#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o7c s VAL 2 N 0.00 4.82 0.25 1.61 0.11 -1.26 -2.59 120.40 123.33 1o7c s VAL 2 Ca 0.00 0.76 -0.04 0.00 -2.93 0.00 0.00 61.98 59.77 1o7c s VAL 2 Cb 0.00 -3.68 0.02 0.00 -1.53 0.00 0.00 36.38 31.19 1o7c s VAL 2 CO 0.00 0.03 0.39 0.00 -3.33 0.00 0.00 175.10 172.19 1o7c n TYR 3 N 0.19 -1.35 -4.19 1.54 4.11 -0.10 -4.99 117.16 112.37 1o7c n TYR 3 Ca -0.01 -1.49 -0.24 0.00 -0.00 0.00 0.00 57.90 56.16 1o7c n TYR 3 Cb 0.52 0.44 -0.06 0.00 -0.00 0.00 0.00 39.34 40.24 1o7c n TYR 3 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 1o7c s HIS 4 N -3.85 2.93 -0.06 -3.48 5.65 -1.26 -1.28 115.29 113.94 1o7c s HIS 4 Ca 0.17 -0.13 -0.25 0.00 0.25 0.00 0.00 55.06 55.10 1o7c s HIS 4 Cb -0.01 -1.35 0.05 0.00 -1.18 0.00 0.00 32.58 30.09 1o7c s HIS 4 CO 0.12 0.55 0.55 1.03 -0.65 0.00 0.00 174.74 176.34 1o7c s ARG 5 N -3.42 0.90 0.18 2.88 1.81 -0.23 -4.81 118.95 116.26 1o7c s ARG 5 Ca 0.31 0.17 0.01 0.00 -1.72 0.00 0.00 55.73 54.50 1o7c s ARG 5 Cb -0.08 0.42 0.01 0.00 -0.45 0.00 0.00 34.95 34.85 1o7c s ARG 5 CO 0.21 -0.26 0.10 -0.85 -0.68 0.00 0.00 175.30 173.83 1o7c n GLU 6 N 1.21 1.32 -3.13 3.54 0.00 -1.26 -0.95 120.64 121.38 1o7c n GLU 6 Ca -0.19 -1.16 -0.26 0.00 0.00 0.00 0.00 57.16 55.54 1o7c n GLU 6 Cb 0.57 0.18 -0.01 0.00 0.00 0.00 0.00 31.44 32.17 1o7c n GLU 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1o7c s ALA 7 N -2.27 3.58 0.60 -1.84 0.00 -1.23 -4.89 121.76 115.71 1o7c s ALA 7 Ca 0.08 -0.67 0.42 0.00 0.00 0.00 0.00 51.96 51.79 1o7c s ALA 7 Cb -0.01 -2.33 2.28 0.00 0.00 0.00 0.00 23.12 23.06 1o7c s ALA 7 CO 0.05 -0.05 2.33 0.00 0.00 0.00 0.00 175.76 178.08 1o7c h ARG 8 N 0.86 0.00 0.00 0.00 -0.00 -2.01 -1.48 114.38 111.75 1o7c h ARG 8 Ca -0.48 0.00 -0.28 0.00 -0.50 0.00 0.00 59.98 58.71 1o7c h ARG 8 Cb 1.21 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 31.12 1o7c h ARG 8 CO 0.63 0.00 -1.98 0.43 0.00 0.00 0.00 179.97 179.05 1o7c n SER 9 N -3.15 0.42 0.00 7.04 7.64 -1.26 -5.08 113.62 119.22 1o7c n SER 9 Ca -0.03 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.05 1o7c n SER 9 Cb 0.10 0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.90 1o7c n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o7c n GLY 10 N 1.59 3.23 3.63 0.23 0.00 -0.56 -5.12 105.19 108.20 1o7c n GLY 10 Ca -0.22 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 1o7c n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1o7c n LYS 11 N -1.72 0.65 -3.06 1.61 4.81 -1.26 -3.51 118.16 115.68 1o7c n LYS 11 Ca 0.00 0.28 -0.13 0.00 -0.87 0.00 0.00 58.31 57.58 1o7c n LYS 11 Cb 0.00 -2.25 0.07 0.00 0.02 0.00 0.00 35.03 32.86 1o7c n LYS 11 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1o7c n TYR 12 N -2.30 -1.87 -1.64 5.64 4.01 -1.24 -4.92 117.16 114.84 1o7c n TYR 12 Ca 0.14 0.73 0.00 0.00 -0.16 0.00 0.00 57.90 58.61 1o7c n TYR 12 Cb 0.49 -4.21 0.00 0.00 -0.31 0.00 0.00 39.34 35.30 1o7c n TYR 12 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1o7c n LYS 13 N -3.27 0.00 -4.42 -0.72 5.02 -1.13 -4.36 118.16 109.28 1o7c n LYS 13 Ca -0.16 -0.10 -0.34 0.00 -2.02 0.00 0.00 58.31 55.69 1o7c n LYS 13 Cb 0.62 -0.18 -0.12 0.00 -0.02 0.00 0.00 35.03 35.33 1o7c n LYS 13 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1o7c s LEU 14 N 0.00 3.24 0.08 -0.35 1.43 -0.22 -4.81 118.68 118.05 1o7c s LEU 14 Ca 0.00 -0.13 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 1o7c s LEU 14 Cb 0.00 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1o7c s LEU 14 CO 0.00 0.18 0.14 0.42 0.23 0.00 0.00 176.35 177.32 1o7c s THR 15 N 0.32 4.90 0.26 5.49 -4.23 -1.26 -1.72 115.64 119.41 1o7c s THR 15 Ca -0.04 -0.63 0.09 0.00 -1.18 0.00 0.00 61.69 59.93 1o7c s THR 15 Cb -0.14 -3.39 0.29 0.00 1.34 0.00 0.00 72.50 70.60 1o7c s THR 15 CO 0.03 0.11 1.20 0.00 -0.54 0.00 0.00 174.62 175.42 1o7c n TYR 16 N 0.31 0.70 -0.07 3.99 9.36 -1.23 0.20 117.16 130.42 1o7c n TYR 16 Ca -0.07 0.91 -0.12 0.00 3.32 0.00 0.00 57.90 61.94 1o7c n TYR 16 Cb 0.52 -1.21 -0.06 0.00 -0.63 0.00 0.00 39.34 37.96 1o7c n TYR 16 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1o7c h ALA 17 N 1.53 0.29 0.38 2.98 0.00 -1.94 -2.30 119.26 120.21 1o7c h ALA 17 Ca 0.56 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1o7c h ALA 17 Cb 1.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1o7c h ALA 17 CO -0.65 0.15 -0.18 0.93 0.00 0.00 0.00 179.25 179.50 1o7c h GLU 18 N 0.14 -0.50 -1.06 0.00 5.08 0.20 -2.41 114.58 116.04 1o7c h GLU 18 Ca 0.04 0.03 0.35 0.00 -1.00 0.00 0.00 59.36 58.78 1o7c h GLU 18 Cb 0.63 0.11 -0.14 0.00 0.50 0.00 0.00 28.75 29.85 1o7c h GLU 18 CO 0.04 -0.18 0.62 0.00 -1.00 0.00 0.00 179.01 178.49 1o7c h ALA 19 N -0.55 2.13 -0.30 3.43 0.00 0.82 0.83 119.26 125.62 1o7c h ALA 19 Ca -0.05 0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1o7c h ALA 19 Cb 0.54 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1o7c h ALA 19 CO 0.09 -0.75 -0.45 -0.22 0.00 0.00 0.00 179.25 177.92 1o7c h LYS 20 N 0.26 0.78 -0.62 0.00 3.64 -1.32 -2.67 116.57 116.64 1o7c h LYS 20 Ca 0.75 -0.43 -0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1o7c h LYS 20 Cb 1.87 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.68 1o7c h LYS 20 CO -0.57 1.06 0.37 0.00 -2.27 0.00 0.00 179.45 178.05 1o7c h ALA 21 N 0.87 0.79 -0.15 5.00 0.00 0.12 0.41 119.26 126.29 1o7c h ALA 21 Ca 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1o7c h ALA 21 Cb 1.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1o7c h ALA 21 CO 0.10 0.27 0.05 0.28 0.00 0.00 0.00 179.25 179.95 1o7c h VAL 22 N 0.83 1.16 0.34 0.00 2.07 -1.24 0.66 116.25 120.08 1o7c h VAL 22 Ca 0.22 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1o7c h VAL 22 Cb -0.02 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1o7c h VAL 22 CO -0.04 0.15 -0.16 0.00 0.02 0.00 0.00 177.57 177.54 1o7c n GLU 24 N -5.17 0.49 -0.02 0.00 2.13 0.14 -0.69 120.64 117.52 1o7c n GLU 24 Ca -0.10 0.03 -0.12 0.00 0.66 0.00 0.00 57.16 57.64 1o7c n GLU 24 Cb 0.27 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.41 1o7c n GLU 24 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1o7c h PHE 25 N 0.00 0.16 -2.31 4.31 3.57 0.76 -3.32 116.94 120.11 1o7c h PHE 25 Ca 0.00 -0.02 -0.64 0.00 3.53 0.00 0.00 57.97 60.84 1o7c h PHE 25 Cb 0.05 -0.04 -0.39 0.00 2.79 0.00 0.00 35.95 38.35 1o7c h PHE 25 CO 0.00 0.35 -0.28 0.39 -2.23 0.00 0.00 178.31 176.55 1o7c n GLU 26 N -4.87 3.43 -3.89 1.11 1.02 -1.19 -4.86 120.64 111.39 1o7c n GLU 26 Ca -0.06 -4.76 -0.27 0.00 -0.02 0.00 0.00 57.16 52.05 1o7c n GLU 26 Cb 0.16 -2.30 0.01 0.00 -0.02 0.00 0.00 31.44 29.30 1o7c n GLU 26 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o7c n GLY 27 N 0.25 -0.36 3.81 0.62 0.00 -1.25 -4.98 105.19 103.28 1o7c n GLY 27 Ca 0.32 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 46.20 1o7c n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o7c s GLY 28 N -3.89 2.72 -0.14 -0.02 0.00 0.13 -4.94 107.32 101.19 1o7c s GLY 28 Ca 0.31 -0.88 -0.09 0.00 0.00 0.00 0.00 44.72 44.05 1o7c s GLY 28 CO 0.85 -2.08 0.35 -2.38 0.00 0.00 0.00 173.10 169.83 1o7c s HIS 29 N -2.81 -0.45 0.31 1.90 -3.43 -0.43 -3.53 115.29 106.84 1o7c s HIS 29 Ca 0.19 1.03 -0.27 0.00 -0.80 0.00 0.00 55.06 55.22 1o7c s HIS 29 Cb 0.01 0.16 -0.14 0.00 -1.43 0.00 0.00 32.58 31.18 1o7c s HIS 29 CO 0.11 -0.26 0.86 -0.11 -2.00 0.00 0.00 174.74 173.35 1o7c n LEU 30 N 3.72 1.09 -4.82 5.38 0.00 -1.26 -0.41 117.00 120.70 1o7c n LEU 30 Ca -0.20 1.12 -0.35 0.00 0.00 0.00 0.00 56.01 56.58 1o7c n LEU 30 Cb 0.56 -1.21 -0.06 0.00 0.00 0.00 0.00 43.42 42.70 1o7c n LEU 30 CO 0.12 -1.90 0.49 0.00 0.00 0.00 0.00 177.39 176.11 1o7c s ALA 31 N -1.13 3.31 0.14 1.96 0.00 0.71 -4.67 121.76 122.07 1o7c s ALA 31 Ca 0.61 0.24 0.02 0.00 0.00 0.00 0.00 51.96 52.83 1o7c s ALA 31 Cb -0.71 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 19.51 1o7c s ALA 31 CO 0.59 0.28 0.18 0.25 0.00 0.00 0.00 175.76 177.05 1o7c n THR 32 N 0.31 0.00 0.11 0.00 -2.24 -1.26 -3.47 114.28 107.73 1o7c n THR 32 Ca 0.01 -0.46 -0.05 0.00 -2.27 0.00 0.00 64.05 61.28 1o7c n THR 32 Cb 0.52 -0.84 -0.02 0.00 -2.10 0.00 0.00 70.33 67.88 1o7c n THR 32 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1o7c h TYR 33 N 0.07 -0.29 -1.01 4.78 3.20 -1.97 -0.82 116.97 120.93 1o7c h TYR 33 Ca -0.07 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 62.04 1o7c h TYR 33 Cb 0.30 0.10 -0.12 0.00 1.54 0.00 0.00 36.73 38.55 1o7c h TYR 33 CO 0.00 -0.18 0.61 0.87 -1.64 0.00 0.00 178.16 177.82 1o7c h LYS 34 N -0.60 0.57 0.22 1.82 1.57 -1.98 0.20 116.57 118.37 1o7c h LYS 34 Ca -0.03 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1o7c h LYS 34 Cb 0.24 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1o7c h LYS 34 CO 0.05 0.37 -0.11 1.96 -0.57 0.00 0.00 179.45 181.16 1o7c h GLN 35 N 0.58 -0.29 -0.19 3.15 4.20 -1.96 -1.08 115.11 119.52 1o7c h GLN 35 Ca 0.62 0.02 0.06 0.00 0.06 0.00 0.00 58.65 59.41 1o7c h GLN 35 Cb 1.21 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.05 1o7c h GLN 35 CO -0.43 0.00 0.17 1.25 -0.67 0.00 0.00 178.83 179.16 1o7c h LEU 36 N -0.58 0.00 0.49 1.46 7.12 0.40 -1.79 115.31 122.40 1o7c h LEU 36 Ca -0.03 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.96 1o7c h LEU 36 Cb 0.43 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 1o7c h LEU 36 CO 0.05 0.00 -0.23 -0.08 -0.13 0.00 0.00 178.44 178.05 1o7c h GLU 37 N 0.00 -0.63 0.00 1.25 4.81 -0.29 0.53 114.58 120.25 1o7c h GLU 37 Ca 0.09 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1o7c h GLU 37 Cb 0.44 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1o7c h GLU 37 CO -0.00 -0.40 0.27 0.00 -0.73 0.00 0.00 179.01 178.15 1o7c h ALA 38 N -1.13 1.27 0.03 2.92 0.00 -0.68 0.49 119.26 122.16 1o7c h ALA 38 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.52 1o7c h ALA 38 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1o7c h ALA 38 CO 0.11 -0.27 -1.87 0.00 0.00 0.00 0.00 179.25 177.22 1o7c n ALA 39 N -1.89 1.33 0.07 0.00 0.00 -0.72 -3.95 120.51 115.36 1o7c n ALA 39 Ca -0.02 -0.78 -0.05 0.00 0.00 0.00 0.00 53.44 52.59 1o7c n ALA 39 Cb 0.32 -0.72 0.15 0.00 0.00 0.00 0.00 19.45 19.20 1o7c n ALA 39 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1o7c h ARG 40 N 0.02 0.31 0.00 0.00 1.12 0.21 -0.81 114.38 115.23 1o7c h ARG 40 Ca -0.35 -0.18 -0.01 0.00 -1.11 0.00 0.00 59.98 58.33 1o7c h ARG 40 Cb 2.04 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 32.01 1o7c h ARG 40 CO 0.07 0.75 -0.03 0.87 -3.11 0.00 0.00 179.97 178.51 1o7c h LYS 41 N 0.24 0.00 0.00 0.20 1.57 -0.68 -1.71 116.57 116.19 1o7c h LYS 41 Ca 0.01 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 1o7c h LYS 41 Cb 0.98 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.27 1o7c h LYS 41 CO 0.08 0.03 -1.13 -0.84 -0.57 0.00 0.00 179.45 177.03 1o7c h ILE 42 N 0.00 0.30 0.00 1.86 3.07 -1.60 -3.47 117.51 117.68 1o7c h ILE 42 Ca -0.00 -1.57 0.00 0.00 1.55 0.00 0.00 64.86 64.84 1o7c h ILE 42 Cb 0.33 1.84 0.00 0.00 -0.27 0.00 0.00 36.82 38.72 1o7c h ILE 42 CO 0.00 0.17 0.00 0.61 -1.05 0.00 0.00 178.15 177.89 1o7c n GLY 43 N 1.29 -0.35 3.72 0.16 0.00 -0.66 -5.13 105.19 104.22 1o7c n GLY 43 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1o7c n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1o7c s PHE 44 N 0.00 3.55 -0.24 1.61 5.36 -0.34 -4.95 117.98 122.97 1o7c s PHE 44 Ca 0.00 1.50 -0.10 0.00 -0.96 0.00 0.00 56.93 57.37 1o7c s PHE 44 Cb 0.00 -3.30 0.09 0.00 -0.34 0.00 0.00 43.02 39.47 1o7c s PHE 44 CO 0.00 -0.75 0.55 -1.58 -1.46 0.00 0.00 175.22 171.98 1o7c s HIS 45 N 0.51 -0.98 -0.37 10.12 5.65 -1.26 -4.05 115.29 124.91 1o7c s HIS 45 Ca 0.54 1.86 0.03 0.00 0.25 0.00 0.00 55.06 57.73 1o7c s HIS 45 Cb -0.28 0.52 0.15 0.00 -1.18 0.00 0.00 32.58 31.80 1o7c s HIS 45 CO 0.31 -0.52 0.36 0.08 -0.65 0.00 0.00 174.74 174.32 1o7c s VAL 46 N 2.24 -0.25 -0.74 0.89 1.01 -1.15 -4.97 120.40 117.42 1o7c s VAL 46 Ca -0.06 -1.15 -0.26 0.00 0.00 0.00 0.00 61.98 60.51 1o7c s VAL 46 Cb -0.10 -0.74 -0.22 0.00 0.00 0.00 0.00 36.38 35.32 1o7c s VAL 46 CO -0.16 -0.66 1.89 0.00 0.00 0.00 0.00 175.10 176.16 1o7c s ALA 48 N 10.20 -3.12 -0.44 0.00 0.00 -1.26 -5.11 121.76 122.04 1o7c s ALA 48 Ca 0.69 1.85 -0.40 0.00 0.00 0.00 0.00 51.96 54.11 1o7c s ALA 48 Cb 0.06 -2.23 -0.17 0.00 0.00 0.00 0.00 23.12 20.78 1o7c s ALA 48 CO 0.20 -0.99 1.65 0.00 0.00 0.00 0.00 175.76 176.62 1o7c n ALA 49 N 4.74 -0.43 -3.60 0.00 0.00 -1.26 -4.64 120.51 115.32 1o7c n ALA 49 Ca -0.07 0.29 -0.34 0.00 0.00 0.00 0.00 53.44 53.31 1o7c n ALA 49 Cb 0.55 -1.75 -0.15 0.00 0.00 0.00 0.00 19.45 18.10 1o7c n ALA 49 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1o7c s GLY 50 N 4.04 1.54 0.57 0.00 0.00 0.58 -0.09 107.32 113.96 1o7c s GLY 50 Ca 0.99 -1.14 -0.19 0.00 0.00 0.00 0.00 44.72 44.37 1o7c s GLY 50 CO 0.64 0.31 0.97 0.79 0.00 0.00 0.00 173.10 175.81 1o7c n TRP 51 N 4.59 0.87 -3.91 1.90 7.02 -1.07 -3.22 117.44 123.62 1o7c n TRP 51 Ca -0.19 0.45 -0.01 0.00 -1.02 0.00 0.00 57.50 56.73 1o7c n TRP 51 Cb 0.51 -2.15 0.02 0.00 -2.42 0.00 0.00 31.31 27.26 1o7c n TRP 51 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1o7c s MET 52 N -2.62 1.01 1.24 -0.99 0.23 0.22 -3.57 119.30 114.83 1o7c s MET 52 Ca 0.73 -0.65 0.00 0.00 -1.03 0.00 0.00 55.69 54.74 1o7c s MET 52 Cb -0.44 0.28 0.00 0.00 -1.53 0.00 0.00 34.83 33.15 1o7c s MET 52 CO 0.49 -0.48 0.00 0.00 -2.03 0.00 0.00 175.02 173.00 1o7c n ALA 53 N -0.75 0.00 0.21 3.16 0.00 -1.23 0.03 120.51 121.94 1o7c n ALA 53 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.45 1o7c n ALA 53 Cb 0.59 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.16 1o7c n ALA 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1o7c n LYS 54 N -0.59 0.04 0.00 0.00 4.76 -1.26 -4.30 118.16 116.81 1o7c n LYS 54 Ca 0.00 0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.76 1o7c n LYS 54 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 1o7c n LYS 54 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1o7c n GLY 55 N -0.90 0.00 3.78 0.72 0.00 -1.02 -5.14 105.19 102.62 1o7c n GLY 55 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1o7c n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o7c s ARG 56 N 0.00 4.15 -0.20 1.61 0.52 0.10 -4.49 118.95 120.64 1o7c s ARG 56 Ca 0.00 0.41 -0.01 0.00 -0.52 0.00 0.00 55.73 55.61 1o7c s ARG 56 Cb 0.00 -3.33 0.05 0.00 0.52 0.00 0.00 34.95 32.19 1o7c s ARG 56 CO 0.00 0.42 -0.02 0.54 0.02 0.00 0.00 175.30 176.26 1o7c s VAL 57 N -0.21 1.04 0.12 3.52 0.11 -1.26 0.69 120.40 124.41 1o7c s VAL 57 Ca 0.24 -0.79 0.01 0.00 -2.93 0.00 0.00 61.98 58.51 1o7c s VAL 57 Cb -0.16 -1.36 0.01 0.00 -1.53 0.00 0.00 36.38 33.34 1o7c s VAL 57 CO 0.11 -0.06 0.06 0.61 -3.33 0.00 0.00 175.10 172.49 1o7c n GLY 58 N 4.87 3.40 2.83 6.54 0.00 -1.20 -4.58 105.19 117.06 1o7c n GLY 58 Ca -0.11 -2.22 -0.28 0.00 0.00 0.00 0.00 46.02 43.41 1o7c n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o7c s TYR 59 N -0.95 3.17 0.14 1.61 2.02 -0.77 -0.31 117.35 122.26 1o7c s TYR 59 Ca 0.04 -3.17 -0.31 0.00 -0.37 0.00 0.00 57.07 53.26 1o7c s TYR 59 Cb -0.00 -2.46 -0.11 0.00 -0.40 0.00 0.00 41.96 38.99 1o7c s TYR 59 CO 0.03 -0.61 1.82 -2.30 -1.57 0.00 0.00 175.55 172.92 1o7c n PRO 60 N 2.24 2.80 -4.42 -1.71 -0.02 -1.26 -2.46 135.00 130.17 1o7c n PRO 60 Ca 0.19 1.02 -0.21 0.00 -2.02 0.00 0.00 63.50 62.48 1o7c n PRO 60 Cb 0.36 -2.90 -0.16 0.00 -0.02 0.00 0.00 33.50 30.78 1o7c n PRO 60 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1o7c s ILE 61 N 2.42 0.85 -0.22 4.25 -1.09 -1.25 -2.95 121.20 123.20 1o7c s ILE 61 Ca 0.80 -0.37 0.04 0.00 -2.23 0.00 0.00 60.65 58.89 1o7c s ILE 61 Cb -0.48 -0.76 -0.16 0.00 -1.58 0.00 0.00 42.46 39.48 1o7c s ILE 61 CO 0.36 0.27 -0.16 0.55 -1.23 0.00 0.00 174.94 174.73 1o7c n VAL 62 N 3.44 1.29 -3.91 2.92 3.14 -1.26 -3.35 118.33 120.60 1o7c n VAL 62 Ca -0.20 -0.53 -0.30 0.00 -2.96 0.00 0.00 64.34 60.35 1o7c n VAL 62 Cb 0.53 -1.19 -0.15 0.00 -1.06 0.00 0.00 33.84 31.97 1o7c n VAL 62 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 1o7c s LYS 63 N -2.45 1.38 0.05 1.45 -2.85 -1.26 -4.98 119.74 111.09 1o7c s LYS 63 Ca -0.27 -1.17 -0.37 0.00 -1.00 0.00 0.00 55.97 53.15 1o7c s LYS 63 Cb 0.07 -2.58 -0.17 0.00 -2.06 0.00 0.00 37.83 33.09 1o7c s LYS 63 CO 0.55 -0.75 1.31 -2.30 0.10 0.00 0.00 175.35 174.26 1o7c n PRO 64 N 4.63 0.94 -2.20 1.78 -0.02 -1.26 -4.98 135.00 133.89 1o7c n PRO 64 Ca -0.07 0.34 -0.05 0.00 -2.02 0.00 0.00 63.50 61.70 1o7c n PRO 64 Cb 0.43 -1.96 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 1o7c n PRO 64 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o7c n GLY 65 N 2.41 3.58 0.00 -1.23 0.00 -1.26 -4.85 105.19 103.83 1o7c n GLY 65 Ca 0.19 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1o7c n GLY 65 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1o7c n PRO 66 N -0.46 0.00 -0.06 1.61 -0.04 -1.26 -1.75 135.00 133.05 1o7c n PRO 66 Ca -0.02 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.46 1o7c n PRO 66 Cb 0.11 -0.41 0.05 0.00 -0.04 0.00 0.00 33.50 33.21 1o7c n PRO 66 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1o7c n ASN 67 N -0.18 0.59 -0.89 3.54 2.04 -1.26 -2.31 115.26 116.79 1o7c n ASN 67 Ca 0.00 -2.00 -0.00 0.00 -0.44 0.00 0.00 54.58 52.13 1o7c n ASN 67 Cb 0.00 -0.08 0.06 0.00 -2.53 0.00 0.00 39.78 37.22 1o7c n ASN 67 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1o7c n GLY 69 N 0.14 1.33 4.27 0.00 0.00 -1.25 -4.47 105.19 105.21 1o7c n GLY 69 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1o7c n GLY 69 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1o7c n PHE 70 N -0.13 -1.49 -2.36 1.61 7.35 -0.98 -2.49 117.46 118.96 1o7c n PHE 70 Ca 0.00 0.73 -0.01 0.00 -0.76 0.00 0.00 57.45 57.41 1o7c n PHE 70 Cb 0.00 -2.82 0.00 0.00 0.35 0.00 0.00 39.48 37.01 1o7c n PHE 70 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1o7c n GLY 71 N -1.67 -0.85 3.89 7.13 0.00 -0.72 -4.98 105.19 107.98 1o7c n GLY 71 Ca -0.07 0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1o7c n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o7c s LYS 72 N -2.86 3.72 -0.07 1.61 1.02 -1.04 -4.91 119.74 117.20 1o7c s LYS 72 Ca 0.02 0.31 0.04 0.00 0.02 0.00 0.00 55.97 56.36 1o7c s LYS 72 Cb -0.00 -2.46 -0.00 0.00 -0.52 0.00 0.00 37.83 34.84 1o7c s LYS 72 CO 0.42 0.03 -0.21 0.95 -0.92 0.00 0.00 175.35 175.62 1o7c s THR 73 N -2.31 1.76 0.25 2.17 -4.23 -1.26 -4.22 115.64 107.80 1o7c s THR 73 Ca 0.49 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 1o7c s THR 73 Cb -0.10 -1.52 0.00 0.00 1.34 0.00 0.00 72.50 72.22 1o7c s THR 73 CO 0.32 0.49 0.00 0.61 -0.54 0.00 0.00 174.62 175.50 1o7c n GLY 74 N 3.39 -2.39 3.58 3.99 0.00 -1.21 -4.65 105.19 107.90 1o7c n GLY 74 Ca -0.19 -1.30 -0.40 0.00 0.00 0.00 0.00 46.02 44.13 1o7c n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o7c s ILE 75 N -2.76 3.12 -1.17 -0.61 1.09 -1.26 -3.79 121.20 115.82 1o7c s ILE 75 Ca 0.00 0.11 -0.21 0.00 -1.10 0.00 0.00 60.65 59.44 1o7c s ILE 75 Cb 0.00 -3.21 -0.02 0.00 -1.06 0.00 0.00 42.46 38.17 1o7c s ILE 75 CO 0.00 -0.16 1.83 -0.63 -0.10 0.00 0.00 174.94 175.88 1o7c s ILE 76 N 9.39 3.75 -0.26 2.92 -1.09 -1.03 -4.72 121.20 130.16 1o7c s ILE 76 Ca 0.93 -1.16 -0.09 0.00 -2.23 0.00 0.00 60.65 58.11 1o7c s ILE 76 Cb -0.24 -4.75 -0.04 0.00 -1.58 0.00 0.00 42.46 35.86 1o7c s ILE 76 CO 0.31 -1.40 0.11 -0.62 -1.23 0.00 0.00 174.94 172.10 1o7c s ASP 77 N 5.83 5.43 -0.04 3.58 2.15 -1.26 -1.85 116.67 130.50 1o7c s ASP 77 Ca 0.62 -0.14 -0.00 0.00 0.43 0.00 0.00 52.55 53.46 1o7c s ASP 77 Cb 0.00 -1.99 -0.26 0.00 -0.30 0.00 0.00 42.92 40.37 1o7c s ASP 77 CO 0.08 -0.04 0.68 1.88 -0.17 0.00 0.00 175.17 177.60 1o7c h TYR 78 N 8.26 0.34 0.00 -5.34 -1.99 -1.92 -3.49 116.97 112.83 1o7c h TYR 78 Ca -0.37 -0.25 0.00 0.00 2.00 0.00 0.00 58.73 60.11 1o7c h TYR 78 Cb 1.18 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.90 1o7c h TYR 78 CO 0.70 1.39 0.00 0.41 -0.00 0.00 0.00 178.16 180.66 1o7c n GLY 79 N 1.73 2.93 3.63 3.88 0.00 -1.26 -5.03 105.19 111.06 1o7c n GLY 79 Ca -0.21 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 1o7c n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o7c s ILE 80 N -2.02 3.09 -1.87 -0.61 1.01 -1.26 -4.65 121.20 114.89 1o7c s ILE 80 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.80 1o7c s ILE 80 Cb 0.00 -3.09 0.15 0.00 0.01 0.00 0.00 42.46 39.53 1o7c s ILE 80 CO 0.00 -0.03 1.08 0.54 0.00 0.00 0.00 174.94 176.52 1o7c n ARG 81 N 8.05 1.43 -3.57 2.79 5.12 -1.26 -4.88 116.66 124.33 1o7c n ARG 81 Ca 0.24 -0.59 -0.21 0.00 -1.93 0.00 0.00 57.85 55.36 1o7c n ARG 81 Cb 0.43 -1.19 0.07 0.00 -1.16 0.00 0.00 32.46 30.62 1o7c n ARG 81 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1o7c n LEU 82 N -0.01 -3.55 -3.00 0.55 -0.00 -1.26 -4.97 117.00 104.77 1o7c n LEU 82 Ca 0.05 -0.65 -0.14 0.00 -0.00 0.00 0.00 56.01 55.28 1o7c n LEU 82 Cb 0.17 -2.96 -0.03 0.00 -0.00 0.00 0.00 43.42 40.60 1o7c n LEU 82 CO 0.04 0.47 -0.05 0.59 -0.00 0.00 0.00 177.39 178.45 1o7c n ASN 83 N -3.06 -2.08 0.00 1.96 5.03 -1.26 -4.96 115.26 110.89 1o7c n ASN 83 Ca -0.18 -2.79 0.03 0.00 0.87 0.00 0.00 54.58 52.51 1o7c n ASN 83 Cb 0.63 0.81 0.16 0.00 -1.02 0.00 0.00 39.78 40.35 1o7c n ASN 83 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1o7c n ARG 84 N 2.54 0.62 -0.21 3.52 1.74 -1.26 -2.11 116.66 121.49 1o7c n ARG 84 Ca 0.21 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.38 1o7c n ARG 84 Cb 0.54 -1.13 0.21 0.00 -1.02 0.00 0.00 32.46 31.06 1o7c n ARG 84 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1o7c n SER 85 N -0.63 3.27 -2.98 0.55 2.88 -1.26 -3.48 113.62 111.97 1o7c n SER 85 Ca 0.04 -1.94 -0.12 0.00 -1.33 0.00 0.00 58.87 55.52 1o7c n SER 85 Cb 0.02 -0.28 0.11 0.00 -0.75 0.00 0.00 64.21 63.30 1o7c n SER 85 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1o7c n GLU 86 N 1.16 -2.32 -3.74 -1.46 -0.58 -0.90 -4.93 120.64 107.87 1o7c n GLU 86 Ca 0.17 -0.65 -0.26 0.00 -0.42 0.00 0.00 57.16 56.00 1o7c n GLU 86 Cb 0.52 -0.68 -0.17 0.00 -0.57 0.00 0.00 31.44 30.54 1o7c n GLU 86 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1o7c s ARG 87 N -3.92 0.64 0.00 3.49 1.04 -1.26 -4.02 118.95 114.91 1o7c s ARG 87 Ca 0.27 -0.26 0.00 0.00 -1.04 0.00 0.00 55.73 54.71 1o7c s ARG 87 Cb -0.03 -1.77 0.00 0.00 -2.04 0.00 0.00 34.95 31.10 1o7c s ARG 87 CO 0.22 -0.54 0.00 0.91 -0.04 0.00 0.00 175.30 175.85 1o7c n TRP 88 N 5.08 -0.48 -1.70 5.89 7.02 -0.70 -4.40 117.44 128.15 1o7c n TRP 88 Ca -0.08 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.30 1o7c n TRP 88 Cb 0.48 0.00 0.06 0.00 -2.42 0.00 0.00 31.31 29.43 1o7c n TRP 88 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1o7c n ASP 89 N -1.04 0.20 -3.65 -0.99 9.92 0.87 -1.05 116.55 120.80 1o7c n ASP 89 Ca 0.00 -1.26 -0.17 0.00 -0.53 0.00 0.00 54.79 52.83 1o7c n ASP 89 Cb 0.00 -0.32 -0.16 0.00 -0.64 0.00 0.00 41.12 40.00 1o7c n ASP 89 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1o7c s ALA 90 N -3.61 -0.13 -0.37 2.24 0.00 -0.12 -2.60 121.76 117.16 1o7c s ALA 90 Ca 0.26 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.49 1o7c s ALA 90 Cb -0.01 -0.85 0.01 0.00 0.00 0.00 0.00 23.12 22.27 1o7c s ALA 90 CO 0.18 -0.63 0.75 0.71 0.00 0.00 0.00 175.76 176.77 1o7c s TYR 91 N 2.29 3.11 0.35 0.00 2.02 -1.23 -1.06 117.35 122.82 1o7c s TYR 91 Ca 0.03 0.46 -0.00 0.00 -0.37 0.00 0.00 57.07 57.19 1o7c s TYR 91 Cb -0.12 -3.36 -0.03 0.00 -0.40 0.00 0.00 41.96 38.04 1o7c s TYR 91 CO -0.06 -0.74 0.56 0.00 -1.57 0.00 0.00 175.55 173.74 1o7c s TYR 93 N -2.33 -0.23 -0.15 0.00 6.14 0.45 -0.93 117.35 120.30 1o7c s TYR 93 Ca 0.40 0.58 -0.16 0.00 0.64 0.00 0.00 57.07 58.53 1o7c s TYR 93 Cb -0.10 0.02 0.04 0.00 0.42 0.00 0.00 41.96 42.35 1o7c s TYR 93 CO 0.36 -0.16 0.45 -0.80 0.64 0.00 0.00 175.55 176.05 1o7c s ASN 94 N 0.76 -0.46 0.46 4.32 0.01 -1.07 -1.32 114.94 117.64 1o7c s ASN 94 Ca -0.05 0.84 0.24 0.00 -0.71 0.00 0.00 52.86 53.18 1o7c s ASN 94 Cb -0.07 0.86 1.27 0.00 0.41 0.00 0.00 41.25 43.72 1o7c s ASN 94 CO -0.04 -0.20 1.83 -0.65 -1.51 0.00 0.00 177.10 176.53 1o7c h PRO 95 N 5.17 0.22 0.00 -0.60 0.11 -1.92 0.13 132.00 135.11 1o7c h PRO 95 Ca -0.27 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1o7c h PRO 95 Cb 1.18 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1o7c h PRO 95 CO 0.24 0.15 -1.04 0.72 -0.21 0.00 0.00 178.00 177.86 1o7c n HIS 96 N -4.43 0.00 -3.71 0.65 8.25 -1.26 -3.75 115.22 110.97 1o7c n HIS 96 Ca 0.22 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.42 1o7c n HIS 96 Cb 0.90 -0.03 0.01 0.00 1.12 0.00 0.00 29.99 31.99 1o7c n HIS 96 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1o7c n ALA 97 N -2.23 -2.16 0.80 -1.41 0.00 -1.17 -3.78 120.51 110.54 1o7c n ALA 97 Ca -0.01 -0.31 0.10 0.00 0.00 0.00 0.00 53.44 53.22 1o7c n ALA 97 Cb 0.51 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.90 1o7c n ALA 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67