GLY 874 N 0.70 1.82 3.68 0.66 0.00 -0.25 -4.99 105.19 106.81 2d20 n GLY 874 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.66 2d20 n GLY 874 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2d20 n THR 875 N -2.00 0.04 -2.35 2.61 -1.04 -0.98 -4.69 114.28 105.87 2d20 n THR 875 Ca 0.00 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 2d20 n THR 875 Cb 0.00 -1.63 -0.03 0.00 -1.82 0.00 0.00 70.33 66.85 2d20 n THR 875 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2d20 s LYS 876 N 1.15 4.51 -0.25 -2.82 -2.85 -1.26 -0.78 119.74 117.44 2d20 s LYS 876 Ca 0.79 1.93 -0.11 0.00 -1.00 0.00 0.00 55.97 57.58 2d20 s LYS 876 Cb -0.65 -3.19 -0.05 0.00 -2.06 0.00 0.00 37.83 31.88 2d20 s LYS 876 CO 0.38 -0.01 0.18 0.08 0.10 0.00 0.00 175.35 176.08 2d20 s VAL 877 N -0.65 5.34 0.00 1.79 1.01 -0.99 -3.90 120.40 123.01 2d20 s VAL 877 Ca 0.49 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2d20 s VAL 877 Cb -0.34 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2d20 s VAL 877 CO 0.41 0.31 0.00 0.00 0.00 0.00 0.00 175.10 175.83 2d20 n GLN 878 N 4.53 0.38 -4.55 2.72 10.64 0.12 -1.36 117.38 129.87 2d20 n GLN 878 Ca -0.14 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.72 2d20 n GLN 878 Cb 0.52 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.78 2d20 n GLN 878 CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 2d20 s ILE 879 N -1.71 3.11 0.09 -0.39 -4.36 -0.81 0.18 121.20 117.29 2d20 s ILE 879 Ca 0.00 -1.08 -0.21 0.00 -0.26 0.00 0.00 60.65 59.10 2d20 s ILE 879 Cb 0.00 -2.34 0.05 0.00 1.25 0.00 0.00 42.46 41.42 2d20 s ILE 879 CO 0.00 0.32 0.51 -0.47 0.24 0.00 0.00 174.94 175.55 2d20 s TYR 880 N -0.98 -0.40 0.26 1.37 5.04 -0.73 -0.84 117.35 121.07 2d20 s TYR 880 Ca 0.16 0.33 -0.30 0.00 -2.44 0.00 0.00 57.07 54.82 2d20 s TYR 880 Cb -0.11 0.37 -0.14 0.00 0.35 0.00 0.00 41.96 42.44 2d20 s TYR 880 CO 0.07 -0.70 1.22 0.43 -1.34 0.00 0.00 175.55 175.23 2d20 n SER 881 N 0.11 2.08 -4.72 4.32 7.64 -1.26 -0.28 113.62 121.51 2d20 n SER 881 Ca -0.18 1.17 -0.42 0.00 1.01 0.00 0.00 58.87 60.45 2d20 n SER 881 Cb 0.62 -1.36 -0.03 0.00 -1.01 0.00 0.00 64.21 62.43 2d20 n SER 881 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d20 n TRP 883 N 3.60 0.00 -0.41 0.00 4.27 -1.26 -5.03 117.44 118.61 2d20 n TRP 883 Ca 0.09 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.70 2d20 n TRP 883 Cb 0.44 0.01 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 2d20 n TRP 883 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2d20 n GLY 884 N 0.00 0.78 3.75 -1.67 0.00 -1.26 -5.06 105.19 101.73 2d20 n GLY 884 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2d20 n GLY 884 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2d20 s GLY 885 N -1.91 2.66 0.45 -0.02 0.00 -1.26 -4.88 107.32 102.37 2d20 s GLY 885 Ca 0.00 0.95 0.31 0.00 0.00 0.00 0.00 44.72 45.98 2d20 s GLY 885 CO 0.00 1.34 1.94 -0.55 0.00 0.00 0.00 173.10 175.83 2d20 h ASP 886 N 0.78 0.00 -0.02 1.64 3.32 -1.97 0.60 116.42 120.77 2d20 h ASP 886 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2d20 h ASP 886 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2d20 h ASP 886 CO 0.55 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.61 2d20 n ASN 887 N -2.68 0.21 -0.02 6.45 6.94 -1.26 -2.44 115.26 122.46 2d20 n ASN 887 Ca -0.00 -1.38 0.02 0.00 -0.02 0.00 0.00 54.58 53.20 2d20 n ASN 887 Cb 0.16 -0.01 0.03 0.00 -2.36 0.00 0.00 39.78 37.60 2d20 n ASN 887 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2d20 n GLN 888 N -0.69 2.61 -4.74 -3.83 6.02 0.20 -2.03 117.38 114.92 2d20 n GLN 888 Ca 0.16 -1.72 -0.32 0.00 -0.01 0.00 0.00 57.00 55.11 2d20 n GLN 888 Cb 0.11 -1.10 -0.12 0.00 1.02 0.00 0.00 30.24 30.14 2d20 n GLN 888 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2d20 s LYS 889 N -1.38 2.38 0.05 -1.09 1.02 -1.02 -4.17 119.74 115.52 2d20 s LYS 889 Ca 0.07 -0.79 0.01 0.00 0.02 0.00 0.00 55.97 55.28 2d20 s LYS 889 Cb 0.06 -2.34 -0.03 0.00 -0.52 0.00 0.00 37.83 35.00 2d20 s LYS 889 CO 0.01 0.59 -0.06 -1.58 -0.92 0.00 0.00 175.35 173.39 2d20 s TRP 890 N -0.84 0.58 -0.17 3.18 0.52 0.14 -1.27 118.94 121.08 2d20 s TRP 890 Ca 0.14 -0.67 -0.01 0.00 0.02 0.00 0.00 56.10 55.57 2d20 s TRP 890 Cb -0.11 -0.37 -0.01 0.00 -1.15 0.00 0.00 33.47 31.84 2d20 s TRP 890 CO 0.03 -0.17 -0.12 1.03 0.02 0.00 0.00 176.95 177.74 2d20 s ARG 891 N -2.33 3.29 -0.58 4.98 0.52 0.47 -4.70 118.95 120.59 2d20 s ARG 891 Ca -0.05 -0.71 -0.20 0.00 -0.52 0.00 0.00 55.73 54.26 2d20 s ARG 891 Cb -0.04 -2.72 0.08 0.00 0.52 0.00 0.00 34.95 32.79 2d20 s ARG 891 CO -0.03 -0.00 0.75 -0.51 0.02 0.00 0.00 175.30 175.53 2d20 s LEU 892 N 0.89 5.05 0.77 2.53 1.43 -1.26 -1.58 118.68 126.52 2d20 s LEU 892 Ca -0.03 -1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 51.77 2d20 s LEU 892 Cb -0.15 -2.38 0.06 0.00 0.03 0.00 0.00 46.19 43.75 2d20 s LEU 892 CO -0.01 -1.13 1.11 0.20 0.23 0.00 0.00 176.35 176.75 2d20 s ASN 893 N 3.39 4.76 0.15 2.29 0.01 -0.17 -4.98 114.94 120.39 2d20 s ASN 893 Ca 0.15 1.17 -0.12 0.00 -0.71 0.00 0.00 52.86 53.35 2d20 s ASN 893 Cb -0.21 -1.89 0.02 0.00 0.41 0.00 0.00 41.25 39.57 2d20 s ASN 893 CO 0.09 -1.78 1.58 0.28 -1.51 0.00 0.00 177.10 175.76 2d20 h SER 894 N -0.96 0.91 0.05 -1.22 0.02 -1.97 -2.56 113.55 107.83 2d20 h SER 894 Ca -0.46 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.15 2d20 h SER 894 Cb 1.27 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.57 2d20 h SER 894 CO 0.62 1.03 0.00 -0.90 -1.14 0.00 0.00 176.83 176.44 2d20 n ASP 895 N -4.26 0.00 0.00 3.07 5.68 -1.26 -4.78 116.55 115.00 2d20 n ASP 895 Ca 0.01 -0.07 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 2d20 n ASP 895 Cb 0.36 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 2d20 n ASP 895 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2d20 n GLY 896 N -0.59 0.75 3.87 6.12 0.00 -0.96 -4.80 105.19 109.56 2d20 n GLY 896 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2d20 n GLY 896 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d20 s SER 897 N -2.54 6.56 -0.24 1.61 1.04 -1.26 -0.06 113.70 118.81 2d20 s SER 897 Ca 0.00 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.59 2d20 s SER 897 Cb 0.00 -2.33 0.06 0.00 0.10 0.00 0.00 66.02 63.85 2d20 s SER 897 CO 0.00 -0.37 -0.09 -0.63 0.98 0.00 0.00 173.24 173.13 2d20 s ILE 898 N -2.31 1.84 -0.11 -1.02 1.01 -1.26 -1.00 121.20 118.34 2d20 s ILE 898 Ca 0.51 -1.35 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 2d20 s ILE 898 Cb -0.10 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 2d20 s ILE 898 CO 0.29 -0.00 0.02 -0.69 0.00 0.00 0.00 174.94 174.56 2d20 s VAL 899 N 1.27 4.45 0.00 2.92 1.01 -0.61 -1.16 120.40 128.27 2d20 s VAL 899 Ca -0.06 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 2d20 s VAL 899 Cb -0.19 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2d20 s VAL 899 CO -0.06 0.57 1.07 -0.83 0.00 0.00 0.00 175.10 175.85 2d20 s GLY 900 N -0.55 2.61 0.11 4.51 0.00 0.37 -0.40 107.32 113.97 2d20 s GLY 900 Ca 0.10 0.62 -0.25 0.00 0.00 0.00 0.00 44.72 45.19 2d20 s GLY 900 CO 0.02 1.88 1.67 -2.08 0.00 0.00 0.00 173.10 174.59 2d20 h VAL 901 N 4.77 0.61 -0.56 1.40 2.07 -1.34 0.54 116.25 123.75 2d20 h VAL 901 Ca -0.39 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 2d20 h VAL 901 Cb 1.20 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2d20 h VAL 901 CO 0.79 0.00 0.06 -0.61 0.02 0.00 0.00 177.57 177.84 2d20 h GLN 902 N -0.29 0.94 0.05 1.57 4.15 -1.75 -3.32 115.11 116.46 2d20 h GLN 902 Ca 0.04 -0.27 -0.30 0.00 0.77 0.00 0.00 58.65 58.90 2d20 h GLN 902 Cb 0.34 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 2d20 h GLN 902 CO -0.13 0.92 -1.61 0.66 -1.93 0.00 0.00 178.83 176.74 2d20 h SER 903 N 0.83 0.17 -0.00 -0.69 4.64 -1.84 -3.48 113.55 113.18 2d20 h SER 903 Ca 0.17 -0.30 -0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2d20 h SER 903 Cb 0.45 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2d20 h SER 903 CO 0.02 1.26 -0.00 0.61 -0.87 0.00 0.00 176.83 177.85 2d20 n GLY 904 N 1.63 0.46 3.90 -0.77 0.00 0.19 -4.99 105.19 105.60 2d20 n GLY 904 Ca -0.17 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 2d20 n GLY 904 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d20 s LEU 905 N -0.02 4.12 0.23 0.99 1.43 -1.25 -4.74 118.68 119.44 2d20 s LEU 905 Ca 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 54.13 53.06 2d20 s LEU 905 Cb 0.00 -2.68 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 2d20 s LEU 905 CO 0.00 0.01 0.47 0.00 0.23 0.00 0.00 176.35 177.06 2d20 s LEU 907 N -3.21 4.35 -0.04 0.00 1.43 -0.31 -1.74 118.68 119.16 2d20 s LEU 907 Ca 0.42 2.35 0.03 0.00 -1.03 0.00 0.00 54.13 55.90 2d20 s LEU 907 Cb -0.11 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.54 2d20 s LEU 907 CO 0.27 -0.75 -0.13 -0.62 0.23 0.00 0.00 176.35 175.36 2d20 s ASP 908 N 1.61 1.69 -0.55 2.29 2.15 0.22 -4.39 116.67 119.67 2d20 s ASP 908 Ca 0.67 -0.27 -0.25 0.00 0.43 0.00 0.00 52.55 53.13 2d20 s ASP 908 Cb -0.37 -0.50 0.04 0.00 -0.30 0.00 0.00 42.92 41.79 2d20 s ASP 908 CO 0.30 0.10 1.01 0.00 -0.17 0.00 0.00 175.17 176.40 2d20 s ALA 909 N 0.18 3.12 0.01 3.66 0.00 -0.94 -0.31 121.76 127.48 2d20 s ALA 909 Ca -0.05 -1.11 -0.31 0.00 0.00 0.00 0.00 51.96 50.49 2d20 s ALA 909 Cb -0.11 -3.81 -0.16 0.00 0.00 0.00 0.00 23.12 19.05 2d20 s ALA 909 CO 0.02 -2.44 0.83 0.28 0.00 0.00 0.00 175.76 174.44 2d20 n VAL 910 N 6.33 0.08 -0.91 0.00 0.31 -0.57 -0.20 118.33 123.37 2d20 n VAL 910 Ca 0.04 -0.02 -0.04 0.00 -0.01 0.00 0.00 64.34 64.30 2d20 n VAL 910 Cb 0.48 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.39 2d20 n VAL 910 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2d20 n GLY 911 N 1.22 0.41 2.20 2.92 0.00 -1.26 -0.58 105.19 110.10 2d20 n GLY 911 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 2d20 n GLY 911 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d20 n GLY 912 N 0.41 0.66 3.52 -0.02 0.00 0.72 -4.98 105.19 105.50 2d20 n GLY 912 Ca -0.04 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 2d20 n GLY 912 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d20 n GLY 913 N -2.16 -1.15 0.00 -0.02 0.00 0.26 -4.95 105.19 97.17 2d20 n GLY 913 Ca -0.04 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2d20 n GLY 913 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2d20 n THR 914 N -2.46 0.00 -2.12 2.61 -2.24 -1.26 -4.87 114.28 103.94 2d20 n THR 914 Ca 0.11 -0.11 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 2d20 n THR 914 Cb 0.50 0.65 0.05 0.00 -2.10 0.00 0.00 70.33 69.43 2d20 n THR 914 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d20 s ALA 915 N -0.58 3.05 0.45 6.98 0.00 -1.26 -4.77 121.76 125.62 2d20 s ALA 915 Ca 0.00 -0.62 -0.25 0.00 0.00 0.00 0.00 51.96 51.09 2d20 s ALA 915 Cb 0.00 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 20.24 2d20 s ALA 915 CO 0.00 -1.12 1.41 0.09 0.00 0.00 0.00 175.76 176.14 2d20 n ASN 916 N -2.89 3.23 0.00 0.00 3.02 -1.26 -2.34 115.26 115.02 2d20 n ASN 916 Ca 0.06 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.74 2d20 n ASN 916 Cb 0.58 -1.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.16 2d20 n ASN 916 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d20 n GLY 917 N 0.61 0.95 3.66 7.41 0.00 -0.89 -5.01 105.19 111.93 2d20 n GLY 917 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2d20 n GLY 917 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d20 s THR 918 N -2.24 3.11 0.62 2.61 2.01 -0.99 -4.78 115.64 115.98 2d20 s THR 918 Ca 0.00 0.17 -0.13 0.00 0.31 0.00 0.00 61.69 62.03 2d20 s THR 918 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.37 2d20 s THR 918 CO 0.00 -0.01 1.04 -0.76 -0.69 0.00 0.00 174.62 174.20 2d20 s LEU 919 N 4.27 3.35 -0.09 4.42 1.43 -1.26 -0.87 118.68 129.94 2d20 s LEU 919 Ca 0.85 1.66 -0.00 0.00 -1.03 0.00 0.00 54.13 55.61 2d20 s LEU 919 Cb -0.41 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.27 2d20 s LEU 919 CO 0.39 -1.15 -0.06 -0.63 0.23 0.00 0.00 176.35 175.13 2d20 s ILE 920 N -2.78 3.80 0.32 -0.59 -1.09 -0.77 -1.51 121.20 118.58 2d20 s ILE 920 Ca 0.60 -0.43 0.04 0.00 -2.23 0.00 0.00 60.65 58.62 2d20 s ILE 920 Cb -0.14 -2.58 -0.02 0.00 -1.58 0.00 0.00 42.46 38.14 2d20 s ILE 920 CO 0.45 0.58 0.31 0.00 -1.23 0.00 0.00 174.94 175.05 2d20 s GLN 921 N -0.59 1.72 0.07 2.79 -2.07 0.58 -2.34 119.66 119.83 2d20 s GLN 921 Ca 0.09 -1.90 -0.04 0.00 -1.82 0.00 0.00 55.36 51.69 2d20 s GLN 921 Cb -0.12 0.35 -0.05 0.00 -1.09 0.00 0.00 33.01 32.10 2d20 s GLN 921 CO 0.02 -0.65 0.29 -0.51 -1.32 0.00 0.00 175.29 173.12 2d20 s LEU 922 N -3.31 4.33 -0.22 2.60 1.43 0.04 0.70 118.68 124.24 2d20 s LEU 922 Ca 0.38 0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.69 2d20 s LEU 922 Cb 0.02 -3.00 0.12 0.00 0.03 0.00 0.00 46.19 43.37 2d20 s LEU 922 CO 0.24 0.15 1.01 -0.47 0.23 0.00 0.00 176.35 177.51 2d20 s TYR 923 N -1.50 -0.43 -0.23 0.29 5.04 -0.71 -1.09 117.35 118.72 2d20 s TYR 923 Ca 0.35 0.93 -0.41 0.00 -2.44 0.00 0.00 57.07 55.50 2d20 s TYR 923 Cb -0.13 0.40 -0.17 0.00 0.35 0.00 0.00 41.96 42.41 2d20 s TYR 923 CO 0.23 -0.29 1.56 0.43 -1.34 0.00 0.00 175.55 176.14 2d20 n SER 924 N 1.54 1.73 -4.59 4.32 7.64 -1.26 -1.58 113.62 121.42 2d20 n SER 924 Ca -0.12 1.12 -0.39 0.00 1.01 0.00 0.00 58.87 60.49 2d20 n SER 924 Cb 0.57 -1.07 0.03 0.00 -1.01 0.00 0.00 64.21 62.73 2d20 n SER 924 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d20 n SER 926 N 0.03 0.00 -0.33 0.00 3.41 -1.26 -5.00 113.62 110.47 2d20 n SER 926 Ca 0.11 -1.00 -0.04 0.00 -0.26 0.00 0.00 58.87 57.68 2d20 n SER 926 Cb 0.44 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 2d20 n SER 926 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2d20 n ASN 927 N 0.00 -5.61 -4.75 4.04 3.02 -1.26 -4.94 115.26 105.75 2d20 n ASN 927 Ca 0.00 0.11 -0.32 0.00 -0.03 0.00 0.00 54.58 54.33 2d20 n ASN 927 Cb 0.46 -3.49 0.08 0.00 -0.61 0.00 0.00 39.78 36.22 2d20 n ASN 927 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2d20 s GLY 928 N -2.18 2.01 0.48 7.41 0.00 -1.26 -4.90 107.32 108.88 2d20 s GLY 928 Ca 0.00 0.53 0.32 0.00 0.00 0.00 0.00 44.72 45.57 2d20 s GLY 928 CO 0.00 0.89 1.97 1.48 0.00 0.00 0.00 173.10 177.44 2d20 h SER 929 N -0.51 0.00 -0.03 1.64 4.64 -1.92 -1.34 113.55 116.03 2d20 h SER 929 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2d20 h SER 929 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2d20 h SER 929 CO 0.51 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.01 2d20 n ASN 930 N -2.76 0.93 0.00 4.97 6.94 -1.26 -3.21 115.26 120.87 2d20 n ASN 930 Ca -0.00 -1.36 0.00 0.00 -0.02 0.00 0.00 54.58 53.20 2d20 n ASN 930 Cb 0.19 -0.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.60 2d20 n ASN 930 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2d20 n GLN 931 N -0.26 2.44 -4.39 -3.83 6.02 -0.52 -2.21 117.38 114.63 2d20 n GLN 931 Ca 0.20 -1.32 -0.34 0.00 -0.01 0.00 0.00 57.00 55.53 2d20 n GLN 931 Cb 0.25 -0.92 -0.11 0.00 1.02 0.00 0.00 30.24 30.49 2d20 n GLN 931 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2d20 s ARG 932 N -0.82 3.33 0.08 -1.09 3.52 -1.14 -4.12 118.95 118.72 2d20 s ARG 932 Ca 0.00 -0.47 0.03 0.00 -0.13 0.00 0.00 55.73 55.16 2d20 s ARG 932 Cb 0.00 -2.85 -0.03 0.00 -1.56 0.00 0.00 34.95 30.50 2d20 s ARG 932 CO 0.00 0.47 -0.09 -1.58 -0.81 0.00 0.00 175.30 173.29 2d20 s TRP 933 N -0.24 0.93 -0.06 5.12 0.52 0.91 -0.83 118.94 125.29 2d20 s TRP 933 Ca 0.05 -0.68 0.05 0.00 0.02 0.00 0.00 56.10 55.54 2d20 s TRP 933 Cb -0.13 -0.52 -0.00 0.00 -1.15 0.00 0.00 33.47 31.67 2d20 s TRP 933 CO 0.02 -0.06 -0.21 0.99 0.02 0.00 0.00 176.95 177.71 2d20 s THR 934 N -2.45 1.78 -0.92 2.01 2.01 0.19 -4.67 115.64 113.59 2d20 s THR 934 Ca 0.03 -0.90 -0.23 0.00 0.31 0.00 0.00 61.69 60.91 2d20 s THR 934 Cb -0.03 -1.52 0.07 0.00 0.01 0.00 0.00 72.50 71.03 2d20 s THR 934 CO -0.01 0.50 1.31 -0.13 -0.69 0.00 0.00 174.62 175.59 2d20 s ARG 935 N 0.05 3.48 0.00 4.92 1.81 -1.26 -1.98 118.95 125.98 2d20 s ARG 935 Ca -0.07 -1.10 0.24 0.00 -1.72 0.00 0.00 55.73 53.08 2d20 s ARG 935 Cb -0.14 -4.97 0.26 0.00 -0.45 0.00 0.00 34.95 29.66 2d20 s ARG 935 CO 0.04 -2.07 1.30 0.25 -0.68 0.00 0.00 175.30 174.15