#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 3.15 -0.71 1.61 1.04 -1.26 -5.09 113.70 112.45 2efi s SER 2 Ca 0.00 -0.51 -0.13 0.00 0.48 0.00 0.00 55.95 55.79 2efi s SER 2 Cb 0.00 -1.04 0.19 0.00 0.10 0.00 0.00 66.02 65.27 2efi s SER 2 CO 0.00 0.22 0.64 -0.55 0.98 0.00 0.00 173.24 174.54 2efi s SER 3 N -0.02 6.42 -0.35 7.02 0.15 -1.26 -4.75 113.70 120.92 2efi s SER 3 Ca -0.08 -2.43 -0.07 0.00 0.70 0.00 0.00 55.95 54.08 2efi s SER 3 Cb -0.15 -2.17 0.01 0.00 -1.71 0.00 0.00 66.02 62.00 2efi s SER 3 CO 0.05 -0.64 0.26 0.61 1.20 0.00 0.00 173.24 174.73 2efi n GLY 4 N 4.32 -2.90 3.38 9.45 0.00 -1.26 -4.67 105.19 113.51 2efi n GLY 4 Ca 0.05 0.79 -0.51 0.00 0.00 0.00 0.00 46.02 46.35 2efi n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2efi n SER 5 N 0.22 0.64 -2.39 1.61 3.41 -1.26 -4.78 113.62 111.07 2efi n SER 5 Ca 0.05 0.42 -0.34 0.00 -0.26 0.00 0.00 58.87 58.74 2efi n SER 5 Cb 0.20 -0.94 0.06 0.00 -0.26 0.00 0.00 64.21 63.27 2efi n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2efi n SER 6 N 9.13 7.07 -1.43 4.04 2.88 -1.26 -4.85 113.62 129.20 2efi n SER 6 Ca 0.59 -3.79 0.00 0.00 -1.33 0.00 0.00 58.87 54.34 2efi n SER 6 Cb 0.02 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 62.61 2efi n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2efi n GLY 7 N -0.80 0.56 1.47 0.46 0.00 -1.26 -5.04 105.19 100.59 2efi n GLY 7 Ca 0.57 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2efi n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2efi n MET 8 N -1.28 0.00 -1.70 1.61 2.81 -1.26 -5.08 117.12 112.21 2efi n MET 8 Ca 0.00 0.00 -0.36 0.00 -1.81 0.00 0.00 57.70 55.53 2efi n MET 8 Cb 0.48 -0.26 0.07 0.00 -0.71 0.00 0.00 33.22 32.79 2efi n MET 8 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2efi s ALA 9 N -2.00 2.33 1.12 3.04 0.00 -1.26 -5.01 121.76 119.99 2efi s ALA 9 Ca 0.00 1.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.88 2efi s ALA 9 Cb 0.00 -3.51 0.25 0.00 0.00 0.00 0.00 23.12 19.85 2efi s ALA 9 CO 0.00 -1.60 1.10 -1.25 0.00 0.00 0.00 175.76 174.01 2efi s PRO 10 N -3.52 -0.56 -0.31 0.00 0.04 -1.26 -4.91 135.00 124.48 2efi s PRO 10 Ca 0.79 0.16 -0.04 0.00 0.04 0.00 0.00 61.00 61.95 2efi s PRO 10 Cb -0.34 -1.65 -0.03 0.00 0.04 0.00 0.00 34.50 32.52 2efi s PRO 10 CO 0.40 -3.32 2.98 1.17 0.04 0.00 0.00 177.00 178.27 2efi n LYS 11 N -4.53 2.24 -2.46 4.56 3.00 -1.26 -4.39 118.16 115.33 2efi n LYS 11 Ca 0.10 -1.90 -0.19 0.00 -0.00 0.00 0.00 58.31 56.32 2efi n LYS 11 Cb 0.59 -2.07 0.02 0.00 0.00 0.00 0.00 35.03 33.57 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 1.33 2.74 -3.91 1.64 -0.06 -1.26 -5.05 117.38 112.81 2efi n GLN 12 Ca 0.46 -4.01 -0.11 0.00 -2.00 0.00 0.00 57.00 51.34 2efi n GLN 12 Cb 0.66 -1.95 -0.12 0.00 -4.06 0.00 0.00 30.24 24.77 2efi n GLN 12 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2efi s ASP 13 N -3.50 0.07 0.92 1.69 1.11 -1.26 -5.11 116.67 110.60 2efi s ASP 13 Ca 0.41 -0.19 -0.12 0.00 0.18 0.00 0.00 52.55 52.83 2efi s ASP 13 Cb 0.40 0.13 0.15 0.00 1.07 0.00 0.00 42.92 44.67 2efi s ASP 13 CO -0.06 -0.21 1.09 -2.16 1.18 0.00 0.00 175.17 175.01 2efi s PRO 14 N -0.86 1.03 -0.13 8.23 0.04 -1.26 -5.05 135.00 137.00 2efi s PRO 14 Ca -0.09 0.74 -0.02 0.00 0.04 0.00 0.00 61.00 61.66 2efi s PRO 14 Cb -0.06 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 2efi s PRO 14 CO -0.00 -2.38 -0.05 0.21 0.04 0.00 0.00 177.00 174.83 2efi s LYS 15 N -4.94 3.41 0.67 4.56 2.47 -1.26 -5.06 119.74 119.59 2efi s LYS 15 Ca 0.64 -0.53 -0.14 0.00 -1.56 0.00 0.00 55.97 54.38 2efi s LYS 15 Cb -0.18 -2.82 0.01 0.00 -1.46 0.00 0.00 37.83 33.38 2efi s LYS 15 CO 0.57 0.36 1.11 -1.25 0.16 0.00 0.00 175.35 176.30 2efi s PRO 16 N 0.02 2.73 -0.25 4.03 0.04 -1.26 -5.00 135.00 135.30 2efi s PRO 16 Ca 0.00 1.37 -0.09 0.00 0.04 0.00 0.00 61.00 62.32 2efi s PRO 16 Cb -0.13 -1.94 -0.16 0.00 0.04 0.00 0.00 34.50 32.31 2efi s PRO 16 CO 0.03 -1.30 -0.18 1.63 0.04 0.00 0.00 177.00 177.21 2efi n LYS 17 N -2.56 0.62 -2.97 4.56 5.02 -1.26 -4.97 118.16 116.60 2efi n LYS 17 Ca 0.10 0.26 -0.32 0.00 -2.02 0.00 0.00 58.31 56.33 2efi n LYS 17 Cb 0.52 -1.55 -0.05 0.00 -0.02 0.00 0.00 35.03 33.93 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 -2.50 3.39 0.32 2.13 0.40 -1.26 -5.09 117.98 115.37 2efi s PHE 18 Ca -0.35 1.25 0.09 0.00 -0.60 0.00 0.00 56.93 57.32 2efi s PHE 18 Cb 0.11 -2.58 -0.04 0.00 0.51 0.00 0.00 43.02 41.02 2efi s PHE 18 CO 0.56 -0.02 0.09 -0.65 0.70 0.00 0.00 175.22 175.91 2efi s GLN 19 N -3.29 2.35 -0.01 0.44 -0.21 -1.26 -5.03 119.66 112.65 2efi s GLN 19 Ca 0.55 -1.50 -0.30 0.00 0.02 0.00 0.00 55.36 54.12 2efi s GLN 19 Cb -0.10 -2.17 -0.05 0.00 1.00 0.00 0.00 33.01 31.69 2efi s GLN 19 CO 0.21 0.20 1.28 -1.21 -2.12 0.00 0.00 175.29 173.64 2efi s GLU 20 N -3.79 4.34 0.00 2.91 2.02 -1.26 -2.94 118.70 119.98 2efi s GLU 20 Ca 0.35 1.81 0.00 0.00 0.02 0.00 0.00 54.97 57.15 2efi s GLU 20 Cb -0.04 -3.51 0.00 0.00 0.10 0.00 0.00 34.13 30.68 2efi s GLU 20 CO 0.22 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.45 2efi n GLY 21 N 3.44 2.86 3.69 -1.39 0.00 0.10 -5.01 105.19 108.88 2efi n GLY 21 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.52 4.41 0.47 1.61 2.12 -1.15 -4.81 118.70 120.82 2efi s GLU 22 Ca 0.00 1.24 -0.24 0.00 0.36 0.00 0.00 54.97 56.33 2efi s GLU 22 Cb 0.00 -3.53 -0.08 0.00 0.26 0.00 0.00 34.13 30.78 2efi s GLU 22 CO 0.00 -0.25 1.30 -2.13 -0.54 0.00 0.00 175.26 173.64 2efi n ARG 23 N 4.81 1.86 -3.80 4.30 0.63 -1.26 -2.19 116.66 121.01 2efi n ARG 23 Ca 0.06 0.67 -0.10 0.00 -0.92 0.00 0.00 57.85 57.57 2efi n ARG 23 Cb 0.49 -2.46 -0.05 0.00 0.45 0.00 0.00 32.46 30.90 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 -1.24 0.04 -0.19 5.15 -7.23 0.30 -4.35 120.40 112.88 2efi s VAL 24 Ca 0.64 -0.95 -0.03 0.00 -1.81 0.00 0.00 61.98 59.84 2efi s VAL 24 Cb -0.47 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 2efi s VAL 24 CO 0.55 -0.18 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.35 2efi s LEU 25 N -2.90 2.91 0.11 1.32 1.43 -1.24 -2.00 118.68 118.31 2efi s LEU 25 Ca 0.11 -0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 2efi s LEU 25 Cb 0.00 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.45 2efi s LEU 25 CO -0.02 0.04 0.30 0.00 0.23 0.00 0.00 176.35 176.90 2efi s PHE 27 N -1.60 3.10 -0.29 0.00 0.08 -1.04 -2.81 117.98 115.42 2efi s PHE 27 Ca 0.38 -0.69 0.11 0.00 0.12 0.00 0.00 56.93 56.85 2efi s PHE 27 Cb -0.12 -3.48 0.66 0.00 -0.57 0.00 0.00 43.02 39.50 2efi s PHE 27 CO 0.26 -0.99 1.67 1.58 -0.10 0.00 0.00 175.22 177.64 2efi n HIS 28 N 5.91 1.91 0.00 0.36 -0.00 -1.22 -5.05 115.22 117.13 2efi n HIS 28 Ca -0.08 -1.21 0.00 0.00 -0.00 0.00 0.00 57.72 56.42 2efi n HIS 28 Cb 0.45 -0.58 0.00 0.00 -0.00 0.00 0.00 29.99 29.86 2efi n HIS 28 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2efi n GLY 29 N -0.42 0.39 0.00 1.57 0.00 -1.26 -4.74 105.19 100.74 2efi n GLY 29 Ca 0.36 -1.75 0.05 0.00 0.00 0.00 0.00 46.02 44.68 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 -3.99 1.61 -0.04 -1.26 -4.68 135.00 127.13 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 -1.32 -0.11 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 -1.65 2.22 0.38 1.53 1.43 -1.26 -4.88 118.68 116.45 2efi s LEU 31 Ca 0.15 -0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 52.76 2efi s LEU 31 Cb 0.07 0.04 -0.04 0.00 0.03 0.00 0.00 46.19 46.29 2efi s LEU 31 CO 0.12 -0.25 0.64 -0.76 0.23 0.00 0.00 176.35 176.32 2efi s LEU 32 N -1.34 3.89 0.01 1.79 1.43 -1.26 -3.46 118.68 119.75 2efi s LEU 32 Ca -0.13 0.71 0.01 0.00 -1.03 0.00 0.00 54.13 53.69 2efi s LEU 32 Cb -0.09 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2efi s LEU 32 CO -0.01 -0.36 -0.05 -0.31 0.23 0.00 0.00 176.35 175.85 2efi s TYR 33 N -2.39 0.41 0.19 0.29 1.51 -1.12 -4.86 117.35 111.37 2efi s TYR 33 Ca 0.44 -0.25 -0.30 0.00 -1.01 0.00 0.00 57.07 55.95 2efi s TYR 33 Cb -0.10 -0.26 -0.08 0.00 -0.11 0.00 0.00 41.96 41.41 2efi s TYR 33 CO 0.37 -0.05 1.21 -2.00 -1.11 0.00 0.00 175.55 173.96 2efi s GLU 34 N -0.71 4.48 0.30 -0.62 2.12 -1.26 -2.83 118.70 120.17 2efi s GLU 34 Ca -0.04 1.90 -0.19 0.00 0.36 0.00 0.00 54.97 57.00 2efi s GLU 34 Cb -0.05 -3.23 0.06 0.00 0.26 0.00 0.00 34.13 31.17 2efi s GLU 34 CO -0.00 -0.10 0.87 0.00 -0.54 0.00 0.00 175.26 175.49 2efi s ALA 35 N -0.07 -1.12 -0.03 6.30 0.00 -0.85 -1.82 121.76 124.17 2efi s ALA 35 Ca 0.53 -0.51 -0.08 0.00 0.00 0.00 0.00 51.96 51.90 2efi s ALA 35 Cb -0.33 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.52 2efi s ALA 35 CO 0.37 -1.02 0.18 0.21 0.00 0.00 0.00 175.76 175.50 2efi s LYS 36 N -2.52 0.39 -0.26 0.00 2.36 -1.24 -0.54 119.74 117.93 2efi s LYS 36 Ca 0.17 -0.08 -0.28 0.00 -2.55 0.00 0.00 55.97 53.23 2efi s LYS 36 Cb -0.04 0.17 -0.04 0.00 -1.05 0.00 0.00 37.83 36.87 2efi s LYS 36 CO 0.08 -0.08 2.12 0.00 1.55 0.00 0.00 175.35 179.02 2efi n VAL 38 N 7.69 1.73 -4.08 0.00 0.31 0.20 0.00 118.33 124.18 2efi n VAL 38 Ca 0.28 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 64.01 2efi n VAL 38 Cb 0.46 -1.82 -0.08 0.00 -0.91 0.00 0.00 33.84 31.49 2efi n VAL 38 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2efi s LYS 39 N -2.51 1.31 -0.23 5.55 1.02 -1.14 -4.78 119.74 118.96 2efi s LYS 39 Ca -0.24 -1.40 -0.03 0.00 0.02 0.00 0.00 55.97 54.32 2efi s LYS 39 Cb 0.06 0.36 0.08 0.00 -0.52 0.00 0.00 37.83 37.81 2efi s LYS 39 CO 0.73 -0.48 0.08 0.08 -0.92 0.00 0.00 175.35 174.83 2efi s VAL 40 N -4.07 0.30 0.22 3.17 1.01 -1.26 -1.04 120.40 118.72 2efi s VAL 40 Ca 0.28 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 61.70 2efi s VAL 40 Cb 0.03 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2efi s VAL 40 CO 0.08 -0.43 -0.06 0.00 0.00 0.00 0.00 175.10 174.70 2efi s ALA 41 N 1.94 3.03 -0.14 5.51 0.00 -0.82 -4.99 121.76 126.29 2efi s ALA 41 Ca 0.04 -1.55 -0.04 0.00 0.00 0.00 0.00 51.96 50.40 2efi s ALA 41 Cb -0.17 -0.74 0.05 0.00 0.00 0.00 0.00 23.12 22.26 2efi s ALA 41 CO -0.18 0.38 0.08 0.42 0.00 0.00 0.00 175.76 176.46 2efi s ILE 42 N -1.98 -0.03 0.29 0.00 1.01 -1.26 -0.01 121.20 119.22 2efi s ILE 42 Ca 0.28 -0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.77 2efi s ILE 42 Cb -0.08 -0.52 0.00 0.00 0.01 0.00 0.00 42.46 41.87 2efi s ILE 42 CO 0.17 -0.16 0.50 -0.54 0.00 0.00 0.00 174.94 174.91 2efi s LYS 43 N 2.12 1.71 -0.97 2.79 1.02 -0.26 -4.91 119.74 121.23 2efi s LYS 43 Ca 0.02 -1.43 -0.07 0.00 0.02 0.00 0.00 55.97 54.52 2efi s LYS 43 Cb -0.15 0.47 0.06 0.00 -0.52 0.00 0.00 37.83 37.69 2efi s LYS 43 CO -0.08 -0.72 0.28 -3.47 -0.92 0.00 0.00 175.35 170.45 2efi n ASP 44 N -0.77 -2.74 -3.18 2.83 2.03 -1.26 0.97 116.55 114.42 2efi n ASP 44 Ca -0.01 -0.16 -0.23 0.00 0.52 0.00 0.00 54.79 54.90 2efi n ASP 44 Cb 0.62 -2.34 0.05 0.00 -0.72 0.00 0.00 41.12 38.72 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2efi n LYS 45 N -3.27 -5.72 -3.81 -0.67 4.76 -1.26 -4.99 118.16 103.20 2efi n LYS 45 Ca -0.02 0.89 -0.12 0.00 -2.87 0.00 0.00 58.31 56.19 2efi n LYS 45 Cb 0.53 -5.81 -0.10 0.00 -1.84 0.00 0.00 35.03 27.82 2efi n LYS 45 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2efi s GLN 46 N -5.88 0.52 -0.26 1.97 -2.07 0.27 -5.07 119.66 109.14 2efi s GLN 46 Ca 0.38 -0.15 -0.10 0.00 -1.82 0.00 0.00 55.36 53.67 2efi s GLN 46 Cb -0.17 0.23 -0.05 0.00 -1.09 0.00 0.00 33.01 31.93 2efi s GLN 46 CO 0.47 -0.13 0.16 0.08 -1.32 0.00 0.00 175.29 174.55 2efi s VAL 47 N -1.03 5.13 0.41 3.63 1.01 -1.26 -1.11 120.40 127.18 2efi s VAL 47 Ca -0.11 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.05 2efi s VAL 47 Cb -0.05 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 2efi s VAL 47 CO 0.02 0.30 0.19 -0.54 0.00 0.00 0.00 175.10 175.08 2efi s LYS 48 N 1.50 2.25 -0.16 2.72 1.02 0.99 -2.13 119.74 125.93 2efi s LYS 48 Ca 0.07 -1.81 -0.06 0.00 0.02 0.00 0.00 55.97 54.19 2efi s LYS 48 Cb -0.15 -2.02 0.08 0.00 -0.52 0.00 0.00 37.83 35.22 2efi s LYS 48 CO 0.08 -0.11 0.34 0.71 -0.92 0.00 0.00 175.35 175.44 2efi s TYR 49 N -2.58 -0.61 -0.56 3.18 1.51 0.27 -1.95 117.35 116.60 2efi s TYR 49 Ca 0.42 1.25 -0.26 0.00 -1.01 0.00 0.00 57.07 57.47 2efi s TYR 49 Cb 0.03 0.14 -0.07 0.00 -0.11 0.00 0.00 41.96 41.95 2efi s TYR 49 CO 0.23 -0.42 2.28 0.12 -1.11 0.00 0.00 175.55 176.65 2efi s PHE 50 N 2.51 1.23 0.34 2.71 5.36 -0.21 -2.57 117.98 127.35 2efi s PHE 50 Ca -0.00 1.42 -0.19 0.00 -0.96 0.00 0.00 56.93 57.19 2efi s PHE 50 Cb -0.12 -3.69 -0.10 0.00 -0.34 0.00 0.00 43.02 38.77 2efi s PHE 50 CO -0.11 -2.35 0.82 0.42 -1.46 0.00 0.00 175.22 172.55 2efi s ILE 51 N 11.76 4.52 -0.41 3.12 -1.09 -0.21 0.63 121.20 139.51 2efi s ILE 51 Ca 0.89 1.27 0.03 0.00 -2.23 0.00 0.00 60.65 60.61 2efi s ILE 51 Cb -0.15 -3.69 0.12 0.00 -1.58 0.00 0.00 42.46 37.15 2efi s ILE 51 CO 0.22 -0.13 0.16 -2.28 -1.23 0.00 0.00 174.94 171.68 2efi s HIS 52 N -1.93 2.78 -0.26 3.97 5.65 -1.15 -2.55 115.29 121.80 2efi s HIS 52 Ca 0.54 -2.67 -0.32 0.00 0.25 0.00 0.00 55.06 52.87 2efi s HIS 52 Cb -0.12 -2.41 -0.09 0.00 -1.18 0.00 0.00 32.58 28.78 2efi s HIS 52 CO 0.17 -0.84 2.17 0.66 -0.65 0.00 0.00 174.74 176.25 2efi n TYR 53 N 3.89 1.85 -1.40 3.88 4.02 -1.26 -3.73 117.16 124.40 2efi n TYR 53 Ca 0.04 0.06 -0.44 0.00 -0.01 0.00 0.00 57.90 57.55 2efi n TYR 53 Cb 0.37 -2.63 -0.01 0.00 -0.02 0.00 0.00 39.34 37.05 2efi n TYR 53 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2efi n SER 54 N 10.25 -1.35 0.00 7.72 3.41 -0.76 -4.76 113.62 128.13 2efi n SER 54 Ca 0.34 0.99 0.00 0.00 -0.26 0.00 0.00 58.87 59.94 2efi n SER 54 Cb 0.33 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 2efi n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2efi n GLY 55 N 1.96 0.67 0.12 5.00 0.00 -1.26 -4.89 105.19 106.79 2efi n GLY 55 Ca 0.14 -2.12 -0.22 0.00 0.00 0.00 0.00 46.02 43.82 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 3.96 0.97 -1.31 1.61 7.02 -1.26 -4.67 117.44 123.77 2efi n TRP 56 Ca 0.00 0.31 -0.23 0.00 -1.02 0.00 0.00 57.50 56.56 2efi n TRP 56 Cb 0.00 -1.11 -0.12 0.00 -2.42 0.00 0.00 31.31 27.66 2efi n TRP 56 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2efi n ASN 57 N -3.96 1.29 0.28 -0.99 2.85 -1.26 -4.65 115.26 108.81 2efi n ASN 57 Ca -0.35 -2.50 0.12 0.00 -0.11 0.00 0.00 54.58 51.74 2efi n ASN 57 Cb 0.87 -1.41 0.78 0.00 1.24 0.00 0.00 39.78 41.26 2efi n ASN 57 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 2efi h LYS 58 N 11.19 0.00 -0.64 1.20 -0.00 -1.87 -2.50 116.57 123.94 2efi h LYS 58 Ca 0.08 0.00 0.13 0.00 -0.00 0.00 0.00 60.65 60.85 2efi h LYS 58 Cb 0.92 0.00 -0.10 0.00 -0.00 0.00 0.00 32.23 33.05 2efi h LYS 58 CO 1.28 0.00 0.12 -0.97 -0.00 0.00 0.00 179.45 179.88 2efi h ASN 59 N 0.00 -0.04 -1.19 7.07 -0.73 -1.96 -0.35 115.58 118.37 2efi h ASN 59 Ca -0.00 0.13 0.42 0.00 1.87 0.00 0.00 56.30 58.72 2efi h ASN 59 Cb 0.00 0.19 -0.13 0.00 0.27 0.00 0.00 38.32 38.65 2efi h ASN 59 CO 0.00 -0.03 0.76 0.79 -0.37 0.00 0.00 177.43 178.58 2efi n TRP 60 N -5.16 0.66 -1.40 0.67 8.01 -0.94 -4.54 117.44 114.74 2efi n TRP 60 Ca 0.10 0.67 -0.55 0.00 -1.31 0.00 0.00 57.50 56.42 2efi n TRP 60 Cb 0.37 -1.09 -0.08 0.00 -2.01 0.00 0.00 31.31 28.50 2efi n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 2efi n ASP 61 N -4.53 0.21 -4.15 -0.99 9.92 -0.15 -4.81 116.55 112.05 2efi n ASP 61 Ca 0.36 1.05 -0.11 0.00 -0.53 0.00 0.00 54.79 55.56 2efi n ASP 61 Cb 1.37 -0.82 -0.09 0.00 -0.64 0.00 0.00 41.12 40.94 2efi n ASP 61 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2efi s GLU 62 N 0.53 1.18 -0.26 -1.24 -1.05 -1.06 -4.98 118.70 111.83 2efi s GLU 62 Ca 0.85 -1.51 -0.16 0.00 -0.15 0.00 0.00 54.97 54.00 2efi s GLU 62 Cb -1.19 0.30 -0.03 0.00 -0.44 0.00 0.00 34.13 32.77 2efi s GLU 62 CO 0.56 -0.40 0.41 -1.58 0.95 0.00 0.00 175.26 175.20 2efi s TRP 63 N -4.11 3.26 0.15 4.83 0.52 -1.26 -1.05 118.94 121.28 2efi s TRP 63 Ca 0.32 0.49 0.10 0.00 0.02 0.00 0.00 56.10 57.04 2efi s TRP 63 Cb 0.06 -2.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.73 2efi s TRP 63 CO 0.09 -0.23 -0.24 0.14 0.02 0.00 0.00 176.95 176.73 2efi s VAL 64 N 2.07 2.16 0.00 4.03 -7.23 -1.06 -4.89 120.40 115.48 2efi s VAL 64 Ca 0.17 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 2efi s VAL 64 Cb -0.16 -1.95 0.00 0.00 0.56 0.00 0.00 36.38 34.83 2efi s VAL 64 CO 0.10 -0.04 0.00 -0.81 -0.31 0.00 0.00 175.10 174.04 2efi n PRO 65 N 0.67 0.06 0.01 4.82 -0.04 -1.26 0.95 135.00 140.22 2efi n PRO 65 Ca -0.16 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.41 2efi n PRO 65 Cb 0.54 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.11 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 -0.70 0.11 0.07 0.54 2.13 -0.91 -3.92 120.64 117.97 2efi n GLU 66 Ca 0.00 0.01 0.11 0.00 0.66 0.00 0.00 57.16 57.94 2efi n GLU 66 Cb 0.00 -1.54 -0.00 0.00 0.27 0.00 0.00 31.44 30.17 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 -1.69 0.68 -1.75 4.31 7.64 -1.26 -3.89 113.62 117.66 2efi n SER 67 Ca 0.04 0.17 0.07 0.00 1.01 0.00 0.00 58.87 60.16 2efi n SER 67 Cb 0.37 0.68 0.37 0.00 -1.01 0.00 0.00 64.21 64.63 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 -2.44 4.46 -4.42 1.43 1.74 -1.25 -4.89 116.66 111.29 2efi n ARG 68 Ca 0.00 -2.88 -0.20 0.00 -0.77 0.00 0.00 57.85 54.00 2efi n ARG 68 Cb 0.52 -2.16 -0.15 0.00 -1.02 0.00 0.00 32.46 29.65 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 -2.51 0.81 0.41 1.55 1.01 -1.25 -2.50 120.40 117.92 2efi s VAL 69 Ca 0.50 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 62.16 2efi s VAL 69 Cb 0.37 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 2efi s VAL 69 CO 0.16 0.24 0.31 -0.76 0.00 0.00 0.00 175.10 175.06 2efi s LEU 70 N 0.02 3.33 0.00 3.92 1.43 -0.72 -4.91 118.68 121.75 2efi s LEU 70 Ca -0.00 -0.82 0.16 0.00 -1.03 0.00 0.00 54.13 52.44 2efi s LEU 70 Cb -0.07 -1.90 0.63 0.00 0.03 0.00 0.00 46.19 44.89 2efi s LEU 70 CO 0.00 -0.60 1.46 0.29 0.23 0.00 0.00 176.35 177.73 2efi n LYS 71 N -1.44 1.58 -3.85 1.70 4.01 -1.26 -3.69 118.16 115.19 2efi n LYS 71 Ca 0.02 -0.88 -0.28 0.00 -0.51 0.00 0.00 58.31 56.66 2efi n LYS 71 Cb 0.62 -1.32 0.03 0.00 -0.51 0.00 0.00 35.03 33.86 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 0.14 -2.24 -3.97 2.13 4.19 -1.26 -4.87 117.16 111.28 2efi n TYR 72 Ca 0.13 0.90 -0.21 0.00 3.31 0.00 0.00 57.90 62.03 2efi n TYR 72 Cb 0.25 -4.12 -0.04 0.00 0.49 0.00 0.00 39.34 35.93 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 -3.39 4.28 0.09 2.97 -7.23 -1.26 -4.87 120.40 110.98 2efi s VAL 73 Ca 0.50 -1.31 -0.17 0.00 -1.81 0.00 0.00 61.98 59.18 2efi s VAL 73 Cb -0.25 -3.40 -0.04 0.00 0.56 0.00 0.00 36.38 33.25 2efi s VAL 73 CO 0.82 -0.29 1.02 0.47 -0.31 0.00 0.00 175.10 176.82 2efi n ASP 74 N -1.29 -0.60 -0.14 4.85 9.92 -1.26 0.39 116.55 128.42 2efi n ASP 74 Ca -0.06 1.16 -0.06 0.00 -0.53 0.00 0.00 54.79 55.30 2efi n ASP 74 Cb 0.58 -0.21 0.00 0.00 -0.64 0.00 0.00 41.12 40.86 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 0.28 -0.21 -3.53 2.02 -2.00 0.28 112.91 109.74 2efi h THR 75 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.27 2efi h THR 75 Cb 0.23 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 2efi h THR 75 CO -0.53 0.00 0.14 0.78 0.37 0.00 0.00 175.52 176.28 2efi h ASN 76 N -0.18 0.25 -0.35 4.18 2.35 -0.44 -2.12 115.58 119.26 2efi h ASN 76 Ca 0.20 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.81 2efi h ASN 76 Cb 0.51 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 2efi h ASN 76 CO -0.56 0.18 -0.34 -0.07 -1.65 0.00 0.00 177.43 174.99 2efi h LEU 77 N 0.29 0.90 -1.06 1.61 3.38 0.32 -2.91 115.31 117.85 2efi h LEU 77 Ca 0.08 -0.47 0.42 0.00 0.09 0.00 0.00 57.88 58.00 2efi h LEU 77 Cb -0.03 -0.25 -0.17 0.00 0.09 0.00 0.00 40.66 40.30 2efi h LEU 77 CO -0.02 1.18 0.59 1.56 0.09 0.00 0.00 178.44 181.85 2efi h GLN 78 N 0.63 0.03 0.00 1.13 1.08 -0.12 -0.64 115.11 117.22 2efi h GLN 78 Ca 0.06 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.23 2efi h GLN 78 Cb 0.92 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.34 2efi h GLN 78 CO 0.08 0.02 -0.20 -0.22 -0.95 0.00 0.00 178.83 177.57 2efi h LYS 79 N 0.04 0.00 -0.83 1.46 3.64 -1.64 -2.71 116.57 116.53 2efi h LYS 79 Ca 0.84 0.00 0.31 0.00 -1.27 0.00 0.00 60.65 60.53 2efi h LYS 79 Cb 2.27 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 33.98 2efi h LYS 79 CO -0.71 0.38 0.50 0.94 -2.27 0.00 0.00 179.45 178.29 2efi n GLN 80 N -4.67 -0.03 0.03 1.90 0.00 -0.32 0.24 117.38 114.52 2efi n GLN 80 Ca -0.07 0.90 -0.20 0.00 -0.00 0.00 0.00 57.00 57.62 2efi n GLN 80 Cb 0.24 -1.69 -0.14 0.00 0.00 0.00 0.00 30.24 28.64 2efi n GLN 80 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.06 177.13 2efi h ARG 81 N 0.00 0.28 -0.83 3.69 0.11 -1.49 -3.17 114.38 112.98 2efi h ARG 81 Ca 0.59 -0.49 0.07 0.00 0.10 0.00 0.00 59.98 60.26 2efi h ARG 81 Cb 1.76 0.18 -0.05 0.00 1.11 0.00 0.00 29.97 32.97 2efi h ARG 81 CO -0.41 1.18 0.54 1.05 0.10 0.00 0.00 179.97 182.43 2efi h GLU 82 N 0.08 0.87 0.19 0.08 4.11 0.34 -0.09 114.58 120.15 2efi h GLU 82 Ca -0.37 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.00 2efi h GLU 82 Cb 2.05 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 31.11 2efi h GLU 82 CO 0.12 0.57 -0.09 -0.07 0.07 0.00 0.00 179.01 179.62 2efi h LEU 83 N 0.89 -0.22 -0.69 3.06 3.38 -0.86 0.27 115.31 121.15 2efi h LEU 83 Ca 0.36 -0.24 0.15 0.00 0.09 0.00 0.00 57.88 58.24 2efi h LEU 83 Cb 0.26 0.06 -0.11 0.00 0.09 0.00 0.00 40.66 40.96 2efi h LEU 83 CO -0.13 0.33 0.11 1.56 0.09 0.00 0.00 178.44 180.40 2efi h GLN 84 N -0.97 0.21 -0.01 1.13 4.20 -1.49 -1.21 115.11 116.98 2efi h GLN 84 Ca -0.03 -0.01 -0.22 0.00 0.06 0.00 0.00 58.65 58.45 2efi h GLN 84 Cb 0.44 -0.05 0.02 0.00 0.30 0.00 0.00 27.48 28.19 2efi h GLN 84 CO 0.04 0.14 -0.85 1.57 -0.67 0.00 0.00 178.83 179.06 2efi h LYS 85 N 0.22 0.59 -0.62 1.46 2.10 -1.11 -3.29 116.57 115.92 2efi h LYS 85 Ca 0.38 -0.63 0.12 0.00 -2.00 0.00 0.00 60.65 58.53 2efi h LYS 85 Cb 0.64 0.18 -0.12 0.00 -0.90 0.00 0.00 32.23 32.02 2efi h LYS 85 CO -0.51 1.24 -0.18 0.00 -2.00 0.00 0.00 179.45 177.99 2efi h ALA 86 N 0.38 0.35 -3.29 0.07 0.00 0.60 -3.30 119.26 114.06 2efi h ALA 86 Ca -0.10 0.23 -0.63 0.00 0.00 0.00 0.00 54.91 54.41 2efi h ALA 86 Cb 1.53 0.52 -0.40 0.00 0.00 0.00 0.00 17.79 19.44 2efi h ALA 86 CO 0.17 -0.46 -0.70 -0.80 0.00 0.00 0.00 179.25 177.46 2efi s ASN 87 N -5.22 4.16 0.01 0.00 0.01 -0.56 -4.99 114.94 108.35 2efi s ASN 87 Ca -0.14 -2.54 -0.18 0.00 -0.71 0.00 0.00 52.86 49.29 2efi s ASN 87 Cb 0.19 -1.35 -0.10 0.00 0.41 0.00 0.00 41.25 40.40 2efi s ASN 87 CO 0.73 -0.30 0.97 1.56 -1.51 0.00 0.00 177.10 178.55 2efi h GLN 88 N 7.01 -0.62 -0.30 -0.60 4.20 -1.65 -3.04 115.11 120.12 2efi h GLN 88 Ca -0.06 0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.73 2efi h GLN 88 Cb 0.95 0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.81 2efi h GLN 88 CO 0.56 -0.41 -0.37 1.49 -0.67 0.00 0.00 178.83 179.43 2efi h GLU 89 N -0.85 -0.23 -1.10 1.46 4.81 -1.94 0.28 114.58 117.00 2efi h GLU 89 Ca -0.07 0.02 0.42 0.00 -0.13 0.00 0.00 59.36 59.60 2efi h GLU 89 Cb 0.49 0.05 -0.16 0.00 0.63 0.00 0.00 28.75 29.77 2efi h GLU 89 CO 0.11 -0.16 0.65 1.04 -0.73 0.00 0.00 179.01 179.92 2efi n GLN 90 N -4.46 -0.05 0.10 1.92 3.00 -1.25 0.22 117.38 116.86 2efi n GLN 90 Ca -0.02 1.26 -0.16 0.00 -0.01 0.00 0.00 57.00 58.07 2efi n GLN 90 Cb 0.22 -2.35 -0.13 0.00 0.00 0.00 0.00 30.24 27.98 2efi n GLN 90 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 2efi h TYR 91 N 0.00 0.55 0.00 1.08 5.03 -0.54 -3.37 116.97 119.72 2efi h TYR 91 Ca 0.82 -0.39 0.00 0.00 2.58 0.00 0.00 58.73 61.74 2efi h TYR 91 Cb 2.36 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 40.62 2efi h TYR 91 CO -0.01 1.29 0.00 0.00 -1.32 0.00 0.00 178.16 178.12 2efi n ALA 92 N -2.55 -0.20 -4.01 1.82 0.00 0.60 -4.74 120.51 111.43 2efi n ALA 92 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 2efi n ALA 92 Cb 1.00 0.19 -0.07 0.00 0.00 0.00 0.00 19.45 20.57 2efi n ALA 92 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2efi n GLU 93 N -1.92 -0.84 0.00 0.00 4.71 -1.04 -0.67 120.64 120.88 2efi n GLU 93 Ca 0.00 0.10 0.00 0.00 -0.01 0.00 0.00 57.16 57.25 2efi n GLU 93 Cb 0.00 -3.51 0.00 0.00 -1.01 0.00 0.00 31.44 26.92 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2efi n GLY 94 N -1.52 3.64 0.26 0.62 0.00 -1.26 -4.95 105.19 101.98 2efi n GLY 94 Ca -0.05 -0.86 0.15 0.00 0.00 0.00 0.00 46.02 45.26 2efi n GLY 94 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2efi n LYS 95 N 0.00 -0.06 -0.37 1.61 5.02 0.15 0.53 118.16 125.04 2efi n LYS 95 Ca 0.00 1.14 0.02 0.00 -2.02 0.00 0.00 58.31 57.45 2efi n LYS 95 Cb 0.00 -1.87 0.09 0.00 -0.02 0.00 0.00 35.03 33.23 2efi n LYS 95 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2efi n MET 96 N -5.01 -0.16 -3.75 1.97 1.56 -1.26 -4.72 117.12 105.75 2efi n MET 96 Ca 0.21 1.53 -0.27 0.00 -0.27 0.00 0.00 57.70 58.90 2efi n MET 96 Cb 0.70 -2.27 -0.06 0.00 2.15 0.00 0.00 33.22 33.74 2efi n MET 96 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 2efi n ARG 97 N -5.53 -0.87 0.00 2.12 5.12 0.19 -4.35 116.66 113.34 2efi n ARG 97 Ca 0.13 0.08 0.00 0.00 -1.93 0.00 0.00 57.85 56.13 2efi n ARG 97 Cb 0.44 -2.99 0.00 0.00 -1.16 0.00 0.00 32.46 28.75 2efi n ARG 97 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2efi n GLY 98 N -1.53 -1.43 3.92 -0.13 0.00 -1.26 -5.01 105.19 99.75 2efi n GLY 98 Ca -0.08 -2.08 -0.26 0.00 0.00 0.00 0.00 46.02 43.60 2efi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2efi s ALA 99 N -2.00 3.50 0.00 4.61 0.00 -1.26 -5.14 121.76 121.47 2efi s ALA 99 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.29 2efi s ALA 99 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 23.12 20.70 2efi s ALA 99 CO 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 175.76 175.46