#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2efi s SER 2 N 0.00 1.54 0.45 1.61 0.15 -1.26 -5.15 113.70 111.04 2efi s SER 2 Ca 0.00 -0.33 0.06 0.00 0.70 0.00 0.00 55.95 56.37 2efi s SER 2 Cb 0.00 0.34 -0.04 0.00 -1.71 0.00 0.00 66.02 64.61 2efi s SER 2 CO 0.00 -0.34 0.15 -0.44 1.20 0.00 0.00 173.24 173.81 2efi s SER 3 N 2.31 4.30 0.00 5.45 0.01 -1.26 -5.12 113.70 119.40 2efi s SER 3 Ca 0.07 -1.26 0.00 0.00 1.31 0.00 0.00 55.95 56.06 2efi s SER 3 Cb -0.16 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 65.93 2efi s SER 3 CO -0.15 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.44 2efi n GLY 4 N -1.28 1.26 3.61 3.44 0.00 -1.26 -5.19 105.19 105.78 2efi n GLY 4 Ca -0.05 0.50 -0.08 0.00 0.00 0.00 0.00 46.02 46.39 2efi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2efi s SER 5 N 0.00 -0.27 0.15 1.61 0.01 -1.26 -5.18 113.70 108.76 2efi s SER 5 Ca 0.00 0.35 0.05 0.00 1.31 0.00 0.00 55.95 57.65 2efi s SER 5 Cb 0.00 0.29 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 2efi s SER 5 CO 0.00 -0.22 0.14 -0.55 0.41 0.00 0.00 173.24 173.02 2efi s SER 6 N -0.84 5.57 -0.45 2.44 0.15 -1.26 -5.04 113.70 114.27 2efi s SER 6 Ca 0.02 -0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.62 2efi s SER 6 Cb -0.01 -1.47 0.43 0.00 -1.71 0.00 0.00 66.02 63.26 2efi s SER 6 CO -0.03 0.08 1.36 0.61 1.20 0.00 0.00 173.24 176.46 2efi n GLY 7 N -0.26 6.12 3.55 9.45 0.00 -1.26 -4.99 105.19 117.80 2efi n GLY 7 Ca -0.08 -2.64 -0.39 0.00 0.00 0.00 0.00 46.02 42.92 2efi n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2efi s MET 8 N -3.66 3.08 -0.18 1.61 0.23 -1.26 -4.92 119.30 114.20 2efi s MET 8 Ca 0.52 -0.26 -0.24 0.00 -1.03 0.00 0.00 55.69 54.68 2efi s MET 8 Cb 0.42 -4.61 0.06 0.00 -1.53 0.00 0.00 34.83 29.17 2efi s MET 8 CO -0.09 -2.45 0.64 0.00 -2.03 0.00 0.00 175.02 171.09 2efi s ALA 9 N 6.86 -1.60 1.00 3.16 0.00 -1.26 -5.18 121.76 124.74 2efi s ALA 9 Ca 0.49 1.60 0.00 0.00 0.00 0.00 0.00 51.96 54.05 2efi s ALA 9 Cb -0.07 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.34 2efi s ALA 9 CO 0.08 -0.32 0.00 -0.35 0.00 0.00 0.00 175.76 175.17 2efi n PRO 10 N 2.15 -0.55 -1.16 0.00 -0.04 -1.26 -4.85 135.00 129.28 2efi n PRO 10 Ca -0.16 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.13 2efi n PRO 10 Cb 0.56 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.89 2efi n PRO 10 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2efi n LYS 11 N -1.16 2.20 -0.00 0.54 3.00 -1.26 -4.10 118.16 117.38 2efi n LYS 11 Ca 0.00 -1.45 0.09 0.00 -0.00 0.00 0.00 58.31 56.95 2efi n LYS 11 Cb 0.00 -2.07 -0.11 0.00 0.00 0.00 0.00 35.03 32.84 2efi n LYS 11 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 2efi n GLN 12 N 2.06 0.56 -3.61 1.64 7.27 -1.26 -5.01 117.38 119.03 2efi n GLN 12 Ca 0.46 -0.02 -0.05 0.00 0.07 0.00 0.00 57.00 57.46 2efi n GLN 12 Cb 0.79 -1.43 -0.04 0.00 2.41 0.00 0.00 30.24 31.97 2efi n GLN 12 CO 0.00 0.00 0.00 0.16 0.07 0.00 0.00 177.06 177.29 2efi s ASP 13 N -2.97 -0.17 1.09 1.69 -4.77 -1.26 -5.16 116.67 105.12 2efi s ASP 13 Ca 0.06 0.16 -0.15 0.00 -3.30 0.00 0.00 52.55 49.32 2efi s ASP 13 Cb 0.15 0.15 0.23 0.00 -1.09 0.00 0.00 42.92 42.36 2efi s ASP 13 CO 0.80 -0.18 1.10 -2.16 0.70 0.00 0.00 175.17 175.43 2efi s PRO 14 N -1.28 -0.31 -0.09 2.11 0.04 -1.26 -4.98 135.00 129.23 2efi s PRO 14 Ca 0.05 0.26 0.02 0.00 0.04 0.00 0.00 61.00 61.37 2efi s PRO 14 Cb -0.01 -1.67 -0.02 0.00 0.04 0.00 0.00 34.50 32.84 2efi s PRO 14 CO -0.04 -3.17 -0.16 0.21 0.04 0.00 0.00 177.00 173.88 2efi s LYS 15 N -5.14 2.99 0.78 4.56 2.36 -1.26 -5.07 119.74 118.97 2efi s LYS 15 Ca 0.68 -0.73 -0.11 0.00 -2.55 0.00 0.00 55.97 53.26 2efi s LYS 15 Cb -0.15 -2.47 0.06 0.00 -1.05 0.00 0.00 37.83 34.22 2efi s LYS 15 CO 0.57 0.36 1.09 -1.25 1.55 0.00 0.00 175.35 177.67 2efi s PRO 16 N -0.04 2.17 -0.22 4.03 0.04 -1.26 -5.00 135.00 134.71 2efi s PRO 16 Ca -0.04 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.17 2efi s PRO 16 Cb -0.14 -1.89 -0.19 0.00 0.04 0.00 0.00 34.50 32.31 2efi s PRO 16 CO 0.04 -1.70 -0.08 1.63 0.04 0.00 0.00 177.00 176.94 2efi n LYS 17 N -3.56 0.67 -3.08 4.56 5.02 -1.26 -4.98 118.16 115.54 2efi n LYS 17 Ca 0.09 0.16 -0.25 0.00 -2.02 0.00 0.00 58.31 56.29 2efi n LYS 17 Cb 0.53 -1.56 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 2efi n LYS 17 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2efi s PHE 18 N -2.53 3.52 0.26 2.13 0.40 -1.26 -5.11 117.98 115.39 2efi s PHE 18 Ca -0.30 0.53 0.10 0.00 -0.60 0.00 0.00 56.93 56.66 2efi s PHE 18 Cb 0.08 -2.06 -0.05 0.00 0.51 0.00 0.00 43.02 41.50 2efi s PHE 18 CO 0.65 -0.05 -0.17 -0.65 0.70 0.00 0.00 175.22 175.71 2efi s GLN 19 N -4.49 1.58 0.39 0.44 -0.21 -1.26 -5.04 119.66 111.07 2efi s GLN 19 Ca 0.43 -1.72 -0.26 0.00 0.02 0.00 0.00 55.36 53.82 2efi s GLN 19 Cb -0.10 -1.55 -0.09 0.00 1.00 0.00 0.00 33.01 32.28 2efi s GLN 19 CO 0.40 0.26 1.25 -1.21 -2.12 0.00 0.00 175.29 173.87 2efi s GLU 20 N -3.56 4.07 0.00 2.91 8.01 -1.26 -2.63 118.70 126.24 2efi s GLU 20 Ca 0.28 2.05 0.00 0.00 0.01 0.00 0.00 54.97 57.31 2efi s GLU 20 Cb -0.03 -2.79 0.00 0.00 -4.31 0.00 0.00 34.13 27.00 2efi s GLU 20 CO 0.12 -0.37 0.00 0.41 0.01 0.00 0.00 175.26 175.44 2efi n GLY 21 N 0.70 2.37 3.68 -1.39 0.00 0.89 -4.98 105.19 106.46 2efi n GLY 21 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2efi n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2efi s GLU 22 N -0.34 4.30 0.34 1.61 2.12 -1.08 -4.84 118.70 120.80 2efi s GLU 22 Ca 0.00 0.86 -0.29 0.00 0.36 0.00 0.00 54.97 55.90 2efi s GLU 22 Cb 0.00 -3.55 -0.12 0.00 0.26 0.00 0.00 34.13 30.72 2efi s GLU 22 CO 0.00 -0.22 1.39 -2.13 -0.54 0.00 0.00 175.26 173.76 2efi n ARG 23 N 4.90 2.34 -3.82 4.30 0.63 -1.26 -2.40 116.66 121.35 2efi n ARG 23 Ca 0.01 0.82 -0.10 0.00 -0.92 0.00 0.00 57.85 57.67 2efi n ARG 23 Cb 0.50 -2.48 -0.05 0.00 0.45 0.00 0.00 32.46 30.88 2efi n ARG 23 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2efi s VAL 24 N -0.88 0.04 -0.30 5.15 -7.23 -0.08 -4.55 120.40 112.55 2efi s VAL 24 Ca 0.57 -0.99 -0.08 0.00 -1.81 0.00 0.00 61.98 59.67 2efi s VAL 24 Cb -0.54 -1.66 -0.00 0.00 0.56 0.00 0.00 36.38 34.74 2efi s VAL 24 CO 0.60 -0.19 0.10 -0.76 -0.31 0.00 0.00 175.10 174.54 2efi s LEU 25 N -2.90 3.89 0.12 1.32 1.43 -1.21 -2.21 118.68 119.11 2efi s LEU 25 Ca 0.12 -0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 52.59 2efi s LEU 25 Cb 0.01 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 2efi s LEU 25 CO -0.02 -0.18 0.34 0.00 0.23 0.00 0.00 176.35 176.73 2efi s PHE 27 N -1.60 3.08 -0.37 0.00 0.08 -1.09 -2.78 117.98 115.29 2efi s PHE 27 Ca 0.39 -0.72 0.06 0.00 0.12 0.00 0.00 56.93 56.78 2efi s PHE 27 Cb -0.12 -3.58 0.53 0.00 -0.57 0.00 0.00 43.02 39.28 2efi s PHE 27 CO 0.24 -1.05 1.60 1.58 -0.10 0.00 0.00 175.22 177.50 2efi n HIS 28 N 6.01 1.93 0.00 0.36 -0.00 -1.24 -5.05 115.22 117.23 2efi n HIS 28 Ca -0.08 -1.89 0.00 0.00 0.46 0.00 0.00 57.72 56.20 2efi n HIS 28 Cb 0.44 -0.69 0.00 0.00 -0.12 0.00 0.00 29.99 29.62 2efi n HIS 28 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2efi n GLY 29 N -1.07 0.72 0.00 1.57 0.00 -1.26 -4.79 105.19 100.36 2efi n GLY 29 Ca 0.44 -1.80 0.05 0.00 0.00 0.00 0.00 46.02 44.71 2efi n GLY 29 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2efi n PRO 30 N 0.00 0.49 -4.16 1.61 -0.04 -1.26 -4.73 135.00 126.91 2efi n PRO 30 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2efi n PRO 30 Cb 0.00 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.02 2efi n PRO 30 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2efi s LEU 31 N -1.67 1.94 0.21 1.53 1.43 -1.26 -4.92 118.68 115.94 2efi s LEU 31 Ca 0.16 -1.17 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 2efi s LEU 31 Cb 0.07 0.22 -0.04 0.00 0.03 0.00 0.00 46.19 46.47 2efi s LEU 31 CO 0.12 -0.68 0.42 -0.76 0.23 0.00 0.00 176.35 175.68 2efi s LEU 32 N -3.05 4.20 -0.02 1.79 1.43 -1.26 -3.64 118.68 118.13 2efi s LEU 32 Ca 0.21 0.46 0.01 0.00 -1.03 0.00 0.00 54.13 53.78 2efi s LEU 32 Cb 0.07 -3.24 0.02 0.00 0.03 0.00 0.00 46.19 43.07 2efi s LEU 32 CO 0.00 -0.07 -0.02 -0.31 0.23 0.00 0.00 176.35 176.19 2efi s TYR 33 N -1.90 0.35 0.06 0.29 1.51 -1.12 -4.91 117.35 111.64 2efi s TYR 33 Ca 0.39 -0.04 -0.30 0.00 -1.01 0.00 0.00 57.07 56.11 2efi s TYR 33 Cb -0.11 -0.36 -0.09 0.00 -0.11 0.00 0.00 41.96 41.29 2efi s TYR 33 CO 0.29 -0.09 1.86 -2.00 -1.11 0.00 0.00 175.55 174.50 2efi s GLU 34 N 0.61 4.15 0.27 -0.62 2.12 -1.26 -3.07 118.70 120.89 2efi s GLU 34 Ca -0.06 2.54 -0.08 0.00 0.36 0.00 0.00 54.97 57.73 2efi s GLU 34 Cb -0.09 -3.88 -0.01 0.00 0.26 0.00 0.00 34.13 30.41 2efi s GLU 34 CO -0.01 -0.88 0.43 0.00 -0.54 0.00 0.00 175.26 174.25 2efi s ALA 35 N 3.60 0.26 0.02 6.30 0.00 -0.94 -2.04 121.76 128.95 2efi s ALA 35 Ca 0.83 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 51.62 2efi s ALA 35 Cb -0.43 1.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 2efi s ALA 35 CO 0.38 -0.80 -0.06 0.21 0.00 0.00 0.00 175.76 175.49 2efi s LYS 36 N -3.75 0.46 -0.57 0.00 2.36 -1.24 -0.90 119.74 116.10 2efi s LYS 36 Ca 0.27 -0.44 -0.26 0.00 -2.55 0.00 0.00 55.97 52.99 2efi s LYS 36 Cb 0.01 -0.34 -0.05 0.00 -1.05 0.00 0.00 37.83 36.39 2efi s LYS 36 CO 0.13 0.08 2.19 0.00 1.55 0.00 0.00 175.35 179.29 2efi h VAL 38 N 7.38 1.35 -3.64 0.00 2.07 0.24 0.25 116.25 123.89 2efi h VAL 38 Ca -0.22 -2.16 -0.07 0.00 0.82 0.00 0.00 66.70 65.07 2efi h VAL 38 Cb 1.21 2.47 -0.11 0.00 -1.52 0.00 0.00 31.29 33.33 2efi h VAL 38 CO 1.18 0.65 -0.17 -0.54 0.02 0.00 0.00 177.57 178.70 2efi s LYS 39 N -3.28 1.26 -0.21 1.57 1.02 -1.08 -4.74 119.74 114.28 2efi s LYS 39 Ca -0.11 -1.06 -0.04 0.00 0.02 0.00 0.00 55.97 54.78 2efi s LYS 39 Cb 0.05 0.44 0.07 0.00 -0.52 0.00 0.00 37.83 37.87 2efi s LYS 39 CO 0.87 -0.50 0.08 0.08 -0.92 0.00 0.00 175.35 174.96 2efi s VAL 40 N -3.93 0.22 0.36 3.17 1.01 -1.26 0.07 120.40 120.04 2efi s VAL 40 Ca 0.14 -0.50 0.09 0.00 0.00 0.00 0.00 61.98 61.71 2efi s VAL 40 Cb 0.01 -0.89 -0.06 0.00 0.00 0.00 0.00 36.38 35.44 2efi s VAL 40 CO -0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 175.10 174.74 2efi s ALA 41 N 1.99 3.16 -0.09 5.51 0.00 -0.78 -4.98 121.76 126.57 2efi s ALA 41 Ca 0.02 -2.08 -0.03 0.00 0.00 0.00 0.00 51.96 49.87 2efi s ALA 41 Cb -0.17 -0.17 0.04 0.00 0.00 0.00 0.00 23.12 22.82 2efi s ALA 41 CO -0.14 0.01 0.07 0.42 0.00 0.00 0.00 175.76 176.12 2efi s ILE 42 N -2.59 -0.09 0.28 0.00 1.01 -1.26 0.05 121.20 118.60 2efi s ILE 42 Ca 0.35 0.22 -0.10 0.00 0.00 0.00 0.00 60.65 61.11 2efi s ILE 42 Cb 0.03 -0.31 0.00 0.00 0.01 0.00 0.00 42.46 42.20 2efi s ILE 42 CO 0.19 0.02 0.49 -1.59 0.00 0.00 0.00 174.94 174.05 2efi s LYS 43 N 2.15 1.68 -0.82 2.79 -2.85 -0.07 -4.90 119.74 117.73 2efi s LYS 43 Ca 0.04 -1.40 -0.03 0.00 -1.00 0.00 0.00 55.97 53.57 2efi s LYS 43 Cb -0.13 0.47 0.03 0.00 -2.06 0.00 0.00 37.83 36.14 2efi s LYS 43 CO -0.05 -0.71 0.15 -0.25 0.10 0.00 0.00 175.35 174.59 2efi n ASP 44 N -0.71 -2.82 -3.02 0.03 8.00 -1.26 0.79 116.55 117.57 2efi n ASP 44 Ca -0.01 0.08 -0.21 0.00 0.71 0.00 0.00 54.79 55.35 2efi n ASP 44 Cb 0.62 -2.43 0.05 0.00 -0.02 0.00 0.00 41.12 39.34 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2efi n LYS 45 N -2.99 -5.76 -3.72 -1.24 4.01 -1.26 -5.00 118.16 102.21 2efi n LYS 45 Ca -0.05 0.80 -0.14 0.00 -0.51 0.00 0.00 58.31 58.41 2efi n LYS 45 Cb 0.55 -5.56 -0.09 0.00 -0.51 0.00 0.00 35.03 29.43 2efi n LYS 45 CO 0.00 0.00 0.00 1.14 -1.11 0.00 0.00 177.40 177.43 2efi s GLN 46 N -5.87 0.67 -0.23 1.97 -2.07 0.24 -5.11 119.66 109.26 2efi s GLN 46 Ca 0.39 0.12 -0.15 0.00 -1.82 0.00 0.00 55.36 53.90 2efi s GLN 46 Cb -0.17 0.31 -0.04 0.00 -1.09 0.00 0.00 33.01 32.01 2efi s GLN 46 CO 0.49 -0.17 0.35 0.08 -1.32 0.00 0.00 175.29 174.72 2efi s VAL 47 N -0.83 5.22 0.41 3.63 1.01 -1.26 -0.89 120.40 127.69 2efi s VAL 47 Ca -0.09 0.58 0.07 0.00 0.00 0.00 0.00 61.98 62.54 2efi s VAL 47 Cb -0.04 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2efi s VAL 47 CO 0.04 0.24 0.18 -0.54 0.00 0.00 0.00 175.10 175.03 2efi s LYS 48 N 1.47 2.24 -0.16 2.72 -0.14 0.11 -2.29 119.74 123.68 2efi s LYS 48 Ca 0.16 -1.82 -0.06 0.00 -1.36 0.00 0.00 55.97 52.89 2efi s LYS 48 Cb -0.15 -2.00 0.08 0.00 -1.68 0.00 0.00 37.83 34.07 2efi s LYS 48 CO 0.08 -0.11 0.33 0.71 -0.76 0.00 0.00 175.35 175.60 2efi s TYR 49 N -2.59 -0.58 -0.50 3.18 1.51 0.29 -1.87 117.35 116.79 2efi s TYR 49 Ca 0.41 1.20 -0.27 0.00 -1.01 0.00 0.00 57.07 57.41 2efi s TYR 49 Cb 0.03 0.11 -0.04 0.00 -0.11 0.00 0.00 41.96 41.95 2efi s TYR 49 CO 0.23 -0.41 2.12 0.12 -1.11 0.00 0.00 175.55 176.50 2efi s PHE 50 N 2.50 1.38 0.41 2.71 5.36 0.11 -2.44 117.98 128.01 2efi s PHE 50 Ca 0.00 1.10 -0.16 0.00 -0.96 0.00 0.00 56.93 56.91 2efi s PHE 50 Cb -0.12 -3.86 -0.09 0.00 -0.34 0.00 0.00 43.02 38.62 2efi s PHE 50 CO -0.10 -2.61 0.85 0.42 -1.46 0.00 0.00 175.22 172.32 2efi s ILE 51 N 10.19 4.60 -0.33 3.12 -1.09 -1.11 0.94 121.20 137.51 2efi s ILE 51 Ca 0.84 1.06 -0.00 0.00 -2.23 0.00 0.00 60.65 60.32 2efi s ILE 51 Cb -0.17 -3.66 0.11 0.00 -1.58 0.00 0.00 42.46 37.15 2efi s ILE 51 CO 0.25 -0.41 0.11 -2.28 -1.23 0.00 0.00 174.94 171.39 2efi s HIS 52 N -2.27 1.89 -0.28 3.97 5.65 -1.15 -4.23 115.29 118.87 2efi s HIS 52 Ca 0.56 -1.92 -0.30 0.00 0.25 0.00 0.00 55.06 53.65 2efi s HIS 52 Cb -0.10 -1.82 -0.07 0.00 -1.18 0.00 0.00 32.58 29.41 2efi s HIS 52 CO 0.23 -0.87 2.23 0.66 -0.65 0.00 0.00 174.74 176.34 2efi n TYR 53 N 4.62 1.81 -0.98 3.88 4.01 -1.26 -3.61 117.16 125.63 2efi n TYR 53 Ca 0.00 0.01 -0.38 0.00 -0.16 0.00 0.00 57.90 57.38 2efi n TYR 53 Cb 0.41 -2.66 -0.10 0.00 -0.31 0.00 0.00 39.34 36.68 2efi n TYR 53 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2efi n SER 54 N 11.36 0.40 0.00 7.72 2.88 -0.87 -4.69 113.62 130.42 2efi n SER 54 Ca 0.34 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 58.22 2efi n SER 54 Cb 0.38 -0.65 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 2efi n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2efi n GLY 55 N 5.11 -0.85 0.02 0.46 0.00 -1.26 -5.00 105.19 103.66 2efi n GLY 55 Ca 0.43 -1.09 0.11 0.00 0.00 0.00 0.00 46.02 45.47 2efi n GLY 55 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2efi n TRP 56 N -0.30 0.12 0.30 1.61 7.02 -1.26 -4.45 117.44 120.46 2efi n TRP 56 Ca 0.00 0.03 -0.13 0.00 -1.02 0.00 0.00 57.50 56.38 2efi n TRP 56 Cb 0.00 -0.31 -0.07 0.00 -2.42 0.00 0.00 31.31 28.51 2efi n TRP 56 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 2efi h ASN 57 N 0.00 -0.67 -4.55 -0.99 2.35 -1.94 -3.45 115.58 106.33 2efi h ASN 57 Ca 0.00 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.60 2efi h ASN 57 Cb 0.72 0.17 -0.09 0.00 0.05 0.00 0.00 38.32 39.17 2efi h ASN 57 CO 0.00 -0.28 -0.21 2.29 -1.65 0.00 0.00 177.43 177.58 2efi n LYS 58 N -5.31 -1.91 -0.10 0.81 2.85 -1.26 -4.65 118.16 108.59 2efi n LYS 58 Ca -0.11 0.03 -0.13 0.00 -1.05 0.00 0.00 58.31 57.06 2efi n LYS 58 Cb 0.33 -3.27 -0.11 0.00 -0.65 0.00 0.00 35.03 31.32 2efi n LYS 58 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2efi n ASN 59 N -1.22 1.75 -2.11 -5.58 5.03 -1.26 -4.45 115.26 107.42 2efi n ASN 59 Ca 0.03 -0.07 -0.20 0.00 0.87 0.00 0.00 54.58 55.20 2efi n ASN 59 Cb 0.35 0.12 0.18 0.00 -1.02 0.00 0.00 39.78 39.41 2efi n ASN 59 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 2efi n TRP 60 N -2.95 2.78 -0.61 3.10 -0.00 -1.26 -5.00 117.44 113.50 2efi n TRP 60 Ca -0.35 -1.68 -0.31 0.00 -0.00 0.00 0.00 57.50 55.17 2efi n TRP 60 Cb 0.96 -0.87 0.20 0.00 -0.00 0.00 0.00 31.31 31.60 2efi n TRP 60 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 2efi n ASP 61 N -0.92 -1.82 -3.95 5.87 5.68 -1.26 -5.05 116.55 115.10 2efi n ASP 61 Ca 0.53 -0.02 -0.09 0.00 -0.50 0.00 0.00 54.79 54.71 2efi n ASP 61 Cb 1.56 -1.16 -0.05 0.00 -1.14 0.00 0.00 41.12 40.32 2efi n ASP 61 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 2efi s GLU 62 N -3.96 1.47 -0.05 0.11 4.04 -1.26 -5.10 118.70 113.95 2efi s GLU 62 Ca 0.62 -1.18 -0.03 0.00 0.04 0.00 0.00 54.97 54.43 2efi s GLU 62 Cb -0.20 0.47 -0.04 0.00 0.02 0.00 0.00 34.13 34.39 2efi s GLU 62 CO 0.65 -0.61 0.08 -1.58 -1.84 0.00 0.00 175.26 171.97 2efi s TRP 63 N -3.99 3.36 0.07 4.83 0.52 -1.26 -2.77 118.94 119.70 2efi s TRP 63 Ca 0.19 0.30 0.05 0.00 0.02 0.00 0.00 56.10 56.66 2efi s TRP 63 Cb -0.00 -1.81 -0.03 0.00 -1.15 0.00 0.00 33.47 30.48 2efi s TRP 63 CO 0.06 0.59 -0.13 0.14 0.02 0.00 0.00 176.95 177.63 2efi s VAL 64 N -1.09 1.04 0.00 4.03 -7.23 -1.02 -4.92 120.40 111.20 2efi s VAL 64 Ca 0.19 -1.34 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2efi s VAL 64 Cb -0.12 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.75 2efi s VAL 64 CO 0.09 -0.29 0.00 -0.81 -0.31 0.00 0.00 175.10 173.78 2efi n PRO 65 N 1.17 -0.08 0.00 4.82 -0.04 -1.26 0.10 135.00 139.71 2efi n PRO 65 Ca -0.20 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.38 2efi n PRO 65 Cb 0.55 0.00 0.28 0.00 -0.04 0.00 0.00 33.50 34.28 2efi n PRO 65 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2efi n GLU 66 N -0.81 0.22 0.01 0.54 2.13 -0.97 -3.84 120.64 117.91 2efi n GLU 66 Ca 0.00 -0.13 0.01 0.00 0.66 0.00 0.00 57.16 57.71 2efi n GLU 66 Cb 0.00 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.11 2efi n GLU 66 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2efi n SER 67 N -1.28 0.54 -1.02 4.31 7.64 -1.26 -4.00 113.62 118.55 2efi n SER 67 Ca 0.07 0.23 0.03 0.00 1.01 0.00 0.00 58.87 60.22 2efi n SER 67 Cb 0.34 0.69 0.17 0.00 -1.01 0.00 0.00 64.21 64.40 2efi n SER 67 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2efi n ARG 68 N -2.72 2.53 -4.45 1.43 1.74 -1.25 -4.81 116.66 109.13 2efi n ARG 68 Ca -0.12 -1.32 -0.21 0.00 -0.77 0.00 0.00 57.85 55.43 2efi n ARG 68 Cb 0.82 -1.74 -0.15 0.00 -1.02 0.00 0.00 32.46 30.37 2efi n ARG 68 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2efi s VAL 69 N -1.73 0.87 0.23 1.55 1.01 -1.26 -2.68 120.40 118.40 2efi s VAL 69 Ca 0.23 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 61.89 2efi s VAL 69 Cb 0.17 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2efi s VAL 69 CO 0.08 0.27 0.03 -0.76 0.00 0.00 0.00 175.10 174.72 2efi s LEU 70 N 0.16 3.34 0.00 3.92 1.43 -0.92 -4.91 118.68 121.69 2efi s LEU 70 Ca -0.03 -0.50 0.19 0.00 -1.03 0.00 0.00 54.13 52.77 2efi s LEU 70 Cb -0.09 -1.90 1.02 0.00 0.03 0.00 0.00 46.19 45.25 2efi s LEU 70 CO 0.01 0.02 1.59 0.29 0.23 0.00 0.00 176.35 178.49 2efi n LYS 71 N -0.69 0.35 -3.58 1.70 4.01 -1.26 -3.31 118.16 115.37 2efi n LYS 71 Ca -0.08 0.08 -0.23 0.00 -0.51 0.00 0.00 58.31 57.58 2efi n LYS 71 Cb 0.58 -1.50 0.05 0.00 -0.51 0.00 0.00 35.03 33.64 2efi n LYS 71 CO 0.00 0.00 0.00 0.98 -1.11 0.00 0.00 177.40 177.27 2efi n TYR 72 N -1.23 -2.05 -4.26 2.13 4.19 -1.26 -4.86 117.16 109.82 2efi n TYR 72 Ca 0.10 0.74 -0.23 0.00 3.31 0.00 0.00 57.90 61.82 2efi n TYR 72 Cb 0.14 -4.10 -0.07 0.00 0.49 0.00 0.00 39.34 35.80 2efi n TYR 72 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2efi s VAL 73 N -3.54 3.42 0.21 2.97 -7.23 -1.26 -4.88 120.40 110.10 2efi s VAL 73 Ca 0.24 -1.86 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2efi s VAL 73 Cb -0.06 -2.89 0.28 0.00 0.56 0.00 0.00 36.38 34.27 2efi s VAL 73 CO 0.81 -0.35 1.04 0.47 -0.31 0.00 0.00 175.10 176.76 2efi n ASP 74 N -0.94 -0.06 0.48 4.85 9.92 -1.26 0.31 116.55 129.84 2efi n ASP 74 Ca -0.06 1.13 -0.19 0.00 -0.53 0.00 0.00 54.79 55.14 2efi n ASP 74 Cb 0.59 -0.42 -0.09 0.00 -0.64 0.00 0.00 41.12 40.56 2efi n ASP 74 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2efi h THR 75 N 0.00 0.00 -0.79 -3.53 2.02 -2.01 -2.69 112.91 105.90 2efi h THR 75 Ca 0.41 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.70 2efi h THR 75 Cb 0.86 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.19 2efi h THR 75 CO -0.62 0.00 0.42 0.78 0.37 0.00 0.00 175.52 176.47 2efi h ASN 76 N -1.23 0.55 -0.79 4.18 2.35 -0.53 -1.44 115.58 118.68 2efi h ASN 76 Ca -0.12 0.07 0.18 0.00 -0.55 0.00 0.00 56.30 55.87 2efi h ASN 76 Cb 0.94 -0.03 -0.11 0.00 0.05 0.00 0.00 38.32 39.17 2efi h ASN 76 CO 0.20 0.29 0.25 -0.07 -1.65 0.00 0.00 177.43 176.45 2efi h LEU 77 N 0.67 0.12 -1.97 1.61 3.38 -0.46 0.51 115.31 119.17 2efi h LEU 77 Ca 0.40 0.15 0.18 0.00 0.09 0.00 0.00 57.88 58.70 2efi h LEU 77 Cb 0.45 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2efi h LEU 77 CO -0.29 -0.02 0.52 0.06 0.09 0.00 0.00 178.44 178.80 2efi h GLN 78 N 0.32 0.00 0.00 1.13 -0.00 -0.92 -1.99 115.11 113.65 2efi h GLN 78 Ca 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 59.06 2efi h GLN 78 Cb 0.80 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.27 2efi h GLN 78 CO -0.51 0.00 -0.32 -0.22 -0.00 0.00 0.00 178.83 177.78 2efi h LYS 79 N 0.00 0.00 -1.38 0.06 3.64 -0.08 -2.86 116.57 115.96 2efi h LYS 79 Ca 0.30 0.00 0.46 0.00 -1.27 0.00 0.00 60.65 60.14 2efi h LYS 79 Cb 1.33 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 33.02 2efi h LYS 79 CO -0.00 0.65 0.90 0.37 -2.27 0.00 0.00 179.45 179.10 2efi h GLN 80 N -1.00 0.05 0.00 1.90 -0.00 -0.64 0.21 115.11 115.63 2efi h GLN 80 Ca -0.07 -0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.53 2efi h GLN 80 Cb 0.77 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 28.24 2efi h GLN 80 CO -0.05 0.03 -0.23 0.07 0.00 0.00 0.00 178.83 178.65 2efi h ARG 81 N 0.05 0.00 -1.25 1.69 0.11 -1.59 -2.80 114.38 110.58 2efi h ARG 81 Ca 0.85 0.00 0.36 0.00 0.10 0.00 0.00 59.98 61.29 2efi h ARG 81 Cb 2.74 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 33.74 2efi h ARG 81 CO -0.42 0.92 0.86 1.05 0.10 0.00 0.00 179.97 182.49 2efi h GLU 82 N -1.00 0.12 0.03 0.08 4.11 -0.40 0.67 114.58 118.19 2efi h GLU 82 Ca -0.06 -0.01 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 2efi h GLU 82 Cb 0.98 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 2efi h GLU 82 CO -0.04 0.08 -0.44 -0.07 0.07 0.00 0.00 179.01 178.61 2efi h LEU 83 N 0.12 0.10 -2.31 3.06 3.38 -1.26 -1.17 115.31 117.24 2efi h LEU 83 Ca 0.65 -0.90 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2efi h LEU 83 Cb 2.26 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.98 2efi h LEU 83 CO -0.15 1.19 -0.03 1.56 0.09 0.00 0.00 178.44 181.10 2efi h GLN 84 N -0.85 0.00 0.00 1.13 4.20 -0.69 -2.17 115.11 116.72 2efi h GLN 84 Ca -0.10 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.32 2efi h GLN 84 Cb 1.21 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.93 2efi h GLN 84 CO -0.01 0.03 -2.01 0.36 -0.67 0.00 0.00 178.83 176.54 2efi n LYS 85 N -3.28 0.66 -0.16 1.46 -0.00 0.21 -4.32 118.16 112.74 2efi n LYS 85 Ca -0.02 0.11 -0.09 0.00 -0.00 0.00 0.00 58.31 58.31 2efi n LYS 85 Cb 0.17 -1.65 -0.00 0.00 -0.00 0.00 0.00 35.03 33.55 2efi n LYS 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2efi h ALA 86 N 1.13 0.60 -3.43 0.58 0.00 -0.58 -3.38 119.26 114.18 2efi h ALA 86 Ca -0.37 -0.21 -0.64 0.00 0.00 0.00 0.00 54.91 53.69 2efi h ALA 86 Cb 1.99 -0.17 -0.40 0.00 0.00 0.00 0.00 17.79 19.20 2efi h ALA 86 CO 0.05 0.30 -0.68 -0.80 0.00 0.00 0.00 179.25 178.12 2efi s ASN 87 N -6.11 4.38 -0.04 0.00 0.01 -0.98 -4.96 114.94 107.26 2efi s ASN 87 Ca -0.13 -2.60 -0.24 0.00 -0.71 0.00 0.00 52.86 49.18 2efi s ASN 87 Cb 0.11 -1.53 -0.22 0.00 0.41 0.00 0.00 41.25 40.02 2efi s ASN 87 CO 0.79 -0.30 1.08 1.56 -1.51 0.00 0.00 177.10 178.72 2efi h GLN 88 N 6.99 0.19 -0.44 -0.60 7.50 -1.75 -2.66 115.11 124.35 2efi h GLN 88 Ca -0.06 -0.18 -0.01 0.00 0.50 0.00 0.00 58.65 58.90 2efi h GLN 88 Cb 0.95 0.05 -0.02 0.00 0.05 0.00 0.00 27.48 28.50 2efi h GLN 88 CO 0.60 0.88 0.25 0.93 -1.50 0.00 0.00 178.83 179.99 2efi h GLU 89 N -0.43 0.60 -0.86 1.46 4.39 -1.94 0.25 114.58 118.04 2efi h GLU 89 Ca -0.02 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2efi h GLU 89 Cb 0.95 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.43 2efi h GLU 89 CO 0.05 0.46 0.55 1.96 -1.16 0.00 0.00 179.01 180.87 2efi h GLN 90 N 0.57 1.15 -0.12 2.33 4.20 -1.98 -1.02 115.11 120.25 2efi h GLN 90 Ca 0.15 -0.08 -0.19 0.00 0.06 0.00 0.00 58.65 58.59 2efi h GLN 90 Cb 0.03 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.55 2efi h GLN 90 CO -0.03 0.78 -0.71 -0.92 -0.67 0.00 0.00 178.83 177.29 2efi h TYR 91 N 1.18 0.74 0.62 2.96 3.20 -1.13 -3.28 116.97 121.26 2efi h TYR 91 Ca 0.31 -0.31 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2efi h TYR 91 Cb -0.10 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.06 2efi h TYR 91 CO -0.01 1.09 -0.30 0.00 -1.64 0.00 0.00 178.16 177.30 2efi h ALA 92 N 0.83 -1.09 -0.76 1.82 0.00 -0.09 -3.15 119.26 116.82 2efi h ALA 92 Ca -0.03 -0.18 0.15 0.00 0.00 0.00 0.00 54.91 54.84 2efi h ALA 92 Cb 1.29 0.32 -0.14 0.00 0.00 0.00 0.00 17.79 19.27 2efi h ALA 92 CO 0.13 -1.03 -0.21 0.39 0.00 0.00 0.00 179.25 178.53 2efi n GLU 93 N -4.51 -0.09 -0.67 0.00 1.02 -0.42 0.21 120.64 116.18 2efi n GLU 93 Ca -0.10 1.18 -0.09 0.00 -0.02 0.00 0.00 57.16 58.13 2efi n GLU 93 Cb 0.33 -1.76 0.02 0.00 -0.02 0.00 0.00 31.44 30.01 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2efi n GLY 94 N -1.46 3.29 3.56 0.62 0.00 -1.19 -4.78 105.19 105.23 2efi n GLY 94 Ca 0.11 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 2efi n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2efi s LYS 95 N -0.95 0.73 0.48 1.61 1.02 0.58 -5.02 119.74 118.18 2efi s LYS 95 Ca 0.16 0.97 -0.22 0.00 0.02 0.00 0.00 55.97 56.91 2efi s LYS 95 Cb 0.13 0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 37.66 2efi s LYS 95 CO 0.00 -0.11 1.13 -1.64 -0.92 0.00 0.00 175.35 173.82 2efi s MET 96 N 0.70 3.70 -0.03 1.68 -1.94 -1.26 -4.88 119.30 117.26 2efi s MET 96 Ca -0.03 1.67 -0.07 0.00 -1.71 0.00 0.00 55.69 55.56 2efi s MET 96 Cb -0.05 -2.29 -0.02 0.00 2.01 0.00 0.00 34.83 34.48 2efi s MET 96 CO -0.05 -0.58 -0.13 -2.13 -0.01 0.00 0.00 175.02 172.12 2efi n ARG 97 N -0.70 0.20 -1.35 2.03 0.63 -1.26 -5.13 116.66 111.09 2efi n ARG 97 Ca 0.08 0.08 0.15 0.00 -0.92 0.00 0.00 57.85 57.25 2efi n ARG 97 Cb 0.49 -0.79 -0.08 0.00 0.45 0.00 0.00 32.46 32.53 2efi n ARG 97 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2efi n GLY 98 N 2.51 -2.92 3.34 5.14 0.00 -1.26 -4.53 105.19 107.48 2efi n GLY 98 Ca -0.05 -0.88 -0.55 0.00 0.00 0.00 0.00 46.02 44.53 2efi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2efi n ALA 99 N -4.17 0.64 -0.68 4.61 0.00 -1.26 -5.33 120.51 114.33 2efi n ALA 99 Ca -0.08 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2efi n ALA 99 Cb 0.61 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2efi n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50