#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2byf s SER 2 N 0.00 4.62 0.11 6.43 0.15 -1.26 -5.03 113.70 118.72 2byf s SER 2 Ca 0.00 -1.25 0.24 0.00 0.70 0.00 0.00 55.95 55.63 2byf s SER 2 Cb 0.00 0.40 0.21 0.00 -1.71 0.00 0.00 66.02 64.91 2byf s SER 2 CO 0.00 -1.08 1.19 -1.84 1.20 0.00 0.00 173.24 172.71 2byf n GLU 3 N -1.74 0.34 -0.16 5.44 0.28 -1.26 -4.06 120.64 119.48 2byf n GLU 3 Ca -0.02 0.07 0.05 0.00 -0.16 0.00 0.00 57.16 57.09 2byf n GLU 3 Cb 0.64 -1.68 0.13 0.00 1.43 0.00 0.00 31.44 31.97 2byf n GLU 3 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2byf n GLU 4 N -2.16 1.74 -3.98 3.44 0.28 -1.26 -4.75 120.64 113.96 2byf n GLU 4 Ca 0.02 -1.09 -0.31 0.00 -0.16 0.00 0.00 57.16 55.63 2byf n GLU 4 Cb 0.46 -1.27 -0.16 0.00 1.43 0.00 0.00 31.44 31.91 2byf n GLU 4 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 2byf s GLU 5 N -1.61 1.84 -0.14 3.44 -1.05 -1.26 -5.08 118.70 114.85 2byf s GLU 5 Ca 0.20 -1.01 -0.13 0.00 -0.15 0.00 0.00 54.97 53.88 2byf s GLU 5 Cb 0.11 -2.60 0.04 0.00 -0.44 0.00 0.00 34.13 31.24 2byf s GLU 5 CO 0.13 -0.55 0.37 -1.54 0.95 0.00 0.00 175.26 174.63 2byf s SER 6 N 1.34 -0.39 0.05 0.83 1.04 -1.26 -4.00 113.70 111.31 2byf s SER 6 Ca -0.05 0.75 0.01 0.00 0.48 0.00 0.00 55.95 57.14 2byf s SER 6 Cb -0.18 0.76 -0.03 0.00 0.10 0.00 0.00 66.02 66.66 2byf s SER 6 CO -0.06 -0.13 -0.05 0.72 0.98 0.00 0.00 173.24 174.69 2byf s PHE 7 N 0.26 0.61 -0.04 5.02 -0.71 0.10 -4.77 117.98 118.44 2byf s PHE 7 Ca -0.00 -0.75 -0.19 0.00 -1.04 0.00 0.00 56.93 54.94 2byf s PHE 7 Cb -0.03 -0.38 -0.05 0.00 -1.21 0.00 0.00 43.02 41.35 2byf s PHE 7 CO -0.00 -0.19 0.54 -0.06 -1.34 0.00 0.00 175.22 174.17 2byf s PHE 8 N -2.60 3.63 -0.17 3.49 0.08 -1.26 -0.57 117.98 120.57 2byf s PHE 8 Ca -0.01 1.08 0.01 0.00 0.12 0.00 0.00 56.93 58.13 2byf s PHE 8 Cb -0.02 -2.56 0.02 0.00 -0.57 0.00 0.00 43.02 39.89 2byf s PHE 8 CO -0.04 0.32 -0.20 0.08 -0.10 0.00 0.00 175.22 175.28 2byf s VAL 9 N 0.01 2.14 -0.45 -0.44 1.01 0.60 -4.91 120.40 118.35 2byf s VAL 9 Ca 0.29 -0.92 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 2byf s VAL 9 Cb -0.17 -1.89 0.04 0.00 0.00 0.00 0.00 36.38 34.35 2byf s VAL 9 CO 0.15 0.54 0.52 -1.10 0.00 0.00 0.00 175.10 175.20 2byf s GLN 10 N 1.18 3.12 -0.12 2.72 -0.21 -1.26 -0.23 119.66 124.86 2byf s GLN 10 Ca 0.02 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 54.63 2byf s GLN 10 Cb -0.14 -4.01 0.02 0.00 1.00 0.00 0.00 33.01 29.88 2byf s GLN 10 CO -0.10 -0.99 -0.14 0.54 -2.12 0.00 0.00 175.29 172.48 2byf s VAL 11 N 2.33 1.48 0.45 1.09 0.11 0.12 -0.82 120.40 125.16 2byf s VAL 11 Ca 0.14 -0.61 -0.20 0.00 -2.93 0.00 0.00 61.98 58.38 2byf s VAL 11 Cb -0.18 -1.37 -0.10 0.00 -1.53 0.00 0.00 36.38 33.20 2byf s VAL 11 CO 0.13 0.44 0.97 -1.00 -3.33 0.00 0.00 175.10 172.31 2byf s HIS 12 N 1.19 3.27 0.44 1.54 3.76 -0.46 -0.49 115.29 124.54 2byf s HIS 12 Ca -0.02 1.59 0.05 0.00 -0.15 0.00 0.00 55.06 56.53 2byf s HIS 12 Cb -0.14 -2.88 -0.06 0.00 1.11 0.00 0.00 32.58 30.61 2byf s HIS 12 CO -0.05 -0.25 0.01 0.34 -0.85 0.00 0.00 174.74 173.95 2byf s ASP 13 N -2.23 3.88 0.34 1.40 2.15 -1.01 -1.02 116.67 120.18 2byf s ASP 13 Ca 0.63 -1.47 0.20 0.00 0.43 0.00 0.00 52.55 52.34 2byf s ASP 13 Cb -0.10 -0.08 0.18 0.00 -0.30 0.00 0.00 42.92 42.63 2byf s ASP 13 CO 0.16 -0.59 1.43 0.58 -0.17 0.00 0.00 175.17 176.57 2byf h VAL 14 N 1.65 0.26 -4.35 1.11 2.07 -1.89 -3.47 116.25 111.63 2byf h VAL 14 Ca -0.44 -1.39 -0.51 0.00 0.82 0.00 0.00 66.70 65.19 2byf h VAL 14 Cb 1.26 2.04 0.08 0.00 -1.52 0.00 0.00 31.29 33.15 2byf h VAL 14 CO 0.78 0.15 0.39 -0.44 0.02 0.00 0.00 177.57 178.47 2byf s SER 15 N -6.12 5.66 0.00 0.57 0.01 -1.26 -5.09 113.70 107.47 2byf s SER 15 Ca 0.04 1.48 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2byf s SER 15 Cb 0.07 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.89 2byf s SER 15 CO 0.72 -1.25 0.00 -0.81 0.41 0.00 0.00 173.24 172.31 2byf n PRO 16 N -2.99 3.76 0.00 12.44 -0.04 -1.26 -4.43 135.00 142.48 2byf n PRO 16 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2byf n PRO 16 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 2byf n PRO 16 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2byf n GLU 17 N 0.00 0.00 -3.37 0.54 4.07 -1.26 -4.24 120.64 116.38 2byf n GLU 17 Ca 0.00 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.94 2byf n GLU 17 Cb 0.00 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.30 2byf n GLU 17 CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 2byf s GLN 18 N 0.00 0.50 0.31 5.31 2.00 -1.26 -5.04 119.66 121.48 2byf s GLN 18 Ca 0.00 -0.51 0.07 0.00 -2.00 0.00 0.00 55.36 52.92 2byf s GLN 18 Cb 0.00 -0.66 0.84 0.00 0.80 0.00 0.00 33.01 33.98 2byf s GLN 18 CO 0.00 -1.12 1.69 -1.35 -0.50 0.00 0.00 175.29 174.01 2byf h PRO 19 N 7.61 0.37 -4.44 1.67 0.11 -1.78 -3.32 132.00 132.22 2byf h PRO 19 Ca -0.03 -0.02 -0.73 0.00 0.11 0.00 0.00 66.00 65.33 2byf h PRO 19 Cb 1.07 -0.08 -0.23 0.00 0.11 0.00 0.00 31.00 31.87 2byf h PRO 19 CO 0.26 0.24 -0.41 -1.17 -0.21 0.00 0.00 178.00 176.71 2byf s LEU 20 N -10.48 5.25 0.36 2.35 2.96 -1.26 -2.40 118.68 115.45 2byf s LEU 20 Ca -0.11 -1.11 -0.25 0.00 -0.22 0.00 0.00 54.13 52.43 2byf s LEU 20 Cb 0.27 -2.14 -0.09 0.00 0.50 0.00 0.00 46.19 44.73 2byf s LEU 20 CO 0.78 -0.52 1.00 -0.89 -1.32 0.00 0.00 176.35 175.41 2byf s THR 21 N 1.63 3.95 -0.16 3.68 2.01 0.36 -4.89 115.64 122.23 2byf s THR 21 Ca 0.04 1.57 0.00 0.00 0.31 0.00 0.00 61.69 63.61 2byf s THR 21 Cb -0.21 -3.85 0.03 0.00 0.01 0.00 0.00 72.50 68.48 2byf s THR 21 CO 0.08 0.08 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.29 2byf s VAL 22 N -1.62 1.43 0.33 3.82 1.01 -1.26 0.11 120.40 124.20 2byf s VAL 22 Ca 0.53 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.90 2byf s VAL 22 Cb -0.21 -1.43 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 2byf s VAL 22 CO 0.26 0.33 0.04 0.27 0.00 0.00 0.00 175.10 176.01 2byf s ILE 23 N 1.53 1.28 -0.30 2.22 -4.36 0.68 -4.99 121.20 117.25 2byf s ILE 23 Ca 0.03 -2.01 0.03 0.00 -0.26 0.00 0.00 60.65 58.44 2byf s ILE 23 Cb -0.14 -2.77 0.08 0.00 1.25 0.00 0.00 42.46 40.88 2byf s ILE 23 CO -0.09 -0.03 -0.01 -0.75 0.24 0.00 0.00 174.94 174.29 2byf s LYS 24 N -3.87 1.75 0.42 0.37 2.20 -1.26 -0.29 119.74 119.05 2byf s LYS 24 Ca 0.36 -1.62 0.08 0.00 -0.36 0.00 0.00 55.97 54.43 2byf s LYS 24 Cb 0.08 -3.03 -0.00 0.00 -1.51 0.00 0.00 37.83 33.38 2byf s LYS 24 CO 0.15 -0.79 0.50 0.00 -0.36 0.00 0.00 175.35 174.86 2byf s ALA 25 N 1.02 4.37 0.32 3.13 0.00 0.26 -4.83 121.76 126.03 2byf s ALA 25 Ca 0.03 -1.75 -0.27 0.00 0.00 0.00 0.00 51.96 49.97 2byf s ALA 25 Cb -0.19 -1.42 -0.09 0.00 0.00 0.00 0.00 23.12 21.42 2byf s ALA 25 CO -0.07 -0.26 1.05 -1.25 0.00 0.00 0.00 175.76 175.22 2byf s PRO 26 N -4.28 4.48 0.38 0.00 0.05 -1.26 0.00 135.00 134.37 2byf s PRO 26 Ca 0.53 1.62 0.25 0.00 0.05 0.00 0.00 61.00 63.45 2byf s PRO 26 Cb -0.08 -2.92 1.37 0.00 0.05 0.00 0.00 34.50 32.92 2byf s PRO 26 CO 0.31 0.12 1.77 0.00 0.05 0.00 0.00 177.00 179.25 2byf h ARG 27 N 3.29 0.00 0.00 4.56 3.08 -1.86 0.63 114.38 124.08 2byf h ARG 27 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2byf h ARG 27 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 2byf h ARG 27 CO 0.65 0.00 -0.87 1.33 -1.07 0.00 0.00 179.97 180.01 2byf n VAL 28 N -2.38 0.10 -1.67 2.04 0.24 -1.26 -4.33 118.33 111.07 2byf n VAL 28 Ca -0.02 -0.14 -0.47 0.00 -2.04 0.00 0.00 64.34 61.67 2byf n VAL 28 Cb 0.04 0.35 -0.04 0.00 -1.47 0.00 0.00 33.84 32.72 2byf n VAL 28 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2byf n SER 29 N -1.76 3.08 -4.67 -1.34 3.41 0.22 -4.76 113.62 107.80 2byf n SER 29 Ca 0.03 1.06 -0.23 0.00 -0.26 0.00 0.00 58.87 59.47 2byf n SER 29 Cb 0.39 -1.39 0.01 0.00 -0.26 0.00 0.00 64.21 62.96 2byf n SER 29 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2byf n THR 30 N 3.84 0.00 -0.15 6.66 5.66 -1.26 -1.15 114.28 127.88 2byf n THR 30 Ca 0.19 -2.00 -0.04 0.00 -3.05 0.00 0.00 64.05 59.15 2byf n THR 30 Cb 0.28 -0.15 0.02 0.00 -1.55 0.00 0.00 70.33 68.94 2byf n THR 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2byf h ALA 31 N 0.58 0.17 -0.87 1.79 0.00 -1.78 0.23 119.26 119.37 2byf h ALA 31 Ca -0.31 0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.87 2byf h ALA 31 Cb 1.19 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 19.43 2byf h ALA 31 CO 0.48 -0.53 0.57 0.37 0.00 0.00 0.00 179.25 180.13 2byf h GLN 32 N -0.09 0.83 0.16 0.00 -0.00 -1.77 0.55 115.11 114.79 2byf h GLN 32 Ca 0.23 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.65 58.82 2byf h GLN 32 Cb 0.45 -0.19 0.00 0.00 0.00 0.00 0.00 27.48 27.75 2byf h GLN 32 CO -0.55 0.55 -0.08 -0.44 0.00 0.00 0.00 178.83 178.31 2byf h ASP 33 N 0.86 -0.18 0.39 -0.69 3.32 -0.91 -2.69 116.42 116.51 2byf h ASP 33 Ca 0.40 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 2byf h ASP 33 Cb 0.42 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2byf h ASP 33 CO -0.17 0.31 -0.22 1.62 -1.72 0.00 0.00 179.24 179.07 2byf h VAL 34 N -0.75 0.88 0.41 -1.35 3.04 -0.93 0.15 116.25 117.69 2byf h VAL 34 Ca -0.02 -0.83 -0.01 0.00 -1.01 0.00 0.00 66.70 64.83 2byf h VAL 34 Cb 0.52 1.49 -0.02 0.00 -2.01 0.00 0.00 31.29 31.27 2byf h VAL 34 CO 0.04 0.21 -0.39 0.40 -1.01 0.00 0.00 177.57 176.82 2byf h ILE 35 N 0.00 0.22 -0.15 3.17 1.08 0.21 0.11 117.51 122.14 2byf h ILE 35 Ca -0.00 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.35 2byf h ILE 35 Cb 0.47 0.22 -0.01 0.00 -3.07 0.00 0.00 36.82 34.43 2byf h ILE 35 CO 0.03 0.00 -0.41 -0.61 -0.69 0.00 0.00 178.15 176.46 2byf h GLN 36 N -0.81 0.35 -0.76 2.37 5.75 -1.06 -0.55 115.11 120.41 2byf h GLN 36 Ca -0.03 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.30 2byf h GLN 36 Cb 0.72 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.23 2byf h GLN 36 CO -0.05 0.71 0.48 0.37 -2.65 0.00 0.00 178.83 177.69 2byf h GLN 37 N 0.29 1.01 -0.38 1.69 4.15 -0.57 0.27 115.11 121.57 2byf h GLN 37 Ca 0.03 -0.08 -0.11 0.00 0.77 0.00 0.00 58.65 59.26 2byf h GLN 37 Cb 0.86 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 2byf h GLN 37 CO 0.07 0.69 -0.19 1.15 -1.93 0.00 0.00 178.83 178.62 2byf h THR 38 N 1.03 1.27 -0.86 2.39 2.02 -0.41 -0.40 112.91 117.94 2byf h THR 38 Ca 0.27 -1.28 0.10 0.00 0.77 0.00 0.00 66.41 66.27 2byf h THR 38 Cb -0.08 1.18 -0.07 0.00 -1.74 0.00 0.00 68.15 67.43 2byf h THR 38 CO -0.06 0.43 0.51 -0.07 0.37 0.00 0.00 175.52 176.70 2byf h LEU 39 N 0.65 0.73 -0.51 2.58 4.07 -0.10 0.21 115.31 122.95 2byf h LEU 39 Ca 0.10 0.05 -0.17 0.00 0.08 0.00 0.00 57.88 57.94 2byf h LEU 39 Cb 0.68 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 2byf h LEU 39 CO 0.05 0.42 -0.66 0.00 -1.08 0.00 0.00 178.44 177.17 2byf h LYS 41 N 0.26 0.72 -0.04 0.00 1.63 -0.46 -3.31 116.57 115.36 2byf h LYS 41 Ca -0.02 -0.65 0.00 0.00 -0.85 0.00 0.00 60.65 59.14 2byf h LYS 41 Cb 1.21 0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 2byf h LYS 41 CO 0.11 1.25 0.00 0.00 -3.45 0.00 0.00 179.45 177.36 2byf n ALA 42 N -2.61 2.50 -1.75 5.00 0.00 0.68 -4.58 120.51 119.76 2byf n ALA 42 Ca -0.08 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 2byf n ALA 42 Cb 0.79 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 19.26 2byf n ALA 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2byf s LYS 43 N -1.98 3.97 0.00 0.00 -2.85 -0.60 -1.43 119.74 116.85 2byf s LYS 43 Ca 0.32 2.39 0.00 0.00 -1.00 0.00 0.00 55.97 57.68 2byf s LYS 43 Cb 0.20 -4.16 0.00 0.00 -2.06 0.00 0.00 37.83 31.81 2byf s LYS 43 CO 0.31 -1.14 0.00 0.66 0.10 0.00 0.00 175.35 175.28 2byf n TYR 44 N 8.19 0.00 0.02 1.78 4.01 -1.26 -4.67 117.16 125.23 2byf n TYR 44 Ca 0.21 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.90 2byf n TYR 44 Cb 0.42 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.42 2byf n TYR 44 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2byf h SER 45 N 0.00 -0.45 -0.36 7.72 0.02 -1.75 -1.34 113.55 117.38 2byf h SER 45 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2byf h SER 45 Cb 0.00 0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2byf h SER 45 CO 0.00 -0.15 0.00 -1.22 -1.14 0.00 0.00 176.83 174.32 2byf n TYR 46 N -3.30 1.30 -4.23 3.45 4.02 -0.52 -4.87 117.16 113.01 2byf n TYR 46 Ca -0.02 -0.45 -0.34 0.00 -0.01 0.00 0.00 57.90 57.08 2byf n TYR 46 Cb 0.11 -0.35 -0.05 0.00 -0.02 0.00 0.00 39.34 39.03 2byf n TYR 46 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2byf n SER 47 N 0.40 -1.57 -4.17 7.72 3.41 -0.51 -4.84 113.62 114.06 2byf n SER 47 Ca 0.17 -1.10 -0.43 0.00 -0.26 0.00 0.00 58.87 57.26 2byf n SER 47 Cb 0.84 -2.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.35 2byf n SER 47 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2byf n ILE 48 N -4.37 4.11 -0.06 -1.33 2.08 -0.72 -4.40 119.36 114.68 2byf n ILE 48 Ca -0.08 -4.25 0.00 0.00 0.56 0.00 0.00 62.75 58.97 2byf n ILE 48 Cb 0.57 -2.43 0.00 0.00 -0.75 0.00 0.00 39.64 37.03 2byf n ILE 48 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2byf n LEU 49 N 5.57 0.42 0.01 1.39 7.99 -1.26 -4.23 117.00 126.90 2byf n LEU 49 Ca 0.42 -0.65 -0.13 0.00 -0.01 0.00 0.00 56.01 55.65 2byf n LEU 49 Cb 0.40 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.62 2byf n LEU 49 CO 0.76 0.11 0.66 0.28 -1.51 0.00 0.00 177.39 177.68 2byf h SER 50 N 0.00 -0.04 -3.99 -1.43 0.02 -2.00 -3.38 113.55 102.73 2byf h SER 50 Ca 0.00 -0.38 -0.67 0.00 -0.84 0.00 0.00 61.79 59.91 2byf h SER 50 Cb 0.03 0.01 -0.38 0.00 0.14 0.00 0.00 62.40 62.20 2byf h SER 50 CO 0.00 0.36 -0.59 0.20 -1.14 0.00 0.00 176.83 175.67 2byf s ASN 51 N -5.55 4.79 0.00 3.07 -0.87 -1.26 -4.90 114.94 110.22 2byf s ASN 51 Ca -0.15 -2.59 0.28 0.00 -1.57 0.00 0.00 52.86 48.83 2byf s ASN 51 Cb 0.02 -1.71 1.40 0.00 -0.02 0.00 0.00 41.25 40.94 2byf s ASN 51 CO 0.65 -0.35 1.93 -0.81 -2.57 0.00 0.00 177.10 175.95 2byf n PRO 52 N 3.74 1.31 -3.81 -0.60 -0.04 -1.26 -4.76 135.00 129.58 2byf n PRO 52 Ca 0.04 -0.46 -0.36 0.00 -0.04 0.00 0.00 63.50 62.68 2byf n PRO 52 Cb 0.38 -1.46 -0.11 0.00 -0.04 0.00 0.00 33.50 32.27 2byf n PRO 52 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2byf s ASN 53 N -1.91 5.62 0.00 3.54 4.22 -1.26 -4.98 114.94 120.16 2byf s ASN 53 Ca 0.41 -0.02 0.29 0.00 -2.14 0.00 0.00 52.86 51.40 2byf s ASN 53 Cb 0.20 -2.00 1.62 0.00 1.28 0.00 0.00 41.25 42.35 2byf s ASN 53 CO 0.33 0.06 2.05 -0.81 -2.04 0.00 0.00 177.10 176.68 2byf n PRO 54 N 4.32 0.70 0.24 3.55 -0.04 -1.26 -3.87 135.00 138.64 2byf n PRO 54 Ca -0.16 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.42 2byf n PRO 54 Cb 0.52 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 33.02 2byf n PRO 54 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2byf h SER 55 N 0.00 0.00 -0.61 3.54 4.64 -1.97 -2.38 113.55 116.77 2byf h SER 55 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2byf h SER 55 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2byf h SER 55 CO 0.00 0.18 0.00 0.47 -0.87 0.00 0.00 176.83 176.61 2byf n ASP 56 N -3.41 3.40 -4.64 4.97 8.00 -1.25 -4.92 116.55 118.70 2byf n ASP 56 Ca -0.00 -1.99 -0.27 0.00 0.71 0.00 0.00 54.79 53.23 2byf n ASP 56 Cb 0.38 -0.41 -0.08 0.00 -0.02 0.00 0.00 41.12 40.99 2byf n ASP 56 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2byf s TYR 57 N -1.19 2.81 -0.00 1.24 1.51 -0.90 -0.37 117.35 120.45 2byf s TYR 57 Ca 0.42 -0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 56.33 2byf s TYR 57 Cb 0.22 -1.38 -0.00 0.00 -0.11 0.00 0.00 41.96 40.69 2byf s TYR 57 CO 0.29 0.50 0.01 0.14 -1.11 0.00 0.00 175.55 175.39 2byf s VAL 58 N -1.63 0.03 0.09 0.71 -7.23 0.61 -4.60 120.40 108.39 2byf s VAL 58 Ca 0.26 -0.24 -0.10 0.00 -1.81 0.00 0.00 61.98 60.09 2byf s VAL 58 Cb -0.10 -0.10 -0.06 0.00 0.56 0.00 0.00 36.38 36.68 2byf s VAL 58 CO 0.17 -0.13 0.42 -0.22 -0.31 0.00 0.00 175.10 175.03 2byf s LEU 59 N -0.38 4.34 -0.17 1.32 2.96 -1.26 -1.92 118.68 123.57 2byf s LEU 59 Ca -0.04 0.82 -0.05 0.00 -0.22 0.00 0.00 54.13 54.64 2byf s LEU 59 Cb -0.03 -3.04 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 2byf s LEU 59 CO -0.00 0.16 0.00 -0.76 -1.32 0.00 0.00 176.35 174.43 2byf s LEU 60 N -1.95 3.46 -1.05 -0.68 2.01 0.65 -1.24 118.68 119.88 2byf s LEU 60 Ca 0.34 -0.06 -0.16 0.00 0.01 0.00 0.00 54.13 54.26 2byf s LEU 60 Cb -0.14 -1.85 0.16 0.00 0.01 0.00 0.00 46.19 44.37 2byf s LEU 60 CO 0.18 0.16 1.22 -1.83 1.01 0.00 0.00 176.35 177.10 2byf s GLU 61 N 0.43 3.84 -0.18 1.70 -1.05 0.20 -0.16 118.70 123.48 2byf s GLU 61 Ca -0.01 -2.25 -0.23 0.00 -0.15 0.00 0.00 54.97 52.32 2byf s GLU 61 Cb -0.14 -4.91 -0.02 0.00 -0.44 0.00 0.00 34.13 28.62 2byf s GLU 61 CO 0.02 -1.70 0.75 -2.00 0.95 0.00 0.00 175.26 173.28 2byf s GLU 62 N 1.76 4.27 -0.22 -4.83 2.12 -0.69 -2.04 118.70 119.07 2byf s GLU 62 Ca 0.35 0.86 0.00 0.00 0.36 0.00 0.00 54.97 56.55 2byf s GLU 62 Cb -0.05 -3.57 0.03 0.00 0.26 0.00 0.00 34.13 30.80 2byf s GLU 62 CO -0.05 -0.28 -0.12 0.54 -0.54 0.00 0.00 175.26 174.80 2byf s VAL 63 N 2.01 2.46 -0.45 3.70 0.11 0.59 -0.18 120.40 128.64 2byf s VAL 63 Ca 0.35 -1.08 -0.27 0.00 -2.93 0.00 0.00 61.98 58.04 2byf s VAL 63 Cb -0.16 -2.20 -0.04 0.00 -1.53 0.00 0.00 36.38 32.45 2byf s VAL 63 CO 0.12 0.30 2.02 -0.69 -3.33 0.00 0.00 175.10 173.52 2byf s VAL 64 N 1.28 3.26 -0.46 2.04 1.01 -1.22 -0.36 120.40 125.95 2byf s VAL 64 Ca 0.01 0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.15 2byf s VAL 64 Cb -0.16 -3.51 0.12 0.00 0.00 0.00 0.00 36.38 32.84 2byf s VAL 64 CO -0.08 -0.43 0.28 -0.54 0.00 0.00 0.00 175.10 174.34 2byf s LYS 65 N 6.86 2.23 0.49 2.72 -0.14 0.60 -3.14 119.74 129.35 2byf s LYS 65 Ca 0.83 -1.93 -0.24 0.00 -1.36 0.00 0.00 55.97 53.27 2byf s LYS 65 Cb -0.19 -3.70 -0.07 0.00 -1.68 0.00 0.00 37.83 32.19 2byf s LYS 65 CO 0.28 -1.12 1.41 0.16 -0.76 0.00 0.00 175.35 175.32 2byf s ASP 66 N 1.86 5.61 -0.11 2.83 -4.77 -1.25 -2.37 116.67 118.46 2byf s ASP 66 Ca 0.09 2.89 0.16 0.00 -3.30 0.00 0.00 52.55 52.39 2byf s ASP 66 Cb -0.23 -2.65 0.26 0.00 -1.09 0.00 0.00 42.92 39.21 2byf s ASP 66 CO -0.03 -1.35 1.14 1.07 0.70 0.00 0.00 175.17 176.70 2byf n THR 67 N -0.53 1.78 0.10 2.11 5.66 -1.26 -4.76 114.28 117.38 2byf n THR 67 Ca 0.07 -2.07 -0.06 0.00 -3.05 0.00 0.00 64.05 58.95 2byf n THR 67 Cb 0.43 -0.13 -0.03 0.00 -1.55 0.00 0.00 70.33 69.05 2byf n THR 67 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 2byf h THR 68 N 0.10 0.00 0.00 1.09 2.02 -1.78 -3.44 112.91 110.90 2byf h THR 68 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2byf h THR 68 Cb 0.95 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2byf h THR 68 CO 0.01 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.49 2byf n ASN 69 N -3.22 0.00 0.01 4.18 3.02 -1.26 -1.92 115.26 116.06 2byf n ASN 69 Ca -0.04 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.30 2byf n ASN 69 Cb 0.14 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.17 2byf n ASN 69 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2byf h LYS 70 N 0.00 0.27 -3.95 3.52 1.79 -2.01 -3.49 116.57 112.69 2byf h LYS 70 Ca 0.00 -0.46 -0.13 0.00 -2.18 0.00 0.00 60.65 57.88 2byf h LYS 70 Cb 0.00 0.17 -0.17 0.00 -1.58 0.00 0.00 32.23 30.65 2byf h LYS 70 CO 0.00 1.22 -0.59 0.21 -1.08 0.00 0.00 179.45 179.21 2byf s LYS 71 N -2.55 0.56 -0.49 3.15 2.20 -0.81 -5.08 119.74 116.72 2byf s LYS 71 Ca -0.22 -0.87 -0.35 0.00 -0.36 0.00 0.00 55.97 54.17 2byf s LYS 71 Cb 0.06 0.21 -0.14 0.00 -1.51 0.00 0.00 37.83 36.45 2byf s LYS 71 CO 0.77 -0.13 2.28 2.41 -0.36 0.00 0.00 175.35 180.32 2byf n THR 72 N 0.69 0.09 -3.78 3.43 -1.04 -1.26 -4.49 114.28 107.92 2byf n THR 72 Ca -0.18 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.05 61.47 2byf n THR 72 Cb 0.59 -1.37 -0.14 0.00 -1.82 0.00 0.00 70.33 67.59 2byf n THR 72 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2byf s THR 73 N 7.84 -0.04 0.26 12.58 2.01 -1.26 -5.02 115.64 132.01 2byf s THR 73 Ca 1.14 0.14 -0.31 0.00 0.31 0.00 0.00 61.69 62.97 2byf s THR 73 Cb -0.97 -0.18 -0.12 0.00 0.01 0.00 0.00 72.50 71.23 2byf s THR 73 CO 0.50 0.06 1.57 0.35 -0.69 0.00 0.00 174.62 176.40 2byf n THR 74 N 3.87 0.79 -2.08 -0.82 -2.24 -1.26 -3.36 114.28 109.19 2byf n THR 74 Ca -0.23 -0.20 -0.39 0.00 -2.27 0.00 0.00 64.05 60.96 2byf n THR 74 Cb 0.54 -1.82 -0.01 0.00 -2.10 0.00 0.00 70.33 66.94 2byf n THR 74 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2byf s PRO 75 N -0.15 3.98 0.35 -0.78 0.02 -1.26 -4.25 135.00 132.91 2byf s PRO 75 Ca 0.68 2.12 0.08 0.00 0.02 0.00 0.00 61.00 63.90 2byf s PRO 75 Cb -0.55 -2.75 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 2byf s PRO 75 CO 0.46 -0.47 0.14 0.15 -0.33 0.00 0.00 177.00 176.94 2byf s LYS 76 N -2.24 2.32 -0.34 5.54 1.02 -1.00 -4.90 119.74 120.15 2byf s LYS 76 Ca 0.57 -1.61 0.00 0.00 0.02 0.00 0.00 55.97 54.95 2byf s LYS 76 Cb -0.37 -2.13 0.09 0.00 -0.52 0.00 0.00 37.83 34.90 2byf s LYS 76 CO 0.48 0.08 0.07 -1.54 -0.92 0.00 0.00 175.35 173.52 2byf s SER 77 N -3.84 4.92 -0.72 2.83 1.04 -1.26 -0.29 113.70 116.38 2byf s SER 77 Ca 0.38 -1.80 -0.26 0.00 0.48 0.00 0.00 55.95 54.75 2byf s SER 77 Cb -0.01 -1.71 0.01 0.00 0.10 0.00 0.00 66.02 64.41 2byf s SER 77 CO 0.22 -0.38 1.53 -0.55 0.98 0.00 0.00 173.24 175.05 2byf s SER 78 N 1.32 5.81 -0.13 7.02 0.15 0.52 -4.83 113.70 123.55 2byf s SER 78 Ca 0.03 -0.23 -0.15 0.00 0.70 0.00 0.00 55.95 56.31 2byf s SER 78 Cb -0.21 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.51 2byf s SER 78 CO -0.05 -2.06 0.36 -1.58 1.20 0.00 0.00 173.24 171.12 2byf s GLN 79 N 6.23 4.23 -0.02 5.44 0.74 -1.26 -0.30 119.66 134.72 2byf s GLN 79 Ca 0.49 0.24 0.02 0.00 0.05 0.00 0.00 55.36 56.17 2byf s GLN 79 Cb -0.09 -3.40 -0.00 0.00 1.10 0.00 0.00 33.01 30.62 2byf s GLN 79 CO 0.15 0.28 -0.09 0.50 -0.55 0.00 0.00 175.29 175.58 2byf s ARG 80 N 0.31 0.83 -0.11 1.67 3.00 -0.87 -4.93 118.95 118.84 2byf s ARG 80 Ca 0.20 -0.29 -0.10 0.00 -1.00 0.00 0.00 55.73 54.54 2byf s ARG 80 Cb -0.14 -0.79 -0.05 0.00 0.00 0.00 0.00 34.95 33.98 2byf s ARG 80 CO 0.07 0.13 0.22 0.08 0.00 0.00 0.00 175.30 175.80 2byf s VAL 81 N 0.05 5.37 0.51 7.11 1.01 -1.26 0.61 120.40 133.80 2byf s VAL 81 Ca -0.01 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.38 2byf s VAL 81 Cb -0.06 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.83 2byf s VAL 81 CO 0.00 0.56 0.73 -0.76 0.00 0.00 0.00 175.10 175.62 2byf s LEU 82 N -0.66 3.41 0.00 3.92 1.43 -0.37 -4.91 118.68 121.49 2byf s LEU 82 Ca 0.16 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 2byf s LEU 82 Cb -0.13 -2.91 0.03 0.00 0.03 0.00 0.00 46.19 43.21 2byf s LEU 82 CO 0.05 -0.99 0.22 0.18 0.23 0.00 0.00 176.35 176.04 2byf n LEU 83 N -2.22 0.00 -0.17 1.79 4.32 -1.26 -4.64 117.00 114.82 2byf n LEU 83 Ca 0.06 -1.26 -0.06 0.00 -0.02 0.00 0.00 56.01 54.74 2byf n LEU 83 Cb 0.59 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.34 2byf n LEU 83 CO 0.45 -0.44 0.65 -0.78 -1.22 0.00 0.00 177.39 176.04 2byf h ASP 84 N 0.24 -1.05 -2.16 -1.43 3.58 -1.98 -3.17 116.42 110.45 2byf h ASP 84 Ca -0.15 0.21 -0.58 0.00 0.42 0.00 0.00 57.03 56.92 2byf h ASP 84 Cb 0.57 0.52 -0.41 0.00 1.72 0.00 0.00 39.33 41.73 2byf h ASP 84 CO 0.23 -0.30 -0.74 0.00 -2.88 0.00 0.00 179.24 175.55 2byf n GLN 85 N -5.42 2.21 0.18 0.28 10.64 -1.26 -2.86 117.38 121.13 2byf n GLN 85 Ca 0.03 -4.34 0.06 0.00 -1.83 0.00 0.00 57.00 50.92 2byf n GLN 85 Cb 0.34 -2.01 0.17 0.00 -0.86 0.00 0.00 30.24 27.88 2byf n GLN 85 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 2byf h GLU 86 N 3.85 0.00 -1.74 2.61 4.57 -1.94 -3.49 114.58 118.44 2byf h GLU 86 Ca 0.16 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 2byf h GLU 86 Cb 0.69 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.28 2byf h GLU 86 CO 0.74 0.35 -0.24 0.00 -1.18 0.00 0.00 179.01 178.67 2byf h VAL 88 N 1.06 1.28 -0.04 0.00 2.07 -1.40 0.31 116.25 119.52 2byf h VAL 88 Ca 0.00 -2.16 -0.16 0.00 0.82 0.00 0.00 66.70 65.20 2byf h VAL 88 Cb 0.00 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 2byf h VAL 88 CO 0.00 0.67 -0.70 0.15 0.02 0.00 0.00 177.57 177.71 2byf h PHE 89 N 0.42 0.30 -0.13 1.57 3.57 -1.75 0.17 116.94 121.09 2byf h PHE 89 Ca -0.11 -0.13 -0.12 0.00 3.53 0.00 0.00 57.97 61.14 2byf h PHE 89 Cb 1.61 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.29 2byf h PHE 89 CO 0.10 0.85 -0.46 1.96 -2.23 0.00 0.00 178.31 178.53 2byf h GLN 90 N 0.15 0.33 -0.18 1.11 4.20 -1.80 -2.06 115.11 116.86 2byf h GLN 90 Ca -0.02 -0.18 -0.12 0.00 0.06 0.00 0.00 58.65 58.40 2byf h GLN 90 Cb 1.25 0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2byf h GLN 90 CO 0.11 0.72 -0.35 0.00 -0.67 0.00 0.00 178.83 178.64 2byf h ALA 91 N 1.25 0.29 0.00 3.87 0.00 0.03 -3.13 119.26 121.57 2byf h ALA 91 Ca 0.02 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 2byf h ALA 91 Cb 0.91 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2byf h ALA 91 CO 0.08 0.35 -0.11 0.37 0.00 0.00 0.00 179.25 179.94 2byf h GLN 92 N 0.21 0.00 -0.00 0.00 4.15 -0.59 -0.07 115.11 118.82 2byf h GLN 92 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2byf h GLN 92 Cb 0.95 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2byf h GLN 92 CO 0.08 0.11 -0.03 -1.13 -1.93 0.00 0.00 178.83 175.93 2byf n SER 93 N -4.33 0.10 0.10 -0.69 3.41 -0.78 -2.64 113.62 108.78 2byf n SER 93 Ca -0.03 -0.33 0.04 0.00 -0.26 0.00 0.00 58.87 58.29 2byf n SER 93 Cb 0.18 -0.21 -0.01 0.00 -0.26 0.00 0.00 64.21 63.92 2byf n SER 93 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2byf h LYS 94 N 0.12 0.00 -7.07 4.33 1.79 -0.95 -3.48 116.57 111.31 2byf h LYS 94 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.92 2byf h LYS 94 Cb 0.27 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 31.06 2byf h LYS 94 CO 0.00 0.31 0.55 -1.58 -1.08 0.00 0.00 179.45 177.65 2byf s TRP 95 N -3.02 2.27 -0.08 -1.35 0.52 -1.08 -4.93 118.94 111.26 2byf s TRP 95 Ca 0.01 1.44 0.12 0.00 0.02 0.00 0.00 56.10 57.68 2byf s TRP 95 Cb 0.08 -3.70 0.18 0.00 -1.15 0.00 0.00 33.47 28.88 2byf s TRP 95 CO 0.77 -2.73 1.09 1.63 0.02 0.00 0.00 176.95 177.73 2byf n LYS 96 N -1.35 0.83 -3.84 4.98 5.02 -1.26 -5.04 118.16 117.50 2byf n LYS 96 Ca 0.12 -1.97 -0.06 0.00 -2.02 0.00 0.00 58.31 54.38 2byf n LYS 96 Cb 0.47 -1.12 -0.02 0.00 -0.02 0.00 0.00 35.03 34.34 2byf n LYS 96 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2byf s GLY 97 N -2.14 -0.12 -0.65 0.72 0.00 -1.26 -4.92 107.32 98.96 2byf s GLY 97 Ca 0.20 -0.24 -0.20 0.00 0.00 0.00 0.00 44.72 44.48 2byf s GLY 97 CO 0.02 -0.07 0.82 0.00 0.00 0.00 0.00 173.10 173.86 2byf s ALA 98 N -3.82 3.35 0.00 3.20 0.00 -1.19 -4.48 121.76 118.82 2byf s ALA 98 Ca 0.11 -2.21 0.00 0.00 0.00 0.00 0.00 51.96 49.87 2byf s ALA 98 Cb -0.05 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2byf s ALA 98 CO 0.06 -2.52 0.00 0.41 0.00 0.00 0.00 175.76 173.71 2byf n GLY 99 N 5.27 3.89 3.34 0.00 0.00 -1.25 -3.40 105.19 113.04 2byf n GLY 99 Ca -0.04 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 43.96 2byf n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2byf s LYS 100 N 2.72 0.95 -0.11 1.61 3.01 0.75 -4.87 119.74 123.80 2byf s LYS 100 Ca 0.00 -0.36 -0.25 0.00 -1.01 0.00 0.00 55.97 54.36 2byf s LYS 100 Cb 0.00 0.43 -0.03 0.00 -1.01 0.00 0.00 37.83 37.22 2byf s LYS 100 CO 0.00 -0.33 0.78 -0.06 0.51 0.00 0.00 175.35 176.25 2byf s PHE 101 N -2.55 3.50 -0.23 3.18 0.08 0.00 -1.70 117.98 120.27 2byf s PHE 101 Ca -0.05 1.27 -0.09 0.00 0.12 0.00 0.00 56.93 58.19 2byf s PHE 101 Cb -0.01 -2.93 -0.04 0.00 -0.57 0.00 0.00 43.02 39.48 2byf s PHE 101 CO -0.03 -0.08 0.10 0.42 -0.10 0.00 0.00 175.22 175.53 2byf s ILE 102 N 1.49 4.83 -0.59 0.64 1.09 0.77 -1.35 121.20 128.08 2byf s ILE 102 Ca 0.39 -0.01 -0.27 0.00 -1.10 0.00 0.00 60.65 59.66 2byf s ILE 102 Cb -0.17 -3.24 0.03 0.00 -1.06 0.00 0.00 42.46 38.02 2byf s ILE 102 CO 0.16 0.37 1.13 -0.22 -0.10 0.00 0.00 174.94 176.28 2byf s LEU 103 N 1.11 3.62 0.36 2.97 2.96 -0.19 -0.25 118.68 129.26 2byf s LEU 103 Ca 0.05 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 53.93 2byf s LEU 103 Cb -0.14 -3.02 -0.06 0.00 0.50 0.00 0.00 46.19 43.47 2byf s LEU 103 CO 0.04 -1.44 0.05 -0.75 -1.32 0.00 0.00 176.35 172.93 2byf s LYS 104 N 4.73 1.78 0.42 1.98 2.20 -0.81 -4.52 119.74 125.53 2byf s LYS 104 Ca 0.39 -2.01 -0.01 0.00 -0.36 0.00 0.00 55.97 53.98 2byf s LYS 104 Cb -0.09 -1.04 -0.02 0.00 -1.51 0.00 0.00 37.83 35.17 2byf s LYS 104 CO 0.23 -0.20 0.65 -0.51 -0.36 0.00 0.00 175.35 175.16 2byf s LEU 105 N -3.57 3.76 0.00 5.43 1.02 -1.26 -0.28 118.68 123.78 2byf s LEU 105 Ca 0.33 0.45 0.25 0.00 0.02 0.00 0.00 54.13 55.18 2byf s LEU 105 Cb 0.08 -3.33 0.54 0.00 0.02 0.00 0.00 46.19 43.50 2byf s LEU 105 CO 0.15 -0.56 1.43 2.29 0.02 0.00 0.00 176.35 179.69 2byf n LYS 106 N -2.02 0.35 0.09 1.70 2.85 0.50 0.59 118.16 122.22 2byf n LYS 106 Ca -0.01 -0.21 0.12 0.00 -1.05 0.00 0.00 58.31 57.16 2byf n LYS 106 Cb 0.57 -1.50 0.28 0.00 -0.65 0.00 0.00 35.03 33.73 2byf n LYS 106 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2byf h GLU 107 N 0.52 0.00 0.00 -1.58 5.08 -1.94 -3.28 114.58 113.38 2byf h GLU 107 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 2byf h GLU 107 Cb 0.51 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 2byf h GLU 107 CO 0.00 0.00 -2.26 1.04 -1.00 0.00 0.00 179.01 176.79 2byf n GLN 108 N -2.25 0.67 -2.79 2.33 6.02 -1.08 -4.47 117.38 115.80 2byf n GLN 108 Ca 0.04 0.10 -0.44 0.00 -0.01 0.00 0.00 57.00 56.70 2byf n GLN 108 Cb 0.44 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.26 2byf n GLN 108 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2byf n VAL 109 N -3.06 4.24 -3.88 5.09 0.31 0.20 -4.51 118.33 116.71 2byf n VAL 109 Ca -0.38 -4.60 0.00 0.00 -0.01 0.00 0.00 64.34 59.35 2byf n VAL 109 Cb 0.95 -2.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 2byf n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2byf n GLN 110 N 5.52 1.89 -2.29 5.55 1.13 -1.19 -4.50 117.38 123.48 2byf n GLN 110 Ca 0.39 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 55.10 2byf n GLN 110 Cb 0.42 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.73 2byf n GLN 110 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2byf s ALA 111 N -2.00 2.46 -0.75 -1.58 0.00 -1.26 -4.88 121.76 113.74 2byf s ALA 111 Ca 0.00 -2.47 -0.26 0.00 0.00 0.00 0.00 51.96 49.23 2byf s ALA 111 Cb 0.00 -4.66 -0.12 0.00 0.00 0.00 0.00 23.12 18.34 2byf s ALA 111 CO 0.00 -4.38 2.35 -1.12 0.00 0.00 0.00 175.76 172.61 2byf s SER 112 N 5.53 4.12 -0.71 0.00 0.01 -1.20 -4.89 113.70 116.56 2byf s SER 112 Ca 0.62 0.13 -0.20 0.00 1.31 0.00 0.00 55.95 57.81 2byf s SER 112 Cb 0.01 -2.54 0.10 0.00 0.21 0.00 0.00 66.02 63.80 2byf s SER 112 CO 0.10 -3.59 0.91 -0.13 0.41 0.00 0.00 173.24 170.94 2byf s ARG 113 N 8.57 3.23 0.00 12.44 1.81 -1.26 -4.49 118.95 139.25 2byf s ARG 113 Ca 0.90 -1.29 0.00 0.00 -1.72 0.00 0.00 55.73 53.62 2byf s ARG 113 Cb -0.13 -4.41 0.00 0.00 -0.45 0.00 0.00 34.95 29.96 2byf s ARG 113 CO 0.10 -1.69 0.00 0.39 -0.68 0.00 0.00 175.30 173.42 2byf n GLU 114 N 6.80 0.00 -3.66 3.54 1.02 -1.26 -4.77 120.64 122.30 2byf n GLU 114 Ca 0.02 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.12 2byf n GLU 114 Cb 0.45 -0.08 -0.01 0.00 -0.02 0.00 0.00 31.44 31.78 2byf n GLU 114 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2byf s ASP 115 N 0.00 -0.18 0.00 1.62 2.15 -1.26 -5.28 116.67 113.72 2byf s ASP 115 Ca 0.00 -0.24 0.00 0.00 0.43 0.00 0.00 52.55 52.74 2byf s ASP 115 Cb 0.00 0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.99 2byf s ASP 115 CO 0.00 -0.66 0.00 0.29 -0.17 0.00 0.00 175.17 174.63