#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnf s SER 2 N 0.00 -1.02 0.00 1.61 0.15 -1.26 -5.16 113.70 108.03 2dnf s SER 2 Ca 0.00 1.45 0.02 0.00 0.70 0.00 0.00 55.95 58.13 2dnf s SER 2 Cb 0.00 2.15 -0.01 0.00 -1.71 0.00 0.00 66.02 66.46 2dnf s SER 2 CO 0.00 -0.22 -0.07 -0.94 1.20 0.00 0.00 173.24 173.21 2dnf s SER 3 N 2.85 0.78 0.00 5.45 1.04 -1.26 -5.12 113.70 117.45 2dnf s SER 3 Ca -0.04 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2dnf s SER 3 Cb -0.12 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 65.93 2dnf s SER 3 CO -0.18 0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2dnf n GLY 4 N 2.68 3.91 3.35 7.32 0.00 -1.26 -5.17 105.19 116.02 2dnf n GLY 4 Ca -0.15 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 2dnf n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dnf s SER 5 N 0.00 2.73 0.14 1.61 0.01 -1.26 -5.16 113.70 111.78 2dnf s SER 5 Ca 0.00 -0.94 0.05 0.00 1.31 0.00 0.00 55.95 56.37 2dnf s SER 5 Cb 0.00 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.02 2dnf s SER 5 CO 0.00 -0.08 -0.11 -0.44 0.41 0.00 0.00 173.24 173.02 2dnf s SER 6 N -2.99 1.86 0.54 2.44 0.01 -1.26 -5.09 113.70 109.22 2dnf s SER 6 Ca 0.20 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.49 2dnf s SER 6 Cb -0.04 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2dnf s SER 6 CO 0.08 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2dnf n GLY 7 N -0.05 -3.97 2.59 3.44 0.00 -1.26 -4.89 105.19 101.04 2dnf n GLY 7 Ca -0.11 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.87 2dnf n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnf n ARG 8 N -2.52 1.76 -2.71 1.61 1.74 -1.26 -5.10 116.66 110.17 2dnf n ARG 8 Ca 0.00 -3.62 -0.32 0.00 -0.77 0.00 0.00 57.85 53.14 2dnf n ARG 8 Cb 0.44 -1.56 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 2dnf n ARG 8 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2dnf s LYS 9 N -3.18 3.98 1.23 5.56 -2.85 -1.26 -5.07 119.74 118.16 2dnf s LYS 9 Ca 0.34 0.84 -0.20 0.00 -1.00 0.00 0.00 55.97 55.95 2dnf s LYS 9 Cb 0.43 -2.25 0.30 0.00 -2.06 0.00 0.00 37.83 34.25 2dnf s LYS 9 CO -0.03 -0.10 1.11 -1.25 0.10 0.00 0.00 175.35 175.18 2dnf s PRO 10 N -3.64 -1.47 0.31 1.78 0.04 -1.26 -5.06 135.00 125.69 2dnf s PRO 10 Ca 0.57 -0.15 0.03 0.00 0.04 0.00 0.00 61.00 61.49 2dnf s PRO 10 Cb -0.10 -1.57 -0.03 0.00 0.04 0.00 0.00 34.50 32.84 2dnf s PRO 10 CO 0.25 -3.86 0.47 -0.48 0.04 0.00 0.00 177.00 173.42 2dnf s LEU 11 N -7.01 4.10 0.00 -3.56 0.05 -1.26 -4.96 118.68 106.04 2dnf s LEU 11 Ca 0.72 0.20 0.00 0.00 0.05 0.00 0.00 54.13 55.09 2dnf s LEU 11 Cb -0.08 -3.04 0.00 0.00 -2.05 0.00 0.00 46.19 41.02 2dnf s LEU 11 CO 0.56 -0.25 0.00 0.00 -0.55 0.00 0.00 176.35 176.10 2dnf n GLN 12 N -1.64 0.00 -3.64 1.48 1.13 -1.26 -5.06 117.38 108.40 2dnf n GLN 12 Ca -0.05 0.06 -0.10 0.00 -1.94 0.00 0.00 57.00 54.97 2dnf n GLN 12 Cb 0.57 -0.35 -0.07 0.00 0.11 0.00 0.00 30.24 30.50 2dnf n GLN 12 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2dnf s GLU 13 N -0.39 0.66 0.90 -1.09 2.12 -1.26 -5.02 118.70 114.62 2dnf s GLU 13 Ca 0.00 0.88 -0.12 0.00 0.36 0.00 0.00 54.97 56.09 2dnf s GLU 13 Cb 0.00 0.27 0.13 0.00 0.26 0.00 0.00 34.13 34.79 2dnf s GLU 13 CO 0.00 -0.09 1.09 -1.25 -0.54 0.00 0.00 175.26 174.47 2dnf s PRO 14 N 0.68 1.25 -0.04 4.30 0.04 -1.26 -3.95 135.00 136.02 2dnf s PRO 14 Ca -0.02 0.82 -0.01 0.00 0.04 0.00 0.00 61.00 61.83 2dnf s PRO 14 Cb -0.05 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.71 2dnf s PRO 14 CO -0.07 -2.25 0.01 0.00 0.04 0.00 0.00 177.00 174.74 2dnf s THR 16 N 1.48 4.61 0.05 0.00 2.01 -1.26 -1.38 115.64 121.15 2dnf s THR 16 Ca -0.03 -0.41 0.06 0.00 0.31 0.00 0.00 61.69 61.61 2dnf s THR 16 Cb -0.13 -4.50 -0.04 0.00 0.01 0.00 0.00 72.50 67.85 2dnf s THR 16 CO -0.03 -1.12 -0.12 0.27 -0.69 0.00 0.00 174.62 172.94 2dnf s ILE 17 N 3.31 3.27 -0.00 1.82 -4.36 -0.21 -1.31 121.20 123.72 2dnf s ILE 17 Ca 0.19 -1.08 -0.12 0.00 -0.26 0.00 0.00 60.65 59.38 2dnf s ILE 17 Cb -0.18 -2.45 -0.05 0.00 1.25 0.00 0.00 42.46 41.02 2dnf s ILE 17 CO 0.12 0.28 0.36 -0.36 0.24 0.00 0.00 174.94 175.57 2dnf s PHE 18 N -1.05 3.67 0.21 1.37 0.08 -0.13 -0.53 117.98 121.61 2dnf s PHE 18 Ca 0.18 0.86 0.11 0.00 0.12 0.00 0.00 56.93 58.20 2dnf s PHE 18 Cb -0.11 -2.20 -0.04 0.00 -0.57 0.00 0.00 43.02 40.10 2dnf s PHE 18 CO 0.09 0.63 -0.18 -0.51 -0.10 0.00 0.00 175.22 175.15 2dnf s LEU 19 N -1.27 2.64 -0.07 -0.37 2.01 -0.89 -0.43 118.68 120.30 2dnf s LEU 19 Ca 0.24 -0.81 -0.05 0.00 0.01 0.00 0.00 54.13 53.52 2dnf s LEU 19 Cb -0.15 -1.31 0.02 0.00 0.01 0.00 0.00 46.19 44.76 2dnf s LEU 19 CO 0.13 0.10 0.17 -0.63 1.01 0.00 0.00 176.35 177.13 2dnf s ILE 20 N -1.85 -0.01 0.15 -0.59 1.01 -0.95 0.65 121.20 119.61 2dnf s ILE 20 Ca 0.24 0.04 -0.31 0.00 0.00 0.00 0.00 60.65 60.62 2dnf s ILE 20 Cb -0.08 -0.25 -0.09 0.00 0.01 0.00 0.00 42.46 42.05 2dnf s ILE 20 CO 0.13 0.02 1.46 0.00 0.00 0.00 0.00 174.94 176.54 2dnf s ALA 21 N 0.39 3.66 0.18 9.38 0.00 -1.26 -0.66 121.76 133.45 2dnf s ALA 21 Ca -0.02 1.24 -0.32 0.00 0.00 0.00 0.00 51.96 52.86 2dnf s ALA 21 Cb -0.04 -3.57 -0.10 0.00 0.00 0.00 0.00 23.12 19.41 2dnf s ALA 21 CO -0.02 -0.69 1.59 1.21 0.00 0.00 0.00 175.76 177.86 2dnf s ASN 22 N 1.00 6.55 0.00 0.00 2.47 -1.04 -1.78 114.94 122.14 2dnf s ASN 22 Ca 0.66 2.67 0.00 0.00 0.42 0.00 0.00 52.86 56.60 2dnf s ASN 22 Cb -0.40 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 36.80 2dnf s ASN 22 CO 0.32 -0.85 0.00 0.61 -3.72 0.00 0.00 177.10 173.47 2dnf n GLY 23 N 3.73 0.60 3.29 1.21 0.00 -1.26 -5.01 105.19 107.74 2dnf n GLY 23 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2dnf n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dnf s ASP 24 N -2.11 4.86 -0.13 1.61 1.11 -0.73 -4.94 116.67 116.34 2dnf s ASP 24 Ca 0.00 -0.81 0.18 0.00 0.18 0.00 0.00 52.55 52.10 2dnf s ASP 24 Cb 0.00 -1.80 0.28 0.00 1.07 0.00 0.00 42.92 42.47 2dnf s ASP 24 CO 0.00 -0.18 1.15 0.18 1.18 0.00 0.00 175.17 177.50 2dnf n LEU 25 N 4.79 2.24 -0.05 1.23 7.99 -1.26 -4.68 117.00 127.25 2dnf n LEU 25 Ca -0.15 -3.01 -0.07 0.00 -0.01 0.00 0.00 56.01 52.77 2dnf n LEU 25 Cb 0.47 -0.41 -0.04 0.00 -0.11 0.00 0.00 43.42 43.33 2dnf n LEU 25 CO 0.30 0.71 -0.81 -0.38 -1.51 0.00 0.00 177.39 175.70 2dnf n ILE 26 N -1.35 0.53 -3.57 -0.08 -0.00 -1.26 -5.03 119.36 108.61 2dnf n ILE 26 Ca 0.15 -0.20 -0.33 0.00 -0.00 0.00 0.00 62.75 62.38 2dnf n ILE 26 Cb 0.65 -0.90 -0.05 0.00 -0.00 0.00 0.00 39.64 39.34 2dnf n ILE 26 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.55 176.75 2dnf s ASN 27 N -4.98 6.59 0.84 4.38 0.01 -1.26 -5.10 114.94 115.41 2dnf s ASN 27 Ca -0.13 0.75 0.00 0.00 -0.71 0.00 0.00 52.86 52.77 2dnf s ASN 27 Cb 0.03 -2.16 0.00 0.00 0.41 0.00 0.00 41.25 39.54 2dnf s ASN 27 CO 0.21 0.07 0.00 -0.81 -1.51 0.00 0.00 177.10 175.06 2dnf n PRO 28 N 0.36 -0.71 -1.44 -0.60 -0.04 -1.26 -4.93 135.00 126.37 2dnf n PRO 28 Ca -0.04 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.29 2dnf n PRO 28 Cb 0.52 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.06 2dnf n PRO 28 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dnf n ALA 29 N -3.00 -0.17 -3.67 0.55 0.00 -1.26 -4.77 120.51 108.19 2dnf n ALA 29 Ca 0.00 -0.99 -0.29 0.00 0.00 0.00 0.00 53.44 52.16 2dnf n ALA 29 Cb 0.00 0.10 -0.15 0.00 0.00 0.00 0.00 19.45 19.40 2dnf n ALA 29 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dnf s SER 30 N -3.26 3.75 -0.05 0.00 0.01 0.21 -4.87 113.70 109.50 2dnf s SER 30 Ca 0.36 -1.44 -0.31 0.00 1.31 0.00 0.00 55.95 55.88 2dnf s SER 30 Cb -0.02 -0.67 -0.09 0.00 0.21 0.00 0.00 66.02 65.46 2dnf s SER 30 CO 0.24 -0.41 2.01 -1.14 0.41 0.00 0.00 173.24 174.35 2dnf n ARG 31 N 5.00 2.51 -4.13 12.44 0.63 -1.26 -2.09 116.66 129.76 2dnf n ARG 31 Ca -0.04 0.88 -0.19 0.00 -0.92 0.00 0.00 57.85 57.58 2dnf n ARG 31 Cb 0.43 -2.96 -0.16 0.00 0.45 0.00 0.00 32.46 30.21 2dnf n ARG 31 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2dnf s LEU 32 N 5.18 1.33 -0.07 6.15 2.96 0.32 -4.99 118.68 129.56 2dnf s LEU 32 Ca 0.93 -0.11 -0.10 0.00 -0.22 0.00 0.00 54.13 54.63 2dnf s LEU 32 Cb -0.48 -0.40 -0.05 0.00 0.50 0.00 0.00 46.19 45.76 2dnf s LEU 32 CO 0.43 -0.06 0.25 -0.22 -1.32 0.00 0.00 176.35 175.44 2dnf s LEU 33 N 0.88 4.42 -0.10 -0.68 2.96 -1.26 -1.04 118.68 123.86 2dnf s LEU 33 Ca -0.11 0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.49 2dnf s LEU 33 Cb -0.14 -2.28 0.01 0.00 0.50 0.00 0.00 46.19 44.28 2dnf s LEU 33 CO -0.00 0.37 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.62 2dnf s ILE 34 N -1.02 1.44 0.42 6.68 1.01 -0.48 -4.93 121.20 124.33 2dnf s ILE 34 Ca 0.19 -0.62 -0.24 0.00 0.00 0.00 0.00 60.65 59.97 2dnf s ILE 34 Cb -0.14 -1.31 -0.08 0.00 0.01 0.00 0.00 42.46 40.94 2dnf s ILE 34 CO 0.08 0.43 1.18 -2.16 0.00 0.00 0.00 174.94 174.47 2dnf s PRO 35 N 0.89 3.94 0.61 2.79 0.04 -1.26 -1.77 135.00 140.23 2dnf s PRO 35 Ca -0.09 1.85 0.28 0.00 0.04 0.00 0.00 61.00 63.08 2dnf s PRO 35 Cb -0.15 -2.59 1.47 0.00 0.04 0.00 0.00 34.50 33.27 2dnf s PRO 35 CO 0.00 -0.42 1.87 -0.09 0.04 0.00 0.00 177.00 178.40 2dnf h ARG 36 N 2.43 0.00 0.00 4.56 9.65 -1.93 0.68 114.38 129.77 2dnf h ARG 36 Ca -0.49 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.27 2dnf h ARG 36 Cb 1.24 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.80 2dnf h ARG 36 CO 0.62 0.00 -0.56 -0.22 2.80 0.00 0.00 179.97 182.60 2dnf h LYS 37 N 0.00 0.00 0.00 0.20 3.64 -1.93 -3.19 116.57 115.29 2dnf h LYS 37 Ca 0.17 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 2dnf h LYS 37 Cb 1.13 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2dnf h LYS 37 CO -0.00 0.56 -1.94 2.41 -2.27 0.00 0.00 179.45 178.21 2dnf n THR 38 N -3.71 0.50 0.12 1.00 -1.04 0.20 -4.25 114.28 107.11 2dnf n THR 38 Ca -0.01 -0.61 0.05 0.00 -2.04 0.00 0.00 64.05 61.44 2dnf n THR 38 Cb 0.60 -0.21 0.49 0.00 -1.82 0.00 0.00 70.33 69.39 2dnf n THR 38 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2dnf h LEU 39 N 0.00 0.24 -0.46 -4.42 3.38 -0.60 -2.15 115.31 111.30 2dnf h LEU 39 Ca -0.14 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 2dnf h LEU 39 Cb 1.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2dnf h LEU 39 CO 0.01 0.23 -0.39 -0.55 0.09 0.00 0.00 178.44 177.83 2dnf h ASN 40 N 0.28 0.90 -3.48 -0.43 -0.00 -1.73 -3.37 115.58 107.75 2dnf h ASN 40 Ca 0.07 -0.41 -0.61 0.00 -0.00 0.00 0.00 56.30 55.35 2dnf h ASN 40 Cb 0.07 -0.25 -0.11 0.00 -0.00 0.00 0.00 38.32 38.02 2dnf h ASN 40 CO -0.01 1.18 0.18 -1.10 -0.00 0.00 0.00 177.43 177.69 2dnf s GLN 41 N -4.36 4.06 0.33 4.14 -1.52 -0.81 -4.83 119.66 116.67 2dnf s GLN 41 Ca -0.10 0.51 0.17 0.00 -1.95 0.00 0.00 55.36 53.99 2dnf s GLN 41 Cb 0.11 -3.67 0.46 0.00 -0.22 0.00 0.00 33.01 29.70 2dnf s GLN 41 CO 0.87 -0.47 1.63 2.35 -0.25 0.00 0.00 175.29 179.42 2dnf h TRP 42 N 7.96 0.00 -0.04 0.91 -0.00 -1.81 -3.08 115.95 119.89 2dnf h TRP 42 Ca -0.26 0.00 -0.15 0.00 -0.00 0.00 0.00 58.89 58.47 2dnf h TRP 42 Cb 1.12 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.27 2dnf h TRP 42 CO 0.76 0.45 -0.66 -0.44 -0.00 0.00 0.00 178.44 178.54 2dnf h ASP 43 N 0.00 0.20 0.53 2.65 5.19 -1.91 -2.50 116.42 120.57 2dnf h ASP 43 Ca -0.00 -0.12 -0.13 0.00 -0.62 0.00 0.00 57.03 56.16 2dnf h ASP 43 Cb 1.08 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.51 2dnf h ASP 43 CO 0.06 0.80 -0.58 0.45 -3.12 0.00 0.00 179.24 176.85 2dnf h HIS 44 N 0.12 0.07 -0.00 4.55 3.86 -1.82 -2.75 115.15 119.17 2dnf h HIS 44 Ca -0.01 -0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.05 2dnf h HIS 44 Cb 1.18 -0.01 0.01 0.00 1.06 0.00 0.00 27.41 29.65 2dnf h HIS 44 CO 0.02 0.63 -0.49 0.28 0.86 0.00 0.00 177.93 179.23 2dnf h VAL 45 N 0.04 1.46 0.00 2.45 2.07 -1.49 -2.41 116.25 118.37 2dnf h VAL 45 Ca -0.01 -2.03 0.00 0.00 0.82 0.00 0.00 66.70 65.49 2dnf h VAL 45 Cb 1.04 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.45 2dnf h VAL 45 CO 0.08 0.58 0.00 -0.07 0.02 0.00 0.00 177.57 178.18 2dnf h LEU 46 N -0.22 0.00 0.01 2.57 4.07 -1.46 0.40 115.31 120.68 2dnf h LEU 46 Ca -0.06 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.60 2dnf h LEU 46 Cb 1.21 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.90 2dnf h LEU 46 CO 0.10 0.00 -1.78 1.67 -1.08 0.00 0.00 178.44 177.35 2dnf n GLN 47 N -2.69 0.64 0.04 1.13 -0.06 -1.04 -3.81 117.38 111.59 2dnf n GLN 47 Ca -0.00 0.27 -0.00 0.00 -2.00 0.00 0.00 57.00 55.27 2dnf n GLN 47 Cb 0.16 -1.77 -0.08 0.00 -4.06 0.00 0.00 30.24 24.50 2dnf n GLN 47 CO 0.00 0.00 0.00 0.52 -0.20 0.00 0.00 177.06 177.38 2dnf h MET 48 N 0.00 0.00 -0.14 3.69 2.86 -0.85 -3.35 114.93 117.14 2dnf h MET 48 Ca -0.31 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.21 2dnf h MET 48 Cb 2.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.68 2dnf h MET 48 CO 0.08 0.32 -0.40 -0.24 1.06 0.00 0.00 176.91 177.72 2dnf h VAL 49 N 0.00 1.31 -0.51 -2.22 3.04 -0.38 -3.09 116.25 114.40 2dnf h VAL 49 Ca -0.15 -1.52 -0.04 0.00 -1.01 0.00 0.00 66.70 63.98 2dnf h VAL 49 Cb 1.59 1.64 -0.02 0.00 -2.01 0.00 0.00 31.29 32.49 2dnf h VAL 49 CO 0.05 0.46 0.16 0.74 -1.01 0.00 0.00 177.57 177.97 2dnf h THR 50 N 0.27 1.23 -1.06 3.17 2.02 -1.69 0.10 112.91 116.95 2dnf h THR 50 Ca 0.03 -0.77 0.29 0.00 0.77 0.00 0.00 66.41 66.73 2dnf h THR 50 Cb 0.83 0.77 -0.06 0.00 -1.74 0.00 0.00 68.15 67.95 2dnf h THR 50 CO 0.07 0.28 0.73 -0.33 0.37 0.00 0.00 175.52 176.64 2dnf h GLU 51 N 0.69 0.15 0.05 6.66 5.08 -1.68 -1.72 114.58 123.81 2dnf h GLU 51 Ca 0.16 -0.01 -0.34 0.00 -1.00 0.00 0.00 59.36 58.17 2dnf h GLU 51 Cb 0.27 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 2dnf h GLU 51 CO -0.01 0.10 -1.91 1.63 -1.00 0.00 0.00 179.01 177.82 2dnf n LYS 52 N -4.37 0.66 -3.68 2.33 4.76 -0.97 -4.78 118.16 112.11 2dnf n LYS 52 Ca 0.24 0.35 -0.38 0.00 -2.87 0.00 0.00 58.31 55.64 2dnf n LYS 52 Cb 1.03 -1.66 -0.10 0.00 -1.84 0.00 0.00 35.03 32.45 2dnf n LYS 52 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2dnf s ILE 53 N -2.48 3.72 -0.59 -0.18 -1.09 0.32 -5.04 121.20 115.87 2dnf s ILE 53 Ca -0.29 -1.86 -0.20 0.00 -2.23 0.00 0.00 60.65 56.08 2dnf s ILE 53 Cb 0.08 -3.47 0.09 0.00 -1.58 0.00 0.00 42.46 37.58 2dnf s ILE 53 CO 0.65 -0.68 0.73 -0.89 -1.23 0.00 0.00 174.94 173.52 2dnf s THR 54 N 1.26 4.75 0.24 2.92 2.01 -1.18 -4.27 115.64 121.37 2dnf s THR 54 Ca 0.06 -0.79 -0.30 0.00 0.31 0.00 0.00 61.69 60.97 2dnf s THR 54 Cb -0.24 -4.49 -0.09 0.00 0.01 0.00 0.00 72.50 67.69 2dnf s THR 54 CO -0.02 -1.12 1.28 -0.76 -0.69 0.00 0.00 174.62 173.31 2dnf s LEU 55 N 2.90 4.44 0.55 4.42 1.43 -0.76 -4.89 118.68 126.78 2dnf s LEU 55 Ca 0.14 2.45 0.27 0.00 -1.03 0.00 0.00 54.13 55.95 2dnf s LEU 55 Cb -0.22 -3.62 1.47 0.00 0.03 0.00 0.00 46.19 43.84 2dnf s LEU 55 CO 0.08 -0.48 2.00 -0.09 0.23 0.00 0.00 176.35 178.10 2dnf h ARG 56 N 4.69 0.00 0.00 1.70 2.43 -1.96 0.22 114.38 121.47 2dnf h ARG 56 Ca -0.46 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 58.56 2dnf h ARG 56 Cb 1.22 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2dnf h ARG 56 CO 0.73 0.00 -0.84 0.66 -1.51 0.00 0.00 179.97 179.01 2dnf h SER 57 N 0.00 0.00 0.00 -3.80 4.64 -2.01 -3.50 113.55 108.89 2dnf h SER 57 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2dnf h SER 57 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2dnf h SER 57 CO -0.00 0.68 0.00 0.61 -0.87 0.00 0.00 176.83 177.24 2dnf n GLY 58 N 1.30 -0.24 3.49 -0.77 0.00 0.77 -5.06 105.19 104.68 2dnf n GLY 58 Ca -0.01 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 2dnf n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dnf n ALA 59 N -0.26 0.31 -2.26 4.61 0.00 -1.26 -1.82 120.51 119.83 2dnf n ALA 59 Ca 0.00 -1.78 -0.36 0.00 0.00 0.00 0.00 53.44 51.30 2dnf n ALA 59 Cb 0.00 0.32 -0.06 0.00 0.00 0.00 0.00 19.45 19.71 2dnf n ALA 59 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2dnf s VAL 60 N -2.67 4.74 0.00 0.00 1.01 -1.26 -4.44 120.40 117.78 2dnf s VAL 60 Ca 0.59 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.63 2dnf s VAL 60 Cb -0.04 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2dnf s VAL 60 CO 0.39 0.31 0.00 1.41 0.00 0.00 0.00 175.10 177.21 2dnf n HIS 61 N 1.01 0.00 -3.60 5.22 8.25 -0.96 -4.85 115.22 120.28 2dnf n HIS 61 Ca -0.06 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.29 2dnf n HIS 61 Cb 0.51 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.57 2dnf n HIS 61 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dnf s ARG 62 N -1.65 1.05 0.21 -0.41 0.52 0.22 -5.02 118.95 113.87 2dnf s ARG 62 Ca 0.00 -0.51 0.08 0.00 -0.52 0.00 0.00 55.73 54.79 2dnf s ARG 62 Cb 0.00 0.47 -0.04 0.00 0.52 0.00 0.00 34.95 35.90 2dnf s ARG 62 CO 0.00 -0.40 0.00 -0.51 0.02 0.00 0.00 175.30 174.41 2dnf s LEU 63 N -2.45 3.27 -0.17 2.53 2.01 -1.26 -0.57 118.68 122.03 2dnf s LEU 63 Ca -0.01 -0.50 -0.09 0.00 0.01 0.00 0.00 54.13 53.55 2dnf s LEU 63 Cb 0.00 -1.87 0.06 0.00 0.01 0.00 0.00 46.19 44.40 2dnf s LEU 63 CO -0.08 0.05 0.41 -0.31 1.01 0.00 0.00 176.35 177.44 2dnf s TYR 64 N -1.97 -0.62 1.07 0.29 1.51 0.19 -3.18 117.35 114.65 2dnf s TYR 64 Ca 0.29 1.31 -0.18 0.00 -1.01 0.00 0.00 57.07 57.48 2dnf s TYR 64 Cb -0.08 0.27 0.26 0.00 -0.11 0.00 0.00 41.96 42.30 2dnf s TYR 64 CO 0.19 -0.36 1.12 0.25 -1.11 0.00 0.00 175.55 175.64 2dnf n THR 65 N 4.36 0.00 0.50 -0.71 -2.24 -0.63 0.49 114.28 116.05 2dnf n THR 65 Ca -0.22 -0.63 0.13 0.00 -2.27 0.00 0.00 64.05 61.06 2dnf n THR 65 Cb 0.55 -1.34 0.43 0.00 -2.10 0.00 0.00 70.33 67.86 2dnf n THR 65 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2dnf h LEU 66 N 0.00 0.00 0.00 3.22 3.38 -1.91 -2.91 115.31 117.09 2dnf h LEU 66 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2dnf h LEU 66 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dnf h LEU 66 CO 0.27 0.00 -0.62 -1.84 0.09 0.00 0.00 178.44 176.33 2dnf n GLU 67 N -2.38 0.19 0.00 1.13 0.28 -1.26 -4.85 120.64 113.74 2dnf n GLU 67 Ca 0.04 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 2dnf n GLU 67 Cb 0.37 -1.61 0.00 0.00 1.43 0.00 0.00 31.44 31.63 2dnf n GLU 67 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dnf n GLY 68 N 1.40 1.02 3.84 -1.84 0.00 -1.10 -5.09 105.19 103.41 2dnf n GLY 68 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2dnf n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dnf s LYS 69 N -0.88 3.41 -0.17 1.61 2.20 -1.26 -4.81 119.74 119.84 2dnf s LYS 69 Ca 0.00 0.94 -0.01 0.00 -0.36 0.00 0.00 55.97 56.54 2dnf s LYS 69 Cb 0.00 -2.05 -0.01 0.00 -1.51 0.00 0.00 37.83 34.26 2dnf s LYS 69 CO 0.00 -0.72 -0.12 -1.17 -0.36 0.00 0.00 175.35 172.98 2dnf s LEU 70 N -4.94 2.66 -0.92 5.43 2.96 -1.26 -1.61 118.68 121.01 2dnf s LEU 70 Ca 0.58 -0.41 -0.13 0.00 -0.22 0.00 0.00 54.13 53.95 2dnf s LEU 70 Cb -0.13 -1.63 0.23 0.00 0.50 0.00 0.00 46.19 45.17 2dnf s LEU 70 CO 0.46 0.07 0.89 -0.69 -1.32 0.00 0.00 176.35 175.77 2dnf s VAL 71 N 0.89 5.67 -1.51 1.68 1.01 -1.19 -4.85 120.40 122.10 2dnf s VAL 71 Ca -0.03 -2.69 0.11 0.00 0.00 0.00 0.00 61.98 59.37 2dnf s VAL 71 Cb -0.15 -4.53 0.21 0.00 0.00 0.00 0.00 36.38 31.91 2dnf s VAL 71 CO -0.00 -1.10 1.24 -0.62 0.00 0.00 0.00 175.10 174.61 2dnf n GLU 72 N 3.77 0.19 -3.55 2.72 1.02 -1.26 -4.45 120.64 119.07 2dnf n GLU 72 Ca 0.17 0.16 -0.13 0.00 -0.02 0.00 0.00 57.16 57.34 2dnf n GLU 72 Cb 0.45 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.32 2dnf n GLU 72 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2dnf s SER 73 N -2.49 -0.47 0.02 1.62 0.15 -1.26 -4.94 113.70 106.33 2dnf s SER 73 Ca 0.11 0.49 0.01 0.00 0.70 0.00 0.00 55.95 57.26 2dnf s SER 73 Cb 0.08 0.39 0.06 0.00 -1.71 0.00 0.00 66.02 64.84 2dnf s SER 73 CO 0.16 -0.45 0.99 0.61 1.20 0.00 0.00 173.24 175.75 2dnf n GLY 74 N 0.73 -0.47 0.34 9.45 0.00 -1.26 -1.78 105.19 112.20 2dnf n GLY 74 Ca -0.13 0.01 0.21 0.00 0.00 0.00 0.00 46.02 46.11 2dnf n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dnf h ALA 75 N 1.80 1.12 0.00 4.61 0.00 -1.94 0.34 119.26 125.18 2dnf h ALA 75 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dnf h ALA 75 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2dnf h ALA 75 CO 0.00 -0.06 -1.67 0.39 0.00 0.00 0.00 179.25 177.92 2dnf n GLU 76 N -3.15 0.50 -0.59 0.00 1.02 -0.74 -4.98 120.64 112.71 2dnf n GLU 76 Ca -0.03 -0.13 -0.30 0.00 -0.02 0.00 0.00 57.16 56.69 2dnf n GLU 76 Cb 0.12 -1.54 0.21 0.00 -0.02 0.00 0.00 31.44 30.21 2dnf n GLU 76 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2dnf n LEU 77 N -2.12 -0.01 -4.07 -4.62 4.77 0.11 -5.05 117.00 106.00 2dnf n LEU 77 Ca -0.02 0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 55.94 2dnf n LEU 77 Cb 0.51 -1.28 -0.09 0.00 -2.33 0.00 0.00 43.42 40.23 2dnf n LEU 77 CO 0.45 -2.96 -0.27 -0.70 -1.33 0.00 0.00 177.39 172.57 2dnf s GLU 78 N -4.28 0.81 -0.29 3.23 2.56 -1.26 -5.07 118.70 114.40 2dnf s GLU 78 Ca 0.65 -1.27 -0.18 0.00 0.00 0.00 0.00 54.97 54.18 2dnf s GLU 78 Cb -0.23 0.25 -0.02 0.00 2.00 0.00 0.00 34.13 36.13 2dnf s GLU 78 CO 0.63 -0.22 0.50 0.54 -0.56 0.00 0.00 175.26 176.15 2dnf s ASN 79 N -2.97 6.37 0.00 -1.70 2.20 -1.26 -3.91 114.94 113.67 2dnf s ASN 79 Ca 0.14 0.33 0.00 0.00 -0.94 0.00 0.00 52.86 52.39 2dnf s ASN 79 Cb 0.07 -2.27 0.00 0.00 -2.00 0.00 0.00 41.25 37.05 2dnf s ASN 79 CO -0.05 -0.33 0.00 0.61 -2.94 0.00 0.00 177.10 174.39 2dnf n GLY 80 N 4.55 0.75 3.76 0.45 0.00 -0.42 -4.97 105.19 109.31 2dnf n GLY 80 Ca -0.05 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 2dnf n GLY 80 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dnf n GLN 81 N -2.45 0.66 -4.38 1.61 1.13 -1.25 -4.93 117.38 107.76 2dnf n GLN 81 Ca 0.00 -3.22 -0.27 0.00 -1.94 0.00 0.00 57.00 51.57 2dnf n GLN 81 Cb 0.00 0.10 -0.13 0.00 0.11 0.00 0.00 30.24 30.32 2dnf n GLN 81 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2dnf s PHE 82 N -2.60 2.21 -0.15 1.08 0.40 -1.26 -0.95 117.98 116.70 2dnf s PHE 82 Ca 0.43 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 56.29 2dnf s PHE 82 Cb -0.03 -1.17 0.05 0.00 0.51 0.00 0.00 43.02 42.38 2dnf s PHE 82 CO 0.27 0.36 0.37 0.71 0.70 0.00 0.00 175.22 177.63 2dnf s TYR 83 N -1.26 -0.53 0.04 0.36 1.51 0.43 -4.58 117.35 113.33 2dnf s TYR 83 Ca 0.14 1.15 -0.24 0.00 -1.01 0.00 0.00 57.07 57.11 2dnf s TYR 83 Cb -0.09 0.21 -0.06 0.00 -0.11 0.00 0.00 41.96 41.91 2dnf s TYR 83 CO 0.07 -0.31 0.74 0.08 -1.11 0.00 0.00 175.55 175.02 2dnf s VAL 84 N 1.28 4.74 -0.28 0.71 1.01 0.18 -2.25 120.40 125.79 2dnf s VAL 84 Ca -0.09 1.58 -0.20 0.00 0.00 0.00 0.00 61.98 63.27 2dnf s VAL 84 Cb -0.08 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 2dnf s VAL 84 CO -0.11 0.38 0.59 0.00 0.00 0.00 0.00 175.10 175.96 2dnf s ALA 85 N -0.12 3.56 -0.12 5.51 0.00 0.17 -0.63 121.76 130.12 2dnf s ALA 85 Ca 0.37 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.74 2dnf s ALA 85 Cb -0.20 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.88 2dnf s ALA 85 CO 0.22 -0.93 -0.15 0.08 0.00 0.00 0.00 175.76 174.98 2dnf s VAL 86 N 2.50 2.88 0.00 0.00 1.01 0.26 -2.49 120.40 124.56 2dnf s VAL 86 Ca 0.24 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2dnf s VAL 86 Cb -0.15 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.04 2dnf s VAL 86 CO 0.10 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.35 2dnf n GLY 87 N 3.46 0.76 2.60 4.51 0.00 -1.26 -0.61 105.19 114.65 2dnf n GLY 87 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 2dnf n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnf n ARG 88 N 0.00 2.66 -3.73 1.61 1.74 -1.26 -4.27 116.66 113.40 2dnf n ARG 88 Ca 0.00 -3.25 -0.12 0.00 -0.77 0.00 0.00 57.85 53.70 2dnf n ARG 88 Cb 0.00 -2.24 -0.11 0.00 -1.02 0.00 0.00 32.46 29.09 2dnf n ARG 88 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dnf s ASP 89 N -1.24 -0.40 0.52 0.55 1.11 -1.26 -5.14 116.67 110.81 2dnf s ASP 89 Ca 0.57 0.75 -0.14 0.00 0.18 0.00 0.00 52.55 53.91 2dnf s ASP 89 Cb 0.46 0.72 -0.12 0.00 1.07 0.00 0.00 42.92 45.05 2dnf s ASP 89 CO -0.22 -0.15 -0.26 2.29 1.18 0.00 0.00 175.17 178.02 2dnf n LYS 90 N 3.32 0.00 -2.69 8.23 0.00 -1.26 -4.81 118.16 120.95 2dnf n LYS 90 Ca -0.17 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.72 2dnf n LYS 90 Cb 0.57 -0.81 -0.02 0.00 -0.00 0.00 0.00 35.03 34.76 2dnf n LYS 90 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 2dnf s PHE 91 N -1.62 3.41 -1.14 5.58 5.36 -1.26 -4.96 117.98 123.35 2dnf s PHE 91 Ca 0.42 1.50 -0.21 0.00 -0.96 0.00 0.00 56.93 57.68 2dnf s PHE 91 Cb -0.33 -3.22 0.05 0.00 -0.34 0.00 0.00 43.02 39.18 2dnf s PHE 91 CO 0.57 -0.36 1.59 0.15 -1.46 0.00 0.00 175.22 175.71 2dnf s LYS 92 N 2.67 3.70 -0.63 10.12 1.02 -1.26 -4.93 119.74 130.43 2dnf s LYS 92 Ca 0.45 -1.46 -0.34 0.00 0.02 0.00 0.00 55.97 54.64 2dnf s LYS 92 Cb -0.16 -5.42 -0.16 0.00 -0.52 0.00 0.00 37.83 31.57 2dnf s LYS 92 CO 0.11 -2.30 2.39 1.17 -0.92 0.00 0.00 175.35 175.81 2dnf n LYS 93 N 8.67 0.49 -3.93 1.68 0.00 -1.26 -4.73 118.16 119.09 2dnf n LYS 93 Ca 0.40 0.08 -0.10 0.00 0.00 0.00 0.00 58.31 58.70 2dnf n LYS 93 Cb 0.49 -2.11 -0.10 0.00 0.00 0.00 0.00 35.03 33.31 2dnf n LYS 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2dnf s LEU 94 N 8.48 1.86 -0.42 3.14 1.43 -1.26 -5.11 118.68 126.80 2dnf s LEU 94 Ca 1.19 -0.49 -0.28 0.00 -1.03 0.00 0.00 54.13 53.52 2dnf s LEU 94 Cb -1.00 0.52 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 2dnf s LEU 94 CO 0.48 -0.45 1.75 -2.16 0.23 0.00 0.00 176.35 176.20 2dnf s PRO 95 N -2.26 3.17 -0.15 1.29 0.04 -1.26 -4.80 135.00 131.02 2dnf s PRO 95 Ca -0.08 1.11 0.10 0.00 0.04 0.00 0.00 61.00 62.17 2dnf s PRO 95 Cb -0.03 -4.22 -0.17 0.00 0.04 0.00 0.00 34.50 30.12 2dnf s PRO 95 CO -0.03 -2.06 0.00 0.66 0.04 0.00 0.00 177.00 175.61 2dnf n TYR 96 N 10.74 0.00 0.07 0.56 4.01 -1.26 -4.40 117.16 126.87 2dnf n TYR 96 Ca 0.21 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.99 2dnf n TYR 96 Cb 0.48 -0.71 0.21 0.00 -0.31 0.00 0.00 39.34 39.01 2dnf n TYR 96 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dnf n GLY 97 N 2.22 -0.64 0.09 2.72 0.00 -1.26 -1.13 105.19 107.19 2dnf n GLY 97 Ca -0.26 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 2dnf n GLY 97 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dnf h GLU 98 N 0.00 0.05 0.00 1.61 4.39 -1.86 -3.33 114.58 115.45 2dnf h GLU 98 Ca 0.00 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 2dnf h GLU 98 Cb 0.01 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2dnf h GLU 98 CO 0.00 0.70 -0.02 -0.07 -1.16 0.00 0.00 179.01 178.47 2dnf h LEU 99 N 0.01 0.00 0.16 1.33 3.38 -1.36 -3.30 115.31 115.53 2dnf h LEU 99 Ca -0.26 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2dnf h LEU 99 Cb 1.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.73 2dnf h LEU 99 CO 0.10 0.02 -0.07 -0.07 0.09 0.00 0.00 178.44 178.50 2dnf h LEU 100 N 0.00 -0.18 -7.86 1.67 3.38 -1.64 -3.45 115.31 107.23 2dnf h LEU 100 Ca -0.00 0.01 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 2dnf h LEU 100 Cb 0.59 0.05 -0.37 0.00 0.09 0.00 0.00 40.66 41.01 2dnf h LEU 100 CO 0.00 0.01 -0.81 -0.36 0.09 0.00 0.00 178.44 177.37 2dnf s PHE 101 N -2.32 2.94 1.11 1.13 0.08 -1.24 -5.08 117.98 114.59 2dnf s PHE 101 Ca -0.03 -2.02 -0.14 0.00 0.12 0.00 0.00 56.93 54.86 2dnf s PHE 101 Cb 0.00 -1.84 0.21 0.00 -0.57 0.00 0.00 43.02 40.82 2dnf s PHE 101 CO 0.09 -0.83 0.75 -3.47 -0.10 0.00 0.00 175.22 171.66 2dnf n ASP 102 N 4.53 -1.63 -3.88 1.36 2.03 -1.25 -4.77 116.55 112.94 2dnf n ASP 102 Ca -0.15 -0.03 -0.19 0.00 0.52 0.00 0.00 54.79 54.94 2dnf n ASP 102 Cb 0.44 -1.22 -0.16 0.00 -0.72 0.00 0.00 41.12 39.47 2dnf n ASP 102 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2dnf s SER 103 N -2.27 0.74 0.00 1.67 0.15 -1.26 -5.11 113.70 107.62 2dnf s SER 103 Ca 0.65 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.20 2dnf s SER 103 Cb -0.22 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.76 2dnf s SER 103 CO 0.65 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.65 2dnf n GLY 104 N 3.89 -1.01 3.57 9.45 0.00 -1.26 -3.90 105.19 115.94 2dnf n GLY 104 Ca -0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 2dnf n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnf s PRO 105 N 0.00 2.52 -0.29 1.61 0.04 -1.26 -4.80 135.00 132.81 2dnf s PRO 105 Ca 0.00 -0.88 -0.16 0.00 0.04 0.00 0.00 61.00 60.00 2dnf s PRO 105 Cb 0.00 -5.18 0.17 0.00 0.04 0.00 0.00 34.50 29.52 2dnf s PRO 105 CO 0.00 -3.78 1.06 0.45 0.04 0.00 0.00 177.00 174.77 2dnf s SER 106 N 6.99 -0.39 -0.06 6.66 0.15 -1.25 -5.16 113.70 120.64 2dnf s SER 106 Ca 0.69 0.61 0.02 0.00 0.70 0.00 0.00 55.95 57.96 2dnf s SER 106 Cb -0.03 1.24 0.02 0.00 -1.71 0.00 0.00 66.02 65.54 2dnf s SER 106 CO 0.09 -0.09 -0.09 -0.55 1.20 0.00 0.00 173.24 173.79 2dnf s SER 107 N 1.51 1.48 0.00 5.45 0.15 -1.26 -4.91 113.70 116.12 2dnf s SER 107 Ca -0.07 -0.23 0.25 0.00 0.70 0.00 0.00 55.95 56.60 2dnf s SER 107 Cb -0.04 -0.68 0.44 0.00 -1.71 0.00 0.00 66.02 64.04 2dnf s SER 107 CO -0.14 -0.01 1.40 0.61 1.20 0.00 0.00 173.24 176.30