#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eec s GLN 2 N 0.00 0.76 0.35 2.12 0.74 -1.26 -3.59 119.66 118.78 3eec s GLN 2 Ca 0.00 0.32 0.07 0.00 0.05 0.00 0.00 55.36 55.79 3eec s GLN 2 Cb 0.00 0.36 -0.03 0.00 1.10 0.00 0.00 33.01 34.44 3eec s GLN 2 CO 0.00 -0.18 0.25 0.96 -0.55 0.00 0.00 175.29 175.77 3eec s ILE 3 N -0.64 0.10 0.07 -2.34 -4.36 -0.53 0.52 121.20 114.03 3eec s ILE 3 Ca -0.07 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.40 3eec s ILE 3 Cb -0.03 -2.46 -0.03 0.00 1.25 0.00 0.00 42.46 41.19 3eec s ILE 3 CO 0.05 0.00 -0.21 -0.36 0.24 0.00 0.00 174.94 174.65 3eec s PHE 4 N -3.39 1.87 0.15 1.37 0.40 0.46 -0.83 117.98 118.02 3eec s PHE 4 Ca 0.37 -0.39 0.11 0.00 -0.60 0.00 0.00 56.93 56.42 3eec s PHE 4 Cb 0.02 -1.08 -0.04 0.00 0.51 0.00 0.00 43.02 42.43 3eec s PHE 4 CO 0.25 0.14 -0.24 0.08 0.70 0.00 0.00 175.22 176.15 3eec s VAL 5 N -0.93 2.20 0.03 -0.44 1.01 0.68 -0.62 120.40 122.33 3eec s VAL 5 Ca 0.08 -1.86 0.05 0.00 0.00 0.00 0.00 61.98 60.26 3eec s VAL 5 Cb -0.09 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 3eec s VAL 5 CO 0.03 -0.04 -0.16 -0.54 0.00 0.00 0.00 175.10 174.39 3eec s LYS 6 N -2.34 1.07 -0.05 2.72 1.02 0.50 -2.00 119.74 120.66 3eec s LYS 6 Ca 0.16 -0.77 0.05 0.00 0.02 0.00 0.00 55.97 55.43 3eec s LYS 6 Cb -0.09 -1.10 -0.02 0.00 -0.52 0.00 0.00 37.83 36.10 3eec s LYS 6 CO 0.07 0.28 -0.20 0.99 -0.92 0.00 0.00 175.35 175.57 3eec s THR 7 N -0.77 2.52 0.40 2.17 2.01 -0.07 0.32 115.64 122.22 3eec s THR 7 Ca 0.04 -0.91 0.18 0.00 0.31 0.00 0.00 61.69 61.30 3eec s THR 7 Cb -0.08 -1.95 0.39 0.00 0.01 0.00 0.00 72.50 70.87 3eec s THR 7 CO 0.01 0.58 1.79 -0.07 -0.69 0.00 0.00 174.62 176.24 3eec h LEU 8 N 5.71 0.44 -0.15 4.42 3.38 -1.87 0.92 115.31 128.16 3eec h LEU 8 Ca -0.39 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3eec h LEU 8 Cb 1.16 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3eec h LEU 8 CO 0.49 0.11 0.00 0.35 0.09 0.00 0.00 178.44 179.48 3eec n THR 9 N -4.59 0.00 0.00 0.22 -2.24 -1.26 -4.76 114.28 101.65 3eec n THR 9 Ca 0.24 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 3eec n THR 9 Cb 0.83 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 3eec n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3eec n GLY 10 N -0.31 1.92 1.14 3.38 0.00 0.32 -4.95 105.19 106.69 3eec n GLY 10 Ca 0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 46.02 45.61 3eec n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3eec n LYS 11 N 0.00 0.00 -3.70 1.61 4.81 -1.23 -4.33 118.16 115.32 3eec n LYS 11 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.06 3eec n LYS 11 Cb 0.00 -0.51 -0.12 0.00 0.02 0.00 0.00 35.03 34.42 3eec n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3eec s THR 12 N 2.49 4.26 0.25 3.15 2.01 -1.26 -0.89 115.64 125.65 3eec s THR 12 Ca 0.43 -0.66 0.08 0.00 0.31 0.00 0.00 61.69 61.84 3eec s THR 12 Cb -0.47 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 3eec s THR 12 CO 0.20 0.01 0.12 0.27 -0.69 0.00 0.00 174.62 174.52 3eec s ILE 13 N 1.54 4.09 0.51 1.82 -4.36 -0.85 -4.95 121.20 118.99 3eec s ILE 13 Ca 0.03 -1.56 0.08 0.00 -0.26 0.00 0.00 60.65 58.94 3eec s ILE 13 Cb -0.18 -3.19 0.04 0.00 1.25 0.00 0.00 42.46 40.38 3eec s ILE 13 CO 0.04 -0.34 0.54 0.42 0.24 0.00 0.00 174.94 175.85 3eec s THR 14 N -2.16 2.22 0.09 8.37 -4.23 -1.26 -0.23 115.64 118.43 3eec s THR 14 Ca 0.32 -1.24 -0.16 0.00 -1.18 0.00 0.00 61.69 59.43 3eec s THR 14 Cb -0.08 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.34 3eec s THR 14 CO 0.23 0.00 0.38 -0.22 -0.54 0.00 0.00 174.62 174.47 3eec s LEU 15 N -4.37 0.50 -0.10 4.79 2.96 -0.01 -4.84 118.68 117.62 3eec s LEU 15 Ca 0.49 -0.22 -0.03 0.00 -0.22 0.00 0.00 54.13 54.15 3eec s LEU 15 Cb -0.04 1.72 -0.03 0.00 0.50 0.00 0.00 46.19 48.33 3eec s LEU 15 CO 0.30 -0.76 0.02 -0.70 -1.32 0.00 0.00 176.35 173.89 3eec s GLU 16 N -3.26 3.15 0.20 1.98 2.56 -1.26 -1.45 118.70 120.63 3eec s GLU 16 Ca -0.00 -0.38 -0.09 0.00 0.00 0.00 0.00 54.97 54.50 3eec s GLU 16 Cb 0.01 -2.88 -0.01 0.00 2.00 0.00 0.00 34.13 33.25 3eec s GLU 16 CO -0.08 0.65 0.34 0.14 -0.56 0.00 0.00 175.26 175.75 3eec s VAL 17 N -0.73 0.03 0.05 3.70 -7.23 -1.24 -4.98 120.40 110.00 3eec s VAL 17 Ca 0.12 -1.50 0.06 0.00 -1.81 0.00 0.00 61.98 58.85 3eec s VAL 17 Cb -0.12 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 3eec s VAL 17 CO 0.02 -0.12 -0.14 -1.61 -0.31 0.00 0.00 175.10 172.94 3eec s GLU 18 N -4.02 2.17 0.32 4.82 2.02 -1.26 -3.14 118.70 119.61 3eec s GLU 18 Ca 0.23 -0.94 0.09 0.00 0.02 0.00 0.00 54.97 54.37 3eec s GLU 18 Cb 0.02 -2.27 0.92 0.00 0.10 0.00 0.00 34.13 32.90 3eec s GLU 18 CO 0.06 0.55 1.64 -1.35 0.02 0.00 0.00 175.26 176.17 3eec h PRO 19 N 4.35 0.21 -0.49 0.39 0.11 -1.99 0.36 132.00 134.94 3eec h PRO 19 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3eec h PRO 19 Cb 1.16 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3eec h PRO 19 CO 0.50 0.14 0.00 0.43 -0.21 0.00 0.00 178.00 178.85 3eec n SER 20 N -5.19 2.60 -4.77 -2.05 7.64 -1.26 -2.18 113.62 108.42 3eec n SER 20 Ca 0.27 -2.01 -0.41 0.00 1.01 0.00 0.00 58.87 57.73 3eec n SER 20 Cb 0.87 -0.33 -0.01 0.00 -1.01 0.00 0.00 64.21 63.73 3eec n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3eec s ASP 21 N -1.00 6.44 0.64 6.43 1.01 0.11 -4.69 116.67 125.61 3eec s ASP 21 Ca 0.32 2.94 -0.08 0.00 0.71 0.00 0.00 52.55 56.45 3eec s ASP 21 Cb 0.17 -2.65 0.02 0.00 1.01 0.00 0.00 42.92 41.46 3eec s ASP 21 CO 0.22 -0.82 0.97 0.42 0.21 0.00 0.00 175.17 176.17 3eec s THR 22 N -0.75 3.48 0.32 -1.27 -4.23 -1.26 -1.06 115.64 110.87 3eec s THR 22 Ca 0.55 0.12 0.18 0.00 -1.18 0.00 0.00 61.69 61.36 3eec s THR 22 Cb -0.45 -3.42 0.14 0.00 1.34 0.00 0.00 72.50 70.11 3eec s THR 22 CO 0.56 -0.47 1.85 0.40 -0.54 0.00 0.00 174.62 176.42 3eec h ILE 23 N -0.36 1.01 -0.11 2.99 1.08 -1.30 0.43 117.51 121.25 3eec h ILE 23 Ca -0.45 -1.21 -0.09 0.00 -0.39 0.00 0.00 64.86 62.71 3eec h ILE 23 Cb 1.26 1.70 -0.01 0.00 -3.07 0.00 0.00 36.82 36.69 3eec h ILE 23 CO 0.62 0.32 -0.36 -0.08 -0.69 0.00 0.00 178.15 177.96 3eec h GLU 24 N 0.00 0.22 -0.02 2.37 4.57 -1.74 0.31 114.58 120.29 3eec h GLU 24 Ca -0.00 -0.09 -0.20 0.00 -1.18 0.00 0.00 59.36 57.88 3eec h GLU 24 Cb 0.67 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 3eec h GLU 24 CO 0.04 0.55 -0.86 -0.91 -1.18 0.00 0.00 179.01 176.66 3eec h ASN 25 N 0.19 0.39 -0.16 1.04 4.21 -1.41 -1.84 115.58 118.00 3eec h ASN 25 Ca 0.02 -0.30 -0.20 0.00 1.21 0.00 0.00 56.30 57.03 3eec h ASN 25 Cb 0.73 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.81 3eec h ASN 25 CO 0.06 1.08 -0.67 0.58 -1.29 0.00 0.00 177.43 177.19 3eec h VAL 26 N 0.18 1.29 -0.23 2.81 2.07 -0.61 -2.88 116.25 118.87 3eec h VAL 26 Ca -0.05 -1.87 -0.04 0.00 0.82 0.00 0.00 66.70 65.55 3eec h VAL 26 Cb 1.47 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 3eec h VAL 26 CO 0.14 0.60 -0.03 0.11 0.02 0.00 0.00 177.57 178.41 3eec h LYS 27 N 0.57 0.35 -0.18 1.57 1.57 -0.90 -1.67 116.57 117.88 3eec h LYS 27 Ca -0.02 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 3eec h LYS 27 Cb 1.28 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 3eec h LYS 27 CO 0.14 0.40 -0.33 0.00 -0.57 0.00 0.00 179.45 179.10 3eec h ALA 28 N 1.64 1.12 0.00 3.86 0.00 -1.16 0.68 119.26 125.39 3eec h ALA 28 Ca 0.08 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.45 3eec h ALA 28 Cb 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3eec h ALA 28 CO 0.01 0.56 -0.77 0.87 0.00 0.00 0.00 179.25 179.92 3eec h LYS 29 N 0.31 0.00 -0.15 0.00 1.57 -1.17 -1.89 116.57 115.24 3eec h LYS 29 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 3eec h LYS 29 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 3eec h LYS 29 CO 0.06 0.77 -0.29 0.82 -0.57 0.00 0.00 179.45 180.23 3eec h ILE 30 N 0.00 1.36 -0.77 1.86 2.04 -0.94 -2.18 117.51 118.88 3eec h ILE 30 Ca -0.01 -1.54 0.05 0.00 1.00 0.00 0.00 64.86 64.36 3eec h ILE 30 Cb 1.41 1.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.41 3eec h ILE 30 CO 0.10 0.46 0.50 -0.61 0.00 0.00 0.00 178.15 178.61 3eec h GLN 31 N 0.10 0.84 -0.49 2.37 4.15 -0.79 0.66 115.11 121.95 3eec h GLN 31 Ca 0.01 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 3eec h GLN 31 Cb 0.88 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.36 3eec h GLN 31 CO 0.07 0.56 0.21 -0.44 -1.93 0.00 0.00 178.83 177.30 3eec h ASP 32 N 0.87 0.66 0.13 -0.69 3.45 -1.19 0.30 116.42 119.94 3eec h ASP 32 Ca 0.32 -0.15 -0.25 0.00 0.43 0.00 0.00 57.03 57.38 3eec h ASP 32 Cb 0.16 -0.17 0.01 0.00 -0.56 0.00 0.00 39.33 38.77 3eec h ASP 32 CO -0.10 0.63 -1.20 0.11 -1.57 0.00 0.00 179.24 177.10 3eec h LYS 33 N 0.65 0.28 -0.03 3.56 1.57 -0.41 -3.37 116.57 118.82 3eec h LYS 33 Ca 0.17 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3eec h LYS 33 Cb 0.16 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3eec h LYS 33 CO -0.02 1.23 -0.01 0.39 -0.57 0.00 0.00 179.45 180.48 3eec n GLU 34 N -3.98 1.97 -1.26 3.15 -0.58 0.21 -4.96 120.64 115.19 3eec n GLU 34 Ca -0.20 -1.77 -0.11 0.00 -0.42 0.00 0.00 57.16 54.66 3eec n GLU 34 Cb 0.89 -1.41 -0.05 0.00 -0.57 0.00 0.00 31.44 30.30 3eec n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3eec n GLY 35 N 1.21 1.07 3.69 0.62 0.00 0.10 -4.92 105.19 106.97 3eec n GLY 35 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3eec n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3eec s ILE 36 N -1.89 5.04 0.22 -0.61 1.01 -1.26 -4.95 121.20 118.76 3eec s ILE 36 Ca 0.00 1.33 -0.32 0.00 0.00 0.00 0.00 60.65 61.66 3eec s ILE 36 Cb 0.00 -3.99 -0.14 0.00 0.01 0.00 0.00 42.46 38.33 3eec s ILE 36 CO 0.00 0.19 1.31 -2.65 0.00 0.00 0.00 174.94 173.79 3eec n PRO 37 N 4.34 1.71 0.30 2.79 -0.02 -1.26 -3.98 135.00 138.88 3eec n PRO 37 Ca -0.01 0.61 0.16 0.00 -2.02 0.00 0.00 63.50 62.24 3eec n PRO 37 Cb 0.51 -2.21 0.94 0.00 -0.02 0.00 0.00 33.50 32.72 3eec n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3eec h PRO 38 N 3.88 0.00 -0.00 0.52 0.11 -1.93 -0.05 132.00 134.52 3eec h PRO 38 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3eec h PRO 38 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3eec h PRO 38 CO 0.73 0.00 -0.17 -0.25 -0.21 0.00 0.00 178.00 178.10 3eec n ASP 39 N -3.77 0.45 -0.61 -2.05 8.00 -1.26 -2.73 116.55 114.58 3eec n ASP 39 Ca -0.03 -0.37 0.05 0.00 0.71 0.00 0.00 54.79 55.16 3eec n ASP 39 Cb 0.10 -0.07 0.15 0.00 -0.02 0.00 0.00 41.12 41.28 3eec n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3eec n GLN 40 N -1.11 2.88 -4.46 -1.24 6.02 -0.07 -4.79 117.38 114.61 3eec n GLN 40 Ca 0.11 -2.09 -0.34 0.00 -0.01 0.00 0.00 57.00 54.67 3eec n GLN 40 Cb 0.30 -1.31 -0.11 0.00 1.02 0.00 0.00 30.24 30.14 3eec n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3eec s GLN 41 N -1.22 3.30 -0.08 -1.09 -0.21 -0.99 -1.52 119.66 117.86 3eec s GLN 41 Ca 0.23 -0.50 -0.00 0.00 0.02 0.00 0.00 55.36 55.11 3eec s GLN 41 Cb 0.14 -2.81 0.02 0.00 1.00 0.00 0.00 33.01 31.36 3eec s GLN 41 CO 0.13 0.44 -0.04 1.03 -2.12 0.00 0.00 175.29 174.74 3eec s ARG 42 N -0.19 1.01 -0.11 2.91 1.81 0.42 -4.83 118.95 119.97 3eec s ARG 42 Ca 0.03 -0.08 -0.03 0.00 -1.72 0.00 0.00 55.73 53.93 3eec s ARG 42 Cb -0.13 -1.16 -0.03 0.00 -0.45 0.00 0.00 34.95 33.18 3eec s ARG 42 CO 0.02 -0.22 -0.00 -0.51 -0.68 0.00 0.00 175.30 173.91 3eec s LEU 43 N 1.57 3.53 -0.13 2.53 1.43 -1.26 0.75 118.68 127.10 3eec s LEU 43 Ca 0.00 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 3eec s LEU 43 Cb -0.13 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.27 3eec s LEU 43 CO -0.04 0.31 -0.21 -0.63 0.23 0.00 0.00 176.35 176.00 3eec s ILE 44 N -0.47 2.21 -0.36 -0.59 1.09 -0.38 0.52 121.20 123.21 3eec s ILE 44 Ca 0.08 -0.94 -0.05 0.00 -1.10 0.00 0.00 60.65 58.64 3eec s ILE 44 Cb -0.12 -1.88 0.07 0.00 -1.06 0.00 0.00 42.46 39.47 3eec s ILE 44 CO 0.02 0.55 0.12 0.12 -0.10 0.00 0.00 174.94 175.65 3eec s PHE 45 N 0.64 3.35 -1.25 3.97 5.36 0.26 -0.70 117.98 129.61 3eec s PHE 45 Ca -0.11 -1.81 -0.09 0.00 -0.96 0.00 0.00 56.93 53.96 3eec s PHE 45 Cb -0.16 -2.56 -0.01 0.00 -0.34 0.00 0.00 43.02 39.95 3eec s PHE 45 CO 0.02 -0.83 0.68 0.00 -1.46 0.00 0.00 175.22 173.63 3eec n ALA 46 N 4.72 -2.26 -1.14 11.12 0.00 -1.26 -1.85 120.51 129.84 3eec n ALA 46 Ca -0.10 -0.20 -0.05 0.00 0.00 0.00 0.00 53.44 53.09 3eec n ALA 46 Cb 0.43 -2.94 -0.02 0.00 0.00 0.00 0.00 19.45 16.92 3eec n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3eec n GLY 47 N -1.69 0.75 3.06 0.00 0.00 -1.26 -5.02 105.19 101.02 3eec n GLY 47 Ca -0.21 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 3eec n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eec s LYS 48 N -2.14 2.42 -0.34 1.61 1.02 -0.77 -5.08 119.74 116.46 3eec s LYS 48 Ca 0.00 -0.62 -0.29 0.00 0.02 0.00 0.00 55.97 55.08 3eec s LYS 48 Cb 0.00 -2.12 0.01 0.00 -0.52 0.00 0.00 37.83 35.20 3eec s LYS 48 CO 0.00 -0.16 1.27 -1.14 -0.92 0.00 0.00 175.35 174.40 3eec s GLN 49 N 1.24 3.87 0.32 1.68 0.74 -1.26 0.92 119.66 127.18 3eec s GLN 49 Ca 0.00 1.11 -0.28 0.00 0.05 0.00 0.00 55.36 56.24 3eec s GLN 49 Cb -0.14 -3.88 -0.10 0.00 1.10 0.00 0.00 33.01 30.00 3eec s GLN 49 CO -0.07 -1.18 1.20 -0.51 -0.55 0.00 0.00 175.29 174.18 3eec s LEU 50 N 4.42 4.44 -0.25 3.68 1.43 0.18 -4.96 118.68 127.62 3eec s LEU 50 Ca 0.54 2.46 -0.20 0.00 -1.03 0.00 0.00 54.13 55.91 3eec s LEU 50 Cb -0.15 -3.70 -0.02 0.00 0.03 0.00 0.00 46.19 42.35 3eec s LEU 50 CO 0.24 -0.40 0.60 -0.70 0.23 0.00 0.00 176.35 176.32 3eec s GLU 51 N -1.74 4.10 0.37 1.70 2.12 -1.26 -4.64 118.70 119.35 3eec s GLU 51 Ca 0.48 0.49 0.24 0.00 0.36 0.00 0.00 54.97 56.54 3eec s GLU 51 Cb -0.35 -3.65 1.32 0.00 0.26 0.00 0.00 34.13 31.71 3eec s GLU 51 CO 0.46 -0.39 1.47 -0.25 -0.54 0.00 0.00 175.26 176.01 3eec n ASP 52 N 5.64 0.28 0.03 -1.70 9.92 -1.26 -1.65 116.55 127.80 3eec n ASP 52 Ca -0.02 1.46 -0.16 0.00 -0.53 0.00 0.00 54.79 55.54 3eec n ASP 52 Cb 0.49 -0.71 -0.06 0.00 -0.64 0.00 0.00 41.12 40.19 3eec n ASP 52 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 3eec h GLY 53 N 0.00 0.71 -1.19 0.44 0.00 -1.96 -2.47 103.07 98.61 3eec h GLY 53 Ca 0.81 -1.12 -0.50 0.00 0.00 0.00 0.00 47.33 46.52 3eec h GLY 53 CO -0.61 0.99 0.28 0.50 0.00 0.00 0.00 176.54 177.70 3eec s ARG 54 N -3.50 1.73 0.28 4.80 0.52 -0.66 -4.72 118.95 117.40 3eec s ARG 54 Ca -0.09 0.96 0.07 0.00 -0.52 0.00 0.00 55.73 56.15 3eec s ARG 54 Cb 0.08 -1.85 -0.03 0.00 0.52 0.00 0.00 34.95 33.67 3eec s ARG 54 CO 0.89 -1.95 0.24 0.95 0.02 0.00 0.00 175.30 175.45 3eec s THR 55 N -2.93 4.15 0.47 0.02 -4.23 -1.26 -2.11 115.64 109.75 3eec s THR 55 Ca 0.62 -1.38 0.26 0.00 -1.18 0.00 0.00 61.69 60.02 3eec s THR 55 Cb -0.17 -3.34 0.45 0.00 1.34 0.00 0.00 72.50 70.78 3eec s THR 55 CO 0.56 -0.29 1.83 -0.07 -0.54 0.00 0.00 174.62 176.11 3eec h LEU 56 N 1.39 0.21 -0.35 4.79 3.38 -1.21 0.59 115.31 124.12 3eec h LEU 56 Ca -0.47 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 3eec h LEU 56 Cb 1.24 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 3eec h LEU 56 CO 0.60 0.06 0.01 0.28 0.09 0.00 0.00 178.44 179.47 3eec h SER 57 N 0.20 0.59 0.28 -0.43 0.02 -1.68 0.20 113.55 112.73 3eec h SER 57 Ca 0.52 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3eec h SER 57 Cb 1.68 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 64.03 3eec h SER 57 CO -0.13 0.75 -0.50 0.44 -1.14 0.00 0.00 176.83 176.25 3eec h ASP 58 N 0.42 -1.43 0.00 3.07 3.45 -1.20 0.21 116.42 120.93 3eec h ASP 58 Ca 0.10 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.70 3eec h ASP 58 Cb 0.44 0.51 0.00 0.00 -0.56 0.00 0.00 39.33 39.72 3eec h ASP 58 CO 0.02 -0.59 0.00 -1.22 -1.57 0.00 0.00 179.24 175.88 3eec n TYR 59 N -5.51 0.00 -4.32 4.55 4.02 -1.12 -4.80 117.16 109.98 3eec n TYR 59 Ca -0.10 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.45 3eec n TYR 59 Cb 0.43 -0.05 -0.07 0.00 -0.02 0.00 0.00 39.34 39.63 3eec n TYR 59 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3eec n ASN 60 N 0.14 -0.88 -4.53 7.72 2.85 0.06 -4.88 115.26 115.74 3eec n ASN 60 Ca 0.00 -1.18 -0.43 0.00 -0.11 0.00 0.00 54.58 52.86 3eec n ASN 60 Cb 0.13 -2.03 -0.07 0.00 1.24 0.00 0.00 39.78 39.05 3eec n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3eec s ILE 61 N -3.77 4.83 0.48 -1.44 1.01 0.68 -5.02 121.20 117.97 3eec s ILE 61 Ca 0.40 0.25 0.08 0.00 0.00 0.00 0.00 60.65 61.38 3eec s ILE 61 Cb -0.23 -4.18 0.08 0.00 0.01 0.00 0.00 42.46 38.14 3eec s ILE 61 CO 0.98 -0.54 0.65 0.00 0.00 0.00 0.00 174.94 176.03 3eec n GLN 62 N 6.25 0.68 -1.62 2.79 10.64 -1.26 -4.55 117.38 130.30 3eec n GLN 62 Ca -0.01 -2.63 -0.39 0.00 -1.83 0.00 0.00 57.00 52.13 3eec n GLN 62 Cb 0.48 -0.17 0.03 0.00 -0.86 0.00 0.00 30.24 29.72 3eec n GLN 62 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 3eec n LYS 63 N -2.03 1.18 -1.26 2.61 2.85 -1.26 -2.12 118.16 118.13 3eec n LYS 63 Ca 0.13 0.44 -0.09 0.00 -1.05 0.00 0.00 58.31 57.73 3eec n LYS 63 Cb 0.50 -2.13 -0.04 0.00 -0.65 0.00 0.00 35.03 32.71 3eec n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3eec n GLU 64 N -0.42 -1.27 -2.39 -1.58 1.02 0.19 -4.99 120.64 111.20 3eec n GLU 64 Ca 0.11 0.76 -0.32 0.00 -0.02 0.00 0.00 57.16 57.69 3eec n GLU 64 Cb 0.43 -4.91 -0.03 0.00 -0.02 0.00 0.00 31.44 26.92 3eec n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3eec s SER 65 N -2.47 6.54 -0.11 1.62 0.01 -0.90 -4.74 113.70 113.65 3eec s SER 65 Ca 0.00 1.47 0.02 0.00 1.31 0.00 0.00 55.95 58.75 3eec s SER 65 Cb 0.00 -2.47 -0.01 0.00 0.21 0.00 0.00 66.02 63.75 3eec s SER 65 CO 0.00 -0.60 -0.18 -0.89 0.41 0.00 0.00 173.24 171.98 3eec s THR 66 N -2.68 2.64 -0.00 1.44 2.01 -1.26 -0.40 115.64 117.39 3eec s THR 66 Ca 0.57 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.81 3eec s THR 66 Cb -0.10 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 3eec s THR 66 CO 0.35 0.55 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.88 3eec s LEU 67 N 0.21 2.54 -0.20 4.42 1.43 0.21 -4.25 118.68 123.04 3eec s LEU 67 Ca -0.11 -0.36 -0.08 0.00 -1.03 0.00 0.00 54.13 52.55 3eec s LEU 67 Cb -0.16 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 3eec s LEU 67 CO 0.06 0.30 0.08 -1.00 0.23 0.00 0.00 176.35 176.02 3eec s HIS 68 N -0.80 3.22 -0.20 0.29 3.76 0.12 -0.37 115.29 121.32 3eec s HIS 68 Ca 0.13 0.00 -0.24 0.00 -0.15 0.00 0.00 55.06 54.80 3eec s HIS 68 Cb -0.10 -2.13 -0.01 0.00 1.11 0.00 0.00 32.58 31.44 3eec s HIS 68 CO 0.02 0.05 0.79 -1.17 -0.85 0.00 0.00 174.74 173.58 3eec s LEU 69 N 0.69 4.14 -0.07 0.89 2.96 0.15 -1.25 118.68 126.19 3eec s LEU 69 Ca 0.04 1.06 0.06 0.00 -0.22 0.00 0.00 54.13 55.06 3eec s LEU 69 Cb -0.13 -3.15 -0.01 0.00 0.50 0.00 0.00 46.19 43.40 3eec s LEU 69 CO 0.02 -0.41 -0.25 -0.69 -1.32 0.00 0.00 176.35 173.70 3eec s VAL 70 N 2.33 2.05 -0.24 1.68 1.01 0.23 -4.49 120.40 122.96 3eec s VAL 70 Ca 0.35 -1.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 3eec s VAL 70 Cb -0.16 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3eec s VAL 70 CO 0.10 0.57 0.11 -0.76 0.00 0.00 0.00 175.10 175.12 3eec s LEU 71 N -0.06 3.74 -0.84 3.92 1.43 -1.26 0.16 118.68 125.78 3eec s LEU 71 Ca -0.07 -0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 3eec s LEU 71 Cb -0.15 -2.00 0.30 0.00 0.03 0.00 0.00 46.19 44.37 3eec s LEU 71 CO 0.05 0.02 2.10 -1.14 0.23 0.00 0.00 176.35 177.61 3eec n ARG 72 N 4.57 3.19 0.00 1.70 0.63 -0.57 -4.97 116.66 121.21 3eec n ARG 72 Ca -0.16 -3.55 0.06 0.00 -0.92 0.00 0.00 57.85 53.29 3eec n ARG 72 Cb 0.52 -2.30 0.05 0.00 0.45 0.00 0.00 32.46 31.18 3eec n ARG 72 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59