#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqw s SER 2 N 0.00 -0.36 0.21 1.61 0.01 -1.26 -5.09 113.70 108.82 2cqw s SER 2 Ca 0.00 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.40 2cqw s SER 2 Cb 0.00 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2cqw s SER 2 CO 0.00 -0.52 0.00 -1.20 0.41 0.00 0.00 173.24 171.93 2cqw n SER 3 N 0.08 0.13 -0.80 2.44 7.64 -1.26 -5.15 113.62 116.69 2cqw n SER 3 Ca -0.09 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.15 2cqw n SER 3 Cb 0.60 0.20 -0.00 0.00 -1.01 0.00 0.00 64.21 64.00 2cqw n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqw n GLY 4 N 2.00 -0.75 1.78 0.23 0.00 -1.26 -4.92 105.19 102.26 2cqw n GLY 4 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2cqw n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cqw n SER 5 N -3.24 0.11 -1.10 1.61 7.64 -1.26 -5.16 113.62 112.22 2cqw n SER 5 Ca 0.00 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.29 2cqw n SER 5 Cb 0.02 0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2cqw n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2cqw n SER 6 N -3.46 -6.06 0.00 6.43 2.88 -1.26 -5.09 113.62 107.06 2cqw n SER 6 Ca 0.00 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 2cqw n SER 6 Cb 0.00 -3.16 0.00 0.00 -0.75 0.00 0.00 64.21 60.31 2cqw n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqw n GLY 7 N -1.72 1.08 2.47 0.46 0.00 -1.26 -5.12 105.19 101.10 2cqw n GLY 7 Ca 0.00 0.28 -0.27 0.00 0.00 0.00 0.00 46.02 46.03 2cqw n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2cqw s ILE 8 N -0.27 0.14 0.04 -0.61 -4.36 -1.26 -5.12 121.20 109.77 2cqw s ILE 8 Ca 0.00 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.09 2cqw s ILE 8 Cb 0.00 -1.10 -0.05 0.00 1.25 0.00 0.00 42.46 42.56 2cqw s ILE 8 CO 0.00 -1.03 1.18 -2.16 0.24 0.00 0.00 174.94 173.16 2cqw s PRO 9 N 0.70 4.44 0.39 0.37 0.04 -1.26 -5.04 135.00 134.64 2cqw s PRO 9 Ca 0.24 1.72 -0.00 0.00 0.04 0.00 0.00 61.00 63.00 2cqw s PRO 9 Cb -0.11 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.02 2cqw s PRO 9 CO -0.08 -0.26 0.61 0.20 0.04 0.00 0.00 177.00 177.52 2cqw s GLY 10 N 1.11 1.41 1.07 0.56 0.00 -1.26 -5.10 107.32 105.11 2cqw s GLY 10 Ca 0.58 -0.88 -0.17 0.00 0.00 0.00 0.00 44.72 44.24 2cqw s GLY 10 CO 0.28 -0.78 1.21 2.56 0.00 0.00 0.00 173.10 176.38 2cqw s PRO 11 N -4.44 -0.20 -0.21 2.90 0.04 -1.26 -5.04 135.00 126.79 2cqw s PRO 11 Ca 0.43 -0.21 -0.08 0.00 0.04 0.00 0.00 61.00 61.18 2cqw s PRO 11 Cb -0.10 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2cqw s PRO 11 CO 0.38 -3.01 0.09 0.20 0.04 0.00 0.00 177.00 174.70 2cqw s GLY 12 N -4.38 1.89 -0.12 0.56 0.00 -1.26 -5.00 107.32 99.00 2cqw s GLY 12 Ca 0.72 -0.88 -0.10 0.00 0.00 0.00 0.00 44.72 44.46 2cqw s GLY 12 CO 0.54 0.26 0.22 0.74 0.00 0.00 0.00 173.10 174.86 2cqw h PHE 13 N 7.28 0.00 -5.06 1.90 0.04 -2.08 -3.50 116.94 115.52 2cqw h PHE 13 Ca -0.37 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.40 2cqw h PHE 13 Cb 1.17 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.27 2cqw h PHE 13 CO 0.62 0.37 -1.21 2.41 -0.60 0.00 0.00 178.31 179.90 2cqw n THR 14 N -4.70-12.33 -0.05 -1.55 -1.04 -1.26 -5.01 114.28 88.34 2cqw n THR 14 Ca -0.05 2.19 -0.03 0.00 -2.04 0.00 0.00 64.05 64.11 2cqw n THR 14 Cb 0.20 -6.79 -0.01 0.00 -1.82 0.00 0.00 70.33 61.91 2cqw n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2cqw n ALA 15 N 1.06 0.33 0.00 2.41 0.00 -1.26 -5.12 120.51 117.93 2cqw n ALA 15 Ca -0.15 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2cqw n ALA 15 Cb 0.24 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.70 2cqw n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqw n GLY 16 N 1.63 0.30 3.56 0.00 0.00 -1.26 -4.99 105.19 104.43 2cqw n GLY 16 Ca -0.05 -2.27 -0.49 0.00 0.00 0.00 0.00 46.02 43.21 2cqw n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqw n ALA 17 N -0.92 1.14 -3.61 4.61 0.00 -1.26 -4.88 120.51 115.60 2cqw n ALA 17 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 2cqw n ALA 17 Cb 0.00 -2.61 -0.01 0.00 0.00 0.00 0.00 19.45 16.83 2cqw n ALA 17 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2cqw s GLN 18 N 5.57 1.93 0.00 0.00 -1.52 -1.26 -5.08 119.66 119.30 2cqw s GLN 18 Ca 1.03 -1.29 0.00 0.00 -1.95 0.00 0.00 55.36 53.14 2cqw s GLN 18 Cb -0.70 0.57 0.00 0.00 -0.22 0.00 0.00 33.01 32.67 2cqw s GLN 18 CO 0.47 -0.87 0.00 0.41 -0.25 0.00 0.00 175.29 175.05 2cqw n GLY 19 N -0.49 0.76 3.29 3.09 0.00 -1.26 -4.87 105.19 105.71 2cqw n GLY 19 Ca -0.05 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 2cqw n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqw s SER 20 N -1.18 2.51 -0.44 1.61 1.04 -1.26 -4.80 113.70 111.18 2cqw s SER 20 Ca 0.00 -0.71 0.08 0.00 0.48 0.00 0.00 55.95 55.80 2cqw s SER 20 Cb 0.00 -0.14 0.40 0.00 0.10 0.00 0.00 66.02 66.39 2cqw s SER 20 CO 0.00 0.03 1.01 0.00 0.98 0.00 0.00 173.24 175.26 2cqw h SER 22 N 2.78 0.18 0.00 0.00 4.64 -1.95 -3.38 113.55 115.82 2cqw h SER 22 Ca 0.17 -0.85 -0.01 0.00 -0.47 0.00 0.00 61.79 60.63 2cqw h SER 22 Cb 0.88 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2cqw h SER 22 CO 0.75 1.34 -0.51 0.00 -0.87 0.00 0.00 176.83 177.53 2cqw n LEU 23 N -4.31 2.62 0.00 5.97 -0.00 -1.26 -4.88 117.00 115.14 2cqw n LEU 23 Ca -0.19 -3.80 0.00 0.00 -0.00 0.00 0.00 56.01 52.02 2cqw n LEU 23 Cb 0.69 -0.50 0.00 0.00 -0.00 0.00 0.00 43.42 43.61 2cqw n LEU 23 CO 0.35 1.35 0.00 0.54 -0.00 0.00 0.00 177.39 179.63 2cqw n ARG 24 N -1.05 0.00 -3.62 1.47 1.74 -1.26 -4.99 116.66 108.94 2cqw n ARG 24 Ca 0.18 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 57.02 2cqw n ARG 24 Cb 0.71 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.23 2cqw n ARG 24 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cqw n GLY 26 N -1.99 -0.97 3.47 0.00 0.00 0.28 -4.87 105.19 101.11 2cqw n GLY 26 Ca 0.01 0.37 -0.10 0.00 0.00 0.00 0.00 46.02 46.31 2cqw n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqw s ALA 27 N 0.00 -0.82 -0.09 4.61 0.00 -1.10 -4.87 121.76 119.48 2cqw s ALA 27 Ca 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 51.96 51.70 2cqw s ALA 27 Cb 0.00 0.83 0.01 0.00 0.00 0.00 0.00 23.12 23.97 2cqw s ALA 27 CO 0.00 -0.76 -0.14 -0.65 0.00 0.00 0.00 175.76 174.20 2cqw s GLN 28 N -3.87 2.06 0.43 0.00 -0.21 -1.26 0.19 119.66 116.99 2cqw s GLN 28 Ca 0.09 -0.52 0.03 0.00 0.02 0.00 0.00 55.36 54.99 2cqw s GLN 28 Cb -0.00 -1.74 -0.02 0.00 1.00 0.00 0.00 33.01 32.25 2cqw s GLN 28 CO -0.04 -0.02 0.10 0.34 -2.12 0.00 0.00 175.29 173.55 2cqw s ASP 29 N 0.87 3.03 -0.15 5.90 2.15 -0.35 -4.95 116.67 123.17 2cqw s ASP 29 Ca -0.10 -1.66 -0.23 0.00 0.43 0.00 0.00 52.55 50.99 2cqw s ASP 29 Cb -0.15 0.49 -0.21 0.00 -0.30 0.00 0.00 42.92 42.75 2cqw s ASP 29 CO 0.01 -0.91 0.51 1.23 -0.17 0.00 0.00 175.17 175.84 2cqw h GLY 30 N 1.72 0.00 0.95 2.66 0.00 -2.00 -3.37 103.07 103.02 2cqw h GLY 30 Ca -0.37 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 2cqw h GLY 30 CO 0.60 0.00 0.17 1.41 0.00 0.00 0.00 176.54 178.72 2cqw h LEU 31 N -1.00 0.47 0.00 3.11 3.38 -1.93 -3.47 115.31 115.88 2cqw h LEU 31 Ca -0.09 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2cqw h LEU 31 Cb 0.95 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2cqw h LEU 31 CO -0.05 0.47 0.00 0.00 0.09 0.00 0.00 178.44 178.95 2cqw s SER 33 N 0.31 -0.79 -0.28 0.00 0.15 0.50 -1.21 113.70 112.38 2cqw s SER 33 Ca 0.00 1.45 0.12 0.00 0.70 0.00 0.00 55.95 58.21 2cqw s SER 33 Cb 0.00 1.43 0.73 0.00 -1.71 0.00 0.00 66.02 66.47 2cqw s SER 33 CO 0.00 -0.24 1.73 0.00 1.20 0.00 0.00 173.24 175.93 2cqw s HIS 35 N -2.93 3.43 -1.29 0.00 2.46 0.22 0.10 115.29 117.28 2cqw s HIS 35 Ca 0.53 0.13 0.22 0.00 0.47 0.00 0.00 55.06 56.41 2cqw s HIS 35 Cb 0.42 -1.66 1.07 0.00 -0.13 0.00 0.00 32.58 32.28 2cqw s HIS 35 CO 0.13 0.53 1.72 -0.35 -2.47 0.00 0.00 174.74 174.31 2cqw n PRO 36 N -0.25 0.21 0.02 2.88 -0.04 -1.26 -2.22 135.00 134.35 2cqw n PRO 36 Ca -0.07 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 2cqw n PRO 36 Cb 0.53 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.79 2cqw n PRO 36 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2cqw n THR 37 N -1.36 0.11 0.32 0.52 -2.24 -1.26 -3.62 114.28 106.75 2cqw n THR 37 Ca 0.09 -0.08 0.19 0.00 -2.27 0.00 0.00 64.05 61.98 2cqw n THR 37 Cb 0.20 -0.00 1.02 0.00 -2.10 0.00 0.00 70.33 69.45 2cqw n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cqw h SER 39 N 0.00 1.00 0.54 0.00 0.87 -1.80 1.45 113.55 115.62 2cqw h SER 39 Ca 0.00 -0.46 -0.20 0.00 -1.23 0.00 0.00 61.79 59.90 2cqw h SER 39 Cb 0.25 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2cqw h SER 39 CO 0.00 1.26 -0.88 1.23 -0.53 0.00 0.00 176.83 177.91 2cqw h GLY 40 N 0.79 0.26 0.00 5.77 0.00 -0.80 -3.37 103.07 105.72 2cqw h GLY 40 Ca 0.06 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2cqw h GLY 40 CO 0.09 0.40 -0.10 1.41 0.00 0.00 0.00 176.54 178.34 2cqw h LEU 41 N 0.13 0.00 0.00 3.11 3.38 -1.25 -3.50 115.31 117.18 2cqw h LEU 41 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2cqw h LEU 41 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.26 2cqw h LEU 41 CO 0.14 0.26 0.00 0.61 0.09 0.00 0.00 178.44 179.54 2cqw n GLY 42 N 1.80 0.99 0.51 0.83 0.00 0.50 -5.04 105.19 104.78 2cqw n GLY 42 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2cqw n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cqw n THR 43 N 0.00 1.81 -2.01 2.61 -2.24 -1.11 -5.05 114.28 108.28 2cqw n THR 43 Ca 0.00 -2.59 -0.39 0.00 -2.27 0.00 0.00 64.05 58.80 2cqw n THR 43 Cb 0.00 -0.10 0.01 0.00 -2.10 0.00 0.00 70.33 68.14 2cqw n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cqw h GLU 46 N -0.45 0.00 -0.23 0.00 4.39 -1.94 -2.73 114.58 113.61 2cqw h GLU 46 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2cqw h GLU 46 Cb 1.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2cqw h GLU 46 CO 0.62 0.40 0.00 -0.25 -1.16 0.00 0.00 179.01 178.62 2cqw n ASP 47 N -3.67 3.11 -0.03 1.42 8.00 -1.26 -4.60 116.55 119.51 2cqw n ASP 47 Ca -0.01 -2.52 -0.13 0.00 0.71 0.00 0.00 54.79 52.85 2cqw n ASP 47 Cb 0.49 -0.35 -0.08 0.00 -0.02 0.00 0.00 41.12 41.17 2cqw n ASP 47 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 2cqw h PHE 48 N 1.45 0.22 -0.09 1.24 3.57 -1.82 -1.42 116.94 120.08 2cqw h PHE 48 Ca 0.00 -0.06 -0.19 0.00 3.53 0.00 0.00 57.97 61.25 2cqw h PHE 48 Cb 1.01 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 2cqw h PHE 48 CO 0.28 0.58 -0.74 -0.07 -2.23 0.00 0.00 178.31 176.12 2cqw h LEU 49 N -0.21 0.58 -0.99 0.59 3.38 -1.74 1.52 115.31 118.43 2cqw h LEU 49 Ca 0.02 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.64 2cqw h LEU 49 Cb 0.53 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 2cqw h LEU 49 CO 0.02 1.14 0.65 0.44 0.09 0.00 0.00 178.44 180.77 2cqw h ASP 50 N 0.33 1.09 0.48 -0.43 5.19 -1.80 0.77 116.42 122.05 2cqw h ASP 50 Ca -0.04 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 2cqw h ASP 50 Cb 1.33 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.59 2cqw h ASP 50 CO 0.13 0.75 -1.48 -1.22 -3.12 0.00 0.00 179.24 174.30 2cqw n TYR 51 N -4.44 0.46 -3.15 4.55 4.01 -0.54 -4.44 117.16 113.60 2cqw n TYR 51 Ca 0.13 0.13 -0.23 0.00 -0.16 0.00 0.00 57.90 57.77 2cqw n TYR 51 Cb 0.09 -0.70 -0.05 0.00 -0.31 0.00 0.00 39.34 38.37 2cqw n TYR 51 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2cqw n LEU 53 N 0.44 4.83 -2.59 0.00 4.77 0.26 -4.25 117.00 120.47 2cqw n LEU 53 Ca 0.27 -2.44 -0.03 0.00 -0.03 0.00 0.00 56.01 53.78 2cqw n LEU 53 Cb 0.51 -0.59 0.11 0.00 -2.33 0.00 0.00 43.42 41.13 2cqw n LEU 53 CO 0.28 0.82 0.58 1.21 -1.33 0.00 0.00 177.39 178.94 2cqw n GLU 54 N 1.16 1.19 -0.02 3.23 2.13 -1.26 -4.93 120.64 122.14 2cqw n GLU 54 Ca 0.26 -1.25 0.01 0.00 0.66 0.00 0.00 57.16 56.84 2cqw n GLU 54 Cb 0.91 0.27 -0.08 0.00 0.27 0.00 0.00 31.44 32.81 2cqw n GLU 54 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2cqw n ILE 55 N -1.18 0.30 -1.11 6.31 -5.35 -1.26 -5.02 119.36 112.06 2cqw n ILE 55 Ca -0.13 -0.32 -0.34 0.00 -0.27 0.00 0.00 62.75 61.69 2cqw n ILE 55 Cb 0.84 -0.20 0.12 0.00 -1.74 0.00 0.00 39.64 38.66 2cqw n ILE 55 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2cqw n LEU 56 N -2.09 3.59 -4.79 7.28 4.32 -1.26 -4.98 117.00 119.06 2cqw n LEU 56 Ca -0.08 0.57 -0.29 0.00 -0.02 0.00 0.00 56.01 56.19 2cqw n LEU 56 Cb 0.52 -1.45 0.13 0.00 -1.62 0.00 0.00 43.42 41.00 2cqw n LEU 56 CO 0.21 -2.03 0.71 -2.16 -1.22 0.00 0.00 177.39 172.91 2cqw s PRO 57 N -3.88 1.33 0.23 3.23 0.04 -1.26 -4.94 135.00 129.74 2cqw s PRO 57 Ca 0.71 0.36 -0.30 0.00 0.04 0.00 0.00 61.00 61.82 2cqw s PRO 57 Cb -0.29 -1.85 -0.15 0.00 0.04 0.00 0.00 34.50 32.24 2cqw s PRO 57 CO 0.53 -2.08 0.91 0.45 0.04 0.00 0.00 177.00 176.85 2cqw n SER 58 N -3.70 0.56 -4.04 6.66 2.88 -1.26 -4.92 113.62 109.80 2cqw n SER 58 Ca 0.07 1.16 -0.34 0.00 -1.33 0.00 0.00 58.87 58.42 2cqw n SER 58 Cb 0.59 -1.16 -0.10 0.00 -0.75 0.00 0.00 64.21 62.78 2cqw n SER 58 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cqw s SER 59 N -0.53 5.15 1.01 -3.46 0.15 -1.26 -5.09 113.70 109.67 2cqw s SER 59 Ca 0.65 -3.22 -0.14 0.00 0.70 0.00 0.00 55.95 53.94 2cqw s SER 59 Cb -0.82 -1.79 0.15 0.00 -1.71 0.00 0.00 66.02 61.84 2cqw s SER 59 CO 0.57 -0.26 0.21 0.61 1.20 0.00 0.00 173.24 175.57 2cqw n GLY 60 N 2.95 -2.48 3.07 9.45 0.00 -1.26 -5.04 105.19 111.88 2cqw n GLY 60 Ca 0.12 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 2cqw n GLY 60 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cqw s SER 61 N -1.91 -0.05 0.16 1.61 0.15 -1.26 -5.07 113.70 107.34 2cqw s SER 61 Ca 0.38 0.01 0.00 0.00 0.70 0.00 0.00 55.95 57.04 2cqw s SER 61 Cb -0.06 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2cqw s SER 61 CO 0.38 -0.23 0.00 0.80 1.20 0.00 0.00 173.24 175.39 2cqw n MET 62 N 2.13 -5.51 0.07 5.44 1.56 -1.26 -5.05 117.12 114.49 2cqw n MET 62 Ca -0.18 3.91 0.00 0.00 -0.27 0.00 0.00 57.70 61.15 2cqw n MET 62 Cb 0.57 -4.39 0.00 0.00 2.15 0.00 0.00 33.22 31.55 2cqw n MET 62 CO 0.00 0.00 0.00 -1.33 -0.73 0.00 0.00 175.97 173.91 2cqw n MET 63 N 1.95 0.00 0.00 2.12 2.00 -1.26 -5.11 117.12 116.82 2cqw n MET 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2cqw n MET 63 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2cqw n MET 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2cqw n GLY 64 N 1.29 1.36 0.00 3.03 0.00 -1.26 -5.18 105.19 104.43 2cqw n GLY 64 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2cqw n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqw n GLY 65 N 3.78 3.73 3.40 -0.02 0.00 -1.26 -5.17 105.19 109.66 2cqw n GLY 65 Ca 0.00 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 2cqw n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqw s LYS 66 N -5.12 0.76 0.16 1.61 1.02 -1.26 -5.18 119.74 111.75 2cqw s LYS 66 Ca 0.00 0.34 -0.01 0.00 0.02 0.00 0.00 55.97 56.32 2cqw s LYS 66 Cb 0.00 0.36 -0.04 0.00 -0.52 0.00 0.00 37.83 37.63 2cqw s LYS 66 CO 0.00 -0.18 0.08 0.34 -0.92 0.00 0.00 175.35 174.67 2cqw s ASP 67 N -0.60 0.37 0.08 2.83 2.15 -1.26 -5.18 116.67 115.07 2cqw s ASP 67 Ca -0.07 -1.28 -0.09 0.00 0.43 0.00 0.00 52.55 51.54 2cqw s ASP 67 Cb -0.03 0.30 0.00 0.00 -0.30 0.00 0.00 42.92 42.89 2cqw s ASP 67 CO 0.04 -0.75 0.20 0.12 -0.17 0.00 0.00 175.17 174.61 2cqw s PHE 68 N -4.04 0.11 -0.28 -5.34 5.36 -1.26 -5.17 117.98 107.36 2cqw s PHE 68 Ca 0.30 -0.48 -0.24 0.00 -0.96 0.00 0.00 56.93 55.55 2cqw s PHE 68 Cb 0.07 -0.03 0.12 0.00 -0.34 0.00 0.00 43.02 42.84 2cqw s PHE 68 CO 0.06 -0.52 1.00 0.54 -1.46 0.00 0.00 175.22 174.84 2cqw s VAL 69 N -3.52 0.00 -0.22 3.12 0.11 -1.26 -5.17 120.40 113.46 2cqw s VAL 69 Ca 0.02 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.79 2cqw s VAL 69 Cb 0.03 -1.00 0.14 0.00 -1.53 0.00 0.00 36.38 34.02 2cqw s VAL 69 CO -0.09 0.00 1.08 0.54 -3.33 0.00 0.00 175.10 173.30 2cqw s VAL 70 N 0.33 0.00 -0.30 2.04 0.11 -1.26 -5.16 120.40 116.15 2cqw s VAL 70 Ca 0.02 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 58.90 2cqw s VAL 70 Cb -0.05 -1.00 0.18 0.00 -1.53 0.00 0.00 36.38 33.98 2cqw s VAL 70 CO -0.06 0.00 1.13 -1.58 -3.33 0.00 0.00 175.10 171.26 2cqw s GLN 71 N -0.57 0.18 -0.13 1.54 0.74 -1.26 -5.18 119.66 114.98 2cqw s GLN 71 Ca 0.02 0.41 -0.30 0.00 0.05 0.00 0.00 55.36 55.54 2cqw s GLN 71 Cb -0.02 0.21 0.09 0.00 1.10 0.00 0.00 33.01 34.39 2cqw s GLN 71 CO -0.03 -0.06 0.81 -1.58 -0.55 0.00 0.00 175.29 173.88 2cqw s HIS 72 N 2.01 -0.58 -0.29 1.67 2.46 -1.26 -5.17 115.29 114.14 2cqw s HIS 72 Ca -0.03 1.08 -0.16 0.00 0.47 0.00 0.00 55.06 56.43 2cqw s HIS 72 Cb -0.03 0.40 0.15 0.00 -0.13 0.00 0.00 32.58 32.97 2cqw s HIS 72 CO -0.16 -0.47 0.99 -1.17 -2.47 0.00 0.00 174.74 171.46 2cqw s LEU 73 N -0.86 -0.48 -0.25 8.88 0.20 -1.26 -5.17 118.68 119.74 2cqw s LEU 73 Ca -0.06 0.77 -0.27 0.00 0.69 0.00 0.00 54.13 55.27 2cqw s LEU 73 Cb -0.01 1.71 0.14 0.00 -0.43 0.00 0.00 46.19 47.59 2cqw s LEU 73 CO 0.05 -0.12 1.09 -0.75 -0.29 0.00 0.00 176.35 176.33 2cqw s LYS 74 N 1.32 0.45 -0.30 1.98 2.20 -1.26 -5.16 119.74 118.98 2cqw s LYS 74 Ca -0.09 0.37 -0.16 0.00 -0.36 0.00 0.00 55.97 55.73 2cqw s LYS 74 Cb -0.04 0.22 0.18 0.00 -1.51 0.00 0.00 37.83 36.68 2cqw s LYS 74 CO -0.15 -0.09 1.14 1.67 -0.36 0.00 0.00 175.35 177.57 2cqw s TRP 75 N -0.24 -0.36 -0.11 4.03 1.48 -1.26 -5.17 118.94 117.31 2cqw s TRP 75 Ca 0.03 0.53 -0.07 0.00 -1.06 0.00 0.00 56.10 55.52 2cqw s TRP 75 Cb -0.03 0.18 0.04 0.00 -1.16 0.00 0.00 33.47 32.49 2cqw s TRP 75 CO -0.05 -0.19 0.27 0.99 -4.06 0.00 0.00 176.95 173.91 2cqw s THR 76 N 2.50 -0.02 0.00 0.66 2.01 -1.26 -5.11 115.64 114.41 2cqw s THR 76 Ca -0.02 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.06 2cqw s THR 76 Cb -0.05 -0.40 0.00 0.00 0.01 0.00 0.00 72.50 72.06 2cqw s THR 76 CO -0.14 0.03 0.00 -0.67 -0.69 0.00 0.00 174.62 173.15 2cqw n ASP 77 N 3.64 0.00 -3.61 3.53 2.03 -1.26 -5.18 116.55 115.70 2cqw n ASP 77 Ca -0.19 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 54.84 2cqw n ASP 77 Cb 0.56 0.00 0.21 0.00 -0.72 0.00 0.00 41.12 41.16 2cqw n ASP 77 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2cqw n PRO 78 N 0.00 -2.07 -4.03 -0.67 -0.04 -1.26 -5.10 135.00 121.83 2cqw n PRO 78 Ca 0.00 -1.75 -0.10 0.00 -0.04 0.00 0.00 63.50 61.61 2cqw n PRO 78 Cb 0.00 -1.38 -0.06 0.00 -0.04 0.00 0.00 33.50 32.02 2cqw n PRO 78 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cqw s SER 79 N -4.85 -0.01 -0.37 3.54 0.01 -1.26 -5.14 113.70 105.62 2cqw s SER 79 Ca 0.67 -1.02 0.06 0.00 1.31 0.00 0.00 55.95 56.97 2cqw s SER 79 Cb -0.04 0.57 0.18 0.00 0.21 0.00 0.00 66.02 66.93 2cqw s SER 79 CO 0.49 -1.11 0.55 -0.83 0.41 0.00 0.00 173.24 172.75 2cqw s GLY 80 N -3.05 -0.94 1.09 3.44 0.00 -1.26 -5.16 107.32 101.44 2cqw s GLY 80 Ca 0.25 0.10 -0.18 0.00 0.00 0.00 0.00 44.72 44.89 2cqw s GLY 80 CO 0.10 3.42 1.22 2.56 0.00 0.00 0.00 173.10 180.40 2cqw s PRO 81 N 1.99 -0.37 0.25 2.90 0.04 -1.26 -5.10 135.00 133.45 2cqw s PRO 81 Ca 0.15 -0.28 -0.20 0.00 0.04 0.00 0.00 61.00 60.71 2cqw s PRO 81 Cb -0.08 -1.71 0.06 0.00 0.04 0.00 0.00 34.50 32.81 2cqw s PRO 81 CO -0.12 -3.11 0.91 0.45 0.04 0.00 0.00 177.00 175.18 2cqw s SER 82 N -4.42 -0.06 0.20 6.66 0.15 -1.26 -5.19 113.70 109.79 2cqw s SER 82 Ca 0.73 -0.77 -0.13 0.00 0.70 0.00 0.00 55.95 56.48 2cqw s SER 82 Cb -0.06 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.89 2cqw s SER 82 CO 0.55 -1.24 0.42 -0.55 1.20 0.00 0.00 173.24 173.62 2cqw s SER 83 N -3.16 -0.09 0.00 5.45 0.15 -1.26 -5.37 113.70 109.41 2cqw s SER 83 Ca 0.17 -0.79 0.00 0.00 0.70 0.00 0.00 55.95 56.03 2cqw s SER 83 Cb -0.03 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 2cqw s SER 83 CO 0.07 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.09