#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2npb n ALA 2 N 0.00 -2.67 -2.49 3.04 0.00 -1.26 -4.33 120.51 112.79 2npb n ALA 2 Ca 0.00 -1.15 -0.25 0.00 0.00 0.00 0.00 53.44 52.04 2npb n ALA 2 Cb 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 19.45 19.27 2npb n ALA 2 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2npb s LEU 3 N 0.00 2.68 -0.03 0.00 2.96 -0.04 -5.01 118.68 119.24 2npb s LEU 3 Ca 0.50 -0.89 -0.00 0.00 -0.22 0.00 0.00 54.13 53.52 2npb s LEU 3 Cb -0.06 -1.26 0.03 0.00 0.50 0.00 0.00 46.19 45.40 2npb s LEU 3 CO 0.39 0.06 0.01 0.00 -1.32 0.00 0.00 176.35 175.49 2npb s ALA 4 N -2.19 0.31 0.05 5.97 0.00 -1.26 -0.92 121.76 123.72 2npb s ALA 4 Ca 0.27 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.43 2npb s ALA 4 Cb -0.06 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 2npb s ALA 4 CO 0.14 -0.17 -0.12 0.08 0.00 0.00 0.00 175.76 175.69 2npb s VAL 5 N 1.27 0.94 0.21 0.00 1.01 0.01 -0.97 120.40 122.87 2npb s VAL 5 Ca -0.06 -1.08 0.09 0.00 0.00 0.00 0.00 61.98 60.92 2npb s VAL 5 Cb -0.13 -0.90 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 2npb s VAL 5 CO -0.02 -0.16 -0.17 -0.60 0.00 0.00 0.00 175.10 174.15 2npb s ARG 6 N -1.40 1.38 -0.32 2.72 6.06 -0.75 -0.91 118.95 125.73 2npb s ARG 6 Ca -0.02 -1.57 -0.02 0.00 -2.50 0.00 0.00 55.73 51.63 2npb s ARG 6 Cb -0.09 -1.30 0.11 0.00 0.06 0.00 0.00 34.95 33.73 2npb s ARG 6 CO 0.01 0.24 0.15 0.08 -2.50 0.00 0.00 175.30 173.28 2npb s VAL 7 N -2.60 0.43 0.13 7.11 1.01 -0.74 -2.62 120.40 123.12 2npb s VAL 7 Ca 0.22 -1.34 -0.30 0.00 0.00 0.00 0.00 61.98 60.56 2npb s VAL 7 Cb -0.03 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.95 2npb s VAL 7 CO 0.08 -0.78 1.16 0.54 0.00 0.00 0.00 175.10 176.10 2npb s VAL 8 N 1.56 3.90 0.00 2.92 0.11 -0.45 -0.74 120.40 127.70 2npb s VAL 8 Ca 0.12 1.50 0.00 0.00 -2.93 0.00 0.00 61.98 60.67 2npb s VAL 8 Cb -0.19 -3.96 0.00 0.00 -1.53 0.00 0.00 36.38 30.70 2npb s VAL 8 CO -0.22 0.19 0.00 0.00 -3.33 0.00 0.00 175.10 171.75 2npb n TYR 9 N 3.06 0.00 -4.28 1.54 9.36 0.05 -1.29 117.16 125.60 2npb n TYR 9 Ca 0.06 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 61.10 2npb n TYR 9 Cb 0.46 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.08 2npb n TYR 9 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2npb s SER 10 N 1.66 1.24 0.00 2.98 0.15 -1.26 -2.33 113.70 116.14 2npb s SER 10 Ca 0.00 -1.61 0.23 0.00 0.70 0.00 0.00 55.95 55.27 2npb s SER 10 Cb 0.00 0.47 0.74 0.00 -1.71 0.00 0.00 66.02 65.52 2npb s SER 10 CO 0.00 -0.96 1.56 0.61 1.20 0.00 0.00 173.24 175.64 2npb n GLY 11 N -0.52 0.45 0.00 9.45 0.00 -1.26 -4.67 105.19 108.65 2npb n GLY 11 Ca 0.04 -0.49 0.07 0.00 0.00 0.00 0.00 46.02 45.65 2npb n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2npb n ALA 12 N 0.52 2.08 -3.85 4.61 0.00 -1.26 -4.82 120.51 117.78 2npb n ALA 12 Ca 0.17 -0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.48 2npb n ALA 12 Cb 0.39 -1.24 0.01 0.00 0.00 0.00 0.00 19.45 18.62 2npb n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2npb n GLY 14 N -0.54 1.96 0.46 0.00 0.00 -1.26 -4.71 105.19 101.09 2npb n GLY 14 Ca -0.06 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.37 2npb n GLY 14 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2npb h TYR 15 N 5.86 -1.23 -0.72 1.61 3.20 -1.91 -3.27 116.97 120.51 2npb h TYR 15 Ca 0.14 -0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.17 2npb h TYR 15 Cb 0.32 0.45 -0.13 0.00 1.54 0.00 0.00 36.73 38.92 2npb h TYR 15 CO 1.55 -0.64 -0.02 0.87 -1.64 0.00 0.00 178.16 178.28 2npb h LYS 16 N -1.02 0.09 -0.07 1.82 1.57 -1.96 0.26 116.57 117.25 2npb h LYS 16 Ca -0.08 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.54 2npb h LYS 16 Cb 0.84 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2npb h LYS 16 CO 0.03 0.06 -0.62 -1.00 -0.57 0.00 0.00 179.45 177.35 2npb h PRO 17 N 0.09 0.27 -0.02 3.15 0.13 -1.99 -1.46 132.00 132.17 2npb h PRO 17 Ca 0.39 -0.19 -0.18 0.00 -0.87 0.00 0.00 66.00 65.15 2npb h PRO 17 Cb 0.66 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 2npb h PRO 17 CO -0.65 0.80 -0.80 -0.22 -0.23 0.00 0.00 178.00 176.91 2npb h LYS 18 N 0.20 0.21 0.46 0.86 3.11 -1.09 -0.71 116.57 119.62 2npb h LYS 18 Ca -0.01 -0.20 -0.01 0.00 -2.81 0.00 0.00 60.65 57.62 2npb h LYS 18 Cb 1.13 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 32.40 2npb h LYS 18 CO 0.10 0.90 -0.46 -0.92 -2.81 0.00 0.00 179.45 176.26 2npb h TYR 19 N 0.13 -1.28 -0.97 1.91 3.20 -0.61 -2.84 116.97 116.52 2npb h TYR 19 Ca -0.03 0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.02 2npb h TYR 19 Cb 1.39 0.50 -0.10 0.00 1.54 0.00 0.00 36.73 40.05 2npb h TYR 19 CO 0.03 -0.61 0.56 -0.07 -1.64 0.00 0.00 178.16 176.43 2npb h LEU 20 N -0.92 0.72 -0.35 2.82 4.07 -1.22 -0.02 115.31 120.40 2npb h LEU 20 Ca -0.06 0.10 0.04 0.00 0.08 0.00 0.00 57.88 58.04 2npb h LEU 20 Cb 0.80 -0.03 -0.04 0.00 1.08 0.00 0.00 40.66 42.47 2npb h LEU 20 CO -0.05 0.26 0.11 -0.61 -1.08 0.00 0.00 178.44 177.06 2npb h GLN 21 N 0.73 0.24 0.02 1.13 -0.00 -0.89 0.60 115.11 116.93 2npb h GLN 21 Ca 0.55 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 59.18 2npb h GLN 21 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.26 2npb h GLN 21 CO -0.38 0.16 -0.01 1.25 0.00 0.00 0.00 178.83 179.85 2npb h LEU 22 N 0.24 -0.02 0.34 -2.39 5.85 -1.25 -3.19 115.31 114.89 2npb h LEU 22 Ca 0.16 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2npb h LEU 22 Cb 0.15 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2npb h LEU 22 CO -0.18 0.03 -0.16 0.50 -0.34 0.00 0.00 178.44 178.29 2npb h LYS 23 N -0.07 -0.43 -0.85 1.25 3.11 0.22 -2.17 116.57 117.63 2npb h LYS 23 Ca -0.00 0.03 0.14 0.00 -2.81 0.00 0.00 60.65 58.01 2npb h LYS 23 Cb 0.06 0.10 -0.14 0.00 -1.00 0.00 0.00 32.23 31.25 2npb h LYS 23 CO 0.00 -0.11 -0.30 -1.91 -2.81 0.00 0.00 179.45 174.33 2npb n GLU 24 N -5.13 -0.17 -0.14 1.90 0.00 0.20 -0.77 120.64 116.53 2npb n GLU 24 Ca -0.09 1.31 -0.09 0.00 0.00 0.00 0.00 57.16 58.28 2npb n GLU 24 Cb 0.27 -1.94 0.05 0.00 0.00 0.00 0.00 31.44 29.82 2npb n GLU 24 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2npb h LYS 25 N 0.00 0.92 0.70 5.31 1.63 -1.51 0.97 116.57 124.59 2npb h LYS 25 Ca 0.32 -0.36 -0.03 0.00 -0.85 0.00 0.00 60.65 59.74 2npb h LYS 25 Cb 0.54 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.11 2npb h LYS 25 CO -0.85 1.01 -0.42 -0.07 -3.45 0.00 0.00 179.45 175.67 2npb h LEU 26 N 0.81 -1.06 -1.33 5.20 4.07 -0.65 -1.83 115.31 120.52 2npb h LEU 26 Ca 0.12 0.06 0.10 0.00 0.08 0.00 0.00 57.88 58.24 2npb h LEU 26 Cb 0.71 0.31 -0.06 0.00 1.08 0.00 0.00 40.66 42.70 2npb h LEU 26 CO 0.05 -0.66 0.53 -0.33 -1.08 0.00 0.00 178.44 176.96 2npb h GLU 27 N -1.05 0.71 -0.86 1.13 5.08 -0.91 -1.07 114.58 117.61 2npb h GLU 27 Ca -0.09 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2npb h GLU 27 Cb 0.85 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.89 2npb h GLU 27 CO 0.10 0.47 0.57 1.25 -1.00 0.00 0.00 179.01 180.39 2npb h HIS 28 N 0.73 1.08 -0.44 4.33 2.76 -0.69 -1.18 115.15 121.74 2npb h HIS 28 Ca 0.38 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.52 2npb h HIS 28 Cb 0.49 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.07 2npb h HIS 28 CO -0.00 0.68 0.05 1.49 -1.30 0.00 0.00 177.93 178.84 2npb h GLU 29 N 1.16 0.74 -1.63 5.26 4.57 -0.34 -3.39 114.58 120.95 2npb h GLU 29 Ca 0.31 -0.21 -0.47 0.00 -1.18 0.00 0.00 59.36 57.81 2npb h GLU 29 Cb -0.14 -0.08 -0.32 0.00 -0.16 0.00 0.00 28.75 28.05 2npb h GLU 29 CO -0.07 0.78 -0.92 1.97 -1.18 0.00 0.00 179.01 179.59 2npb n PHE 30 N -4.45 -1.31 -2.22 0.92 1.16 -0.85 -5.11 117.46 105.59 2npb n PHE 30 Ca -0.00 -3.00 -0.41 0.00 -1.87 0.00 0.00 57.45 52.17 2npb n PHE 30 Cb 0.26 0.28 -0.03 0.00 -1.61 0.00 0.00 39.48 38.38 2npb n PHE 30 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 2npb s PRO 31 N -0.41 4.42 0.00 3.97 0.04 -0.45 -3.11 135.00 139.47 2npb s PRO 31 Ca 0.34 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.45 2npb s PRO 31 Cb 0.14 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.53 2npb s PRO 31 CO -0.15 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.15 2npb n GLY 32 N 1.60 0.20 0.25 0.56 0.00 -1.26 -4.54 105.19 101.99 2npb n GLY 32 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 2npb n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2npb s LEU 34 N -7.10 2.90 -0.08 0.00 2.01 -1.18 -0.86 118.68 114.38 2npb s LEU 34 Ca -0.02 -0.40 -0.05 0.00 0.01 0.00 0.00 54.13 53.68 2npb s LEU 34 Cb 0.12 -1.71 -0.04 0.00 0.01 0.00 0.00 46.19 44.57 2npb s LEU 34 CO 0.61 0.21 0.14 -0.62 1.01 0.00 0.00 176.35 177.69 2npb s ASP 35 N -1.94 6.24 -0.03 2.29 2.15 -0.10 -4.93 116.67 120.36 2npb s ASP 35 Ca 0.19 0.39 -0.00 0.00 0.43 0.00 0.00 52.55 53.55 2npb s ASP 35 Cb -0.11 -1.97 0.03 0.00 -0.30 0.00 0.00 42.92 40.57 2npb s ASP 35 CO 0.10 0.36 0.03 -0.63 -0.17 0.00 0.00 175.17 174.86 2npb s ILE 36 N -1.11 -0.00 0.47 4.11 1.09 -1.26 -0.81 121.20 123.68 2npb s ILE 36 Ca 0.19 0.23 0.04 0.00 -1.10 0.00 0.00 60.65 60.01 2npb s ILE 36 Cb -0.12 -0.16 -0.04 0.00 -1.06 0.00 0.00 42.46 41.09 2npb s ILE 36 CO 0.09 0.13 0.05 0.00 -0.10 0.00 0.00 174.94 175.10 2npb s GLY 38 N -3.85 -0.36 -0.32 0.00 0.00 -1.26 -1.79 107.32 99.74 2npb s GLY 38 Ca 0.21 1.02 0.00 0.00 0.00 0.00 0.00 44.72 45.94 2npb s GLY 38 CO 0.11 0.76 0.29 1.85 0.00 0.00 0.00 173.10 176.11 2npb s GLU 39 N -0.74 0.43 -0.69 2.90 2.12 0.08 -4.90 118.70 117.90 2npb s GLU 39 Ca -0.08 -0.55 -0.16 0.00 0.36 0.00 0.00 54.97 54.54 2npb s GLU 39 Cb -0.03 -0.82 0.16 0.00 0.26 0.00 0.00 34.13 33.70 2npb s GLU 39 CO 0.05 -1.10 0.69 0.20 -0.54 0.00 0.00 175.26 174.56 2npb s GLY 40 N 1.90 2.23 -0.09 -1.50 0.00 -1.26 -0.77 107.32 107.83 2npb s GLY 40 Ca 0.13 -2.79 0.04 0.00 0.00 0.00 0.00 44.72 42.09 2npb s GLY 40 CO -0.21 1.36 -0.21 -1.08 0.00 0.00 0.00 173.10 172.97 2npb s THR 41 N 1.36 2.36 0.32 0.90 -1.32 -0.98 -4.80 115.64 113.48 2npb s THR 41 Ca 0.13 -0.93 -0.27 0.00 -1.21 0.00 0.00 61.69 59.40 2npb s THR 41 Cb -0.19 -1.91 -0.09 0.00 -1.51 0.00 0.00 72.50 68.79 2npb s THR 41 CO -0.02 0.56 1.07 -2.16 -2.21 0.00 0.00 174.62 171.86 2npb s PRO 42 N 0.11 4.47 0.00 7.08 0.04 -1.26 -4.62 135.00 140.81 2npb s PRO 42 Ca -0.10 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2npb s PRO 42 Cb -0.16 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2npb s PRO 42 CO 0.06 0.10 0.00 1.04 0.04 0.00 0.00 177.00 178.24 2npb n GLN 43 N 0.72 0.00 0.00 4.56 1.13 -1.26 -5.07 117.38 117.46 2npb n GLN 43 Ca 0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2npb n GLN 43 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.82 2npb n GLN 43 CO 0.00 0.00 0.00 1.55 -1.44 0.00 0.00 177.06 177.17 2npb n VAL 44 N -1.96 0.00 0.00 5.09 3.14 -1.26 -5.05 118.33 118.28 2npb n VAL 44 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2npb n VAL 44 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2npb n VAL 44 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2npb n THR 45 N -1.00 0.00 0.00 1.55 5.66 -1.26 -5.20 114.28 114.03 2npb n THR 45 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2npb n THR 45 Cb 0.00 -0.02 0.00 0.00 -1.55 0.00 0.00 70.33 68.76 2npb n THR 45 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2npb n GLY 46 N 1.46 1.31 3.16 1.09 0.00 -1.26 -4.80 105.19 106.15 2npb n GLY 46 Ca 0.00 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.35 2npb n GLY 46 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2npb s PHE 47 N -1.71 -0.54 -0.61 1.61 -0.12 -1.26 -4.99 117.98 110.37 2npb s PHE 47 Ca 0.00 1.15 -0.23 0.00 -0.05 0.00 0.00 56.93 57.80 2npb s PHE 47 Cb 0.00 0.16 0.06 0.00 -0.63 0.00 0.00 43.02 42.61 2npb s PHE 47 CO 0.00 -0.34 0.93 0.12 -0.05 0.00 0.00 175.22 175.88 2npb s PHE 48 N 1.80 2.74 -0.01 3.49 2.19 -1.25 -3.80 117.98 123.13 2npb s PHE 48 Ca -0.06 -0.34 0.04 0.00 0.33 0.00 0.00 56.93 56.90 2npb s PHE 48 Cb -0.10 -4.16 -0.01 0.00 -1.31 0.00 0.00 43.02 37.44 2npb s PHE 48 CO -0.11 -1.50 -0.13 -1.21 1.83 0.00 0.00 175.22 174.10 2npb s GLU 49 N 3.94 1.08 -0.13 10.12 2.02 -0.41 -1.44 118.70 133.87 2npb s GLU 49 Ca 0.25 -0.46 0.02 0.00 0.02 0.00 0.00 54.97 54.79 2npb s GLU 49 Cb -0.15 -1.04 0.01 0.00 0.10 0.00 0.00 34.13 33.05 2npb s GLU 49 CO 0.14 0.27 -0.18 0.08 0.02 0.00 0.00 175.26 175.58 2npb s VAL 50 N -0.26 1.79 -0.07 2.63 1.01 -0.64 -1.35 120.40 123.52 2npb s VAL 50 Ca 0.04 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.26 2npb s VAL 50 Cb -0.06 -1.61 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 2npb s VAL 50 CO -0.00 0.50 -0.22 0.42 0.00 0.00 0.00 175.10 175.80 2npb s THR 51 N 0.99 1.84 -0.16 3.92 -4.23 -1.08 -1.28 115.64 115.64 2npb s THR 51 Ca -0.05 -0.92 0.02 0.00 -1.18 0.00 0.00 61.69 59.56 2npb s THR 51 Cb -0.15 -1.58 0.01 0.00 1.34 0.00 0.00 72.50 72.13 2npb s THR 51 CO -0.04 0.51 -0.21 0.54 -0.54 0.00 0.00 174.62 174.89 2npb s VAL 52 N 0.15 2.03 -0.52 2.29 0.11 -0.15 -1.80 120.40 122.51 2npb s VAL 52 Ca -0.11 -0.94 0.00 0.00 -2.93 0.00 0.00 61.98 58.00 2npb s VAL 52 Cb -0.15 -1.81 0.00 0.00 -1.53 0.00 0.00 36.38 32.89 2npb s VAL 52 CO 0.05 0.54 0.00 0.00 -3.33 0.00 0.00 175.10 172.36 2npb n ALA 53 N 4.33 -0.07 0.00 1.54 0.00 -0.14 -0.41 120.51 125.76 2npb n ALA 53 Ca -0.20 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2npb n ALA 53 Cb 0.51 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2npb n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2npb n GLY 54 N -0.02 1.15 3.59 0.00 0.00 -1.26 -5.07 105.19 103.58 2npb n GLY 54 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2npb n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2npb s LYS 55 N -0.73 3.47 0.15 1.61 -0.14 0.45 -4.98 119.74 119.58 2npb s LYS 55 Ca 0.00 0.70 -0.34 0.00 -1.36 0.00 0.00 55.97 54.97 2npb s LYS 55 Cb 0.00 -4.05 -0.15 0.00 -1.68 0.00 0.00 37.83 31.95 2npb s LYS 55 CO 0.00 -1.70 1.50 -0.11 -0.76 0.00 0.00 175.35 174.27 2npb n LEU 56 N 9.05 2.68 0.00 3.17 0.00 -1.26 -0.98 117.00 129.66 2npb n LEU 56 Ca 0.14 1.10 0.00 0.00 0.00 0.00 0.00 56.01 57.25 2npb n LEU 56 Cb 0.49 -1.36 0.00 0.00 0.00 0.00 0.00 43.42 42.55 2npb n LEU 56 CO 0.71 -0.52 -0.38 0.52 0.00 0.00 0.00 177.39 177.71 2npb n VAL 57 N 3.05 0.00 -4.20 1.96 0.31 -0.41 -4.94 118.33 114.10 2npb n VAL 57 Ca 0.17 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.31 2npb n VAL 57 Cb 0.26 0.24 -0.12 0.00 -0.91 0.00 0.00 33.84 33.31 2npb n VAL 57 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 2npb s HIS 58 N -1.57 1.24 -0.24 3.52 5.65 -1.10 -5.01 115.29 117.79 2npb s HIS 58 Ca 0.00 -0.44 -0.18 0.00 0.25 0.00 0.00 55.06 54.69 2npb s HIS 58 Cb 0.00 -0.70 0.07 0.00 -1.18 0.00 0.00 32.58 30.76 2npb s HIS 58 CO 0.00 0.06 0.62 0.45 -0.65 0.00 0.00 174.74 175.22 2npb s SER 59 N -1.66 -0.74 0.12 9.88 0.15 -1.26 -1.62 113.70 118.57 2npb s SER 59 Ca -0.01 1.30 -0.16 0.00 0.70 0.00 0.00 55.95 57.78 2npb s SER 59 Cb -0.10 1.25 -0.02 0.00 -1.71 0.00 0.00 66.02 65.44 2npb s SER 59 CO 0.02 -0.22 1.60 0.11 1.20 0.00 0.00 173.24 175.95 2npb h LYS 60 N 6.09 0.63 0.00 5.44 1.79 -1.58 -0.14 116.57 128.80 2npb h LYS 60 Ca -0.30 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 57.96 2npb h LYS 60 Cb 1.19 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2npb h LYS 60 CO 0.15 0.70 -0.16 1.57 -1.08 0.00 0.00 179.45 180.63 2npb h LYS 61 N 0.48 0.00 0.00 3.15 2.10 -1.94 -1.75 116.57 118.60 2npb h LYS 61 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.76 2npb h LYS 61 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2npb h LYS 61 CO 0.01 0.16 -0.04 2.89 -2.00 0.00 0.00 179.45 180.47 2npb n ARG 62 N -3.53 0.11 -2.11 0.07 -4.01 -1.25 -4.95 116.66 101.00 2npb n ARG 62 Ca -0.01 0.09 0.00 0.00 -1.04 0.00 0.00 57.85 56.89 2npb n ARG 62 Cb 0.31 -1.62 0.00 0.00 -3.04 0.00 0.00 32.46 28.11 2npb n ARG 62 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2npb n GLY 63 N 1.42 0.83 0.10 2.89 0.00 -0.66 -4.99 105.19 104.79 2npb n GLY 63 Ca 0.06 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 2npb n GLY 63 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2npb h ASP 64 N 0.00 0.33 -3.87 1.61 3.58 -1.21 -3.50 116.42 113.35 2npb h ASP 64 Ca 0.00 -0.33 0.05 0.00 0.42 0.00 0.00 57.03 57.17 2npb h ASP 64 Cb 0.90 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.82 2npb h ASP 64 CO 0.00 1.22 -0.69 0.61 -2.88 0.00 0.00 179.24 177.50 2npb n GLY 65 N 1.33 -3.54 0.00 -0.78 0.00 -1.22 -4.98 105.19 96.00 2npb n GLY 65 Ca -0.06 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2npb n GLY 65 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2npb n TYR 66 N -2.51 -1.88 -0.31 1.61 4.01 -1.26 -4.74 117.16 112.08 2npb n TYR 66 Ca -0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.60 2npb n TYR 66 Cb 0.35 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.36 2npb n TYR 66 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 2npb n VAL 67 N -2.41 0.75 0.30 -0.72 0.24 -1.26 -4.38 118.33 110.86 2npb n VAL 67 Ca 0.00 -0.47 0.18 0.00 -2.04 0.00 0.00 64.34 62.01 2npb n VAL 67 Cb 0.00 -1.76 0.80 0.00 -1.47 0.00 0.00 33.84 31.41 2npb n VAL 67 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2npb h ASP 68 N 7.74 0.00 -5.16 -1.34 3.32 -1.95 -3.45 116.42 115.58 2npb h ASP 68 Ca 0.18 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 2npb h ASP 68 Cb 0.15 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.56 2npb h ASP 68 CO 1.28 0.00 -0.34 -0.89 -1.72 0.00 0.00 179.24 177.56 2npb s THR 69 N -3.75 0.13 0.15 0.35 2.01 -1.26 -5.02 115.64 108.24 2npb s THR 69 Ca -0.00 -1.15 -0.24 0.00 0.31 0.00 0.00 61.69 60.61 2npb s THR 69 Cb 0.10 -1.36 0.02 0.00 0.01 0.00 0.00 72.50 71.26 2npb s THR 69 CO 0.48 -0.60 1.62 -0.08 -0.69 0.00 0.00 174.62 175.34 2npb h GLU 70 N 2.71 -0.29 0.00 4.92 4.22 -1.98 -0.74 114.58 123.42 2npb h GLU 70 Ca -0.34 0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.09 2npb h GLU 70 Cb 1.21 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 2npb h GLU 70 CO 0.55 -0.19 -0.15 1.03 -2.18 0.00 0.00 179.01 178.06 2npb h SER 71 N -0.30 0.00 0.19 1.04 0.87 -1.99 -1.89 113.55 111.47 2npb h SER 71 Ca 0.13 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.46 2npb h SER 71 Cb 0.51 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2npb h SER 71 CO -0.41 0.15 -0.93 0.50 -0.53 0.00 0.00 176.83 175.61 2npb h LYS 72 N 0.00 0.52 -0.33 2.24 1.63 -1.53 -2.42 116.57 116.68 2npb h LYS 72 Ca -0.00 -0.53 0.04 0.00 -0.85 0.00 0.00 60.65 59.30 2npb h LYS 72 Cb 0.38 0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 32.12 2npb h LYS 72 CO 0.02 1.16 0.11 0.35 -3.45 0.00 0.00 179.45 177.64 2npb h PHE 73 N 0.31 0.19 -0.84 1.91 3.57 -0.80 -2.79 116.94 118.50 2npb h PHE 73 Ca -0.08 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.51 2npb h PHE 73 Cb 1.56 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 40.21 2npb h PHE 73 CO 0.07 0.08 0.55 -0.09 -2.23 0.00 0.00 178.31 176.69 2npb h ARG 74 N 0.25 0.85 0.00 1.11 2.43 -1.32 0.13 114.38 117.82 2npb h ARG 74 Ca 0.15 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 2npb h ARG 74 Cb 0.13 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2npb h ARG 74 CO -0.16 0.56 -0.11 -0.22 -1.51 0.00 0.00 179.97 178.54 2npb h LYS 75 N 0.88 0.00 0.03 0.20 3.11 -1.15 0.13 116.57 119.76 2npb h LYS 75 Ca 0.37 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.94 2npb h LYS 75 Cb 0.31 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.50 2npb h LYS 75 CO -0.14 0.11 -1.50 -0.11 -2.81 0.00 0.00 179.45 174.99 2npb n LEU 76 N -3.94 2.05 -0.24 5.20 -0.00 -0.69 -3.33 117.00 116.05 2npb n LEU 76 Ca -0.02 0.37 -0.06 0.00 -0.00 0.00 0.00 56.01 56.29 2npb n LEU 76 Cb 0.20 -0.99 0.05 0.00 -0.00 0.00 0.00 43.42 42.67 2npb n LEU 76 CO 0.32 0.43 1.10 0.58 -0.00 0.00 0.00 177.39 179.81 2npb h VAL 77 N -0.75 1.21 -0.33 1.96 2.07 -0.86 -0.29 116.25 119.26 2npb h VAL 77 Ca -0.39 -0.50 -0.12 0.00 0.82 0.00 0.00 66.70 66.52 2npb h VAL 77 Cb 1.49 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2npb h VAL 77 CO -0.15 0.22 -0.28 0.74 0.02 0.00 0.00 177.57 178.12 2npb h THR 78 N 0.92 1.28 -0.02 2.57 2.02 -0.95 -0.45 112.91 118.28 2npb h THR 78 Ca 0.24 -1.38 -0.16 0.00 0.77 0.00 0.00 66.41 65.87 2npb h THR 78 Cb 0.02 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2npb h THR 78 CO -0.04 0.45 -0.73 0.00 0.37 0.00 0.00 175.52 175.57 2npb h ALA 79 N 1.11 0.74 0.04 6.16 0.00 -1.36 -1.13 119.26 124.83 2npb h ALA 79 Ca 0.07 -0.64 -0.24 0.00 0.00 0.00 0.00 54.91 54.10 2npb h ALA 79 Cb 0.77 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2npb h ALA 79 CO 0.06 0.85 -1.03 0.82 0.00 0.00 0.00 179.25 179.95 2npb h ILE 80 N 0.08 1.40 -0.54 0.00 1.08 -1.05 -1.70 117.51 116.78 2npb h ILE 80 Ca -0.02 -2.54 -0.07 0.00 -0.39 0.00 0.00 64.86 61.84 2npb h ILE 80 Cb 1.29 2.53 -0.02 0.00 -3.07 0.00 0.00 36.82 37.55 2npb h ILE 80 CO 0.10 0.76 0.06 0.50 -0.69 0.00 0.00 178.15 178.89 2npb h LYS 81 N 0.22 0.91 0.25 2.37 3.64 -0.80 0.21 116.57 123.37 2npb h LYS 81 Ca -0.10 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 2npb h LYS 81 Cb 1.69 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.41 2npb h LYS 81 CO 0.18 0.90 -0.12 0.00 -2.27 0.00 0.00 179.45 178.13 2npb h ALA 82 N 0.98 -0.34 -0.70 5.00 0.00 -1.28 -1.47 119.26 121.45 2npb h ALA 82 Ca 0.16 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2npb h ALA 82 Cb 0.44 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2npb h ALA 82 CO 0.02 -0.59 0.46 0.00 0.00 0.00 0.00 179.25 179.14 2npb h ALA 83 N 0.14 1.58 0.48 0.00 0.00 -1.10 -2.40 119.26 117.96 2npb h ALA 83 Ca -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2npb h ALA 83 Cb 0.40 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2npb h ALA 83 CO 0.06 0.36 -0.23 1.25 0.00 0.00 0.00 179.25 180.68 2npb h LEU 84 N 0.87 -0.55 -2.69 0.00 7.12 -0.56 -1.34 115.31 118.16 2npb h LEU 84 Ca 0.28 -0.07 0.01 0.00 0.13 0.00 0.00 57.88 58.22 2npb h LEU 84 Cb 0.03 0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 40.30 2npb h LEU 84 CO -0.07 -0.22 0.07 0.00 -0.13 0.00 0.00 178.44 178.09 2npb h ALA 85 N -0.53 1.22 0.03 1.25 0.00 -1.06 0.62 119.26 120.80 2npb h ALA 85 Ca -0.07 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 2npb h ALA 85 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2npb h ALA 85 CO 0.11 -0.08 -1.71 0.37 0.00 0.00 0.00 179.25 177.94 2npb h GLN 86 N 0.00 0.07 0.00 0.00 4.15 -1.33 -3.30 115.11 114.69 2npb h GLN 86 Ca 0.01 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.26 2npb h GLN 86 Cb 0.15 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 2npb h GLN 86 CO -0.00 0.71 -0.22 0.00 -1.93 0.00 0.00 178.83 177.39