#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edp n SER 2 N 0.00 2.05 -4.51 1.61 7.64 -1.26 -4.89 113.62 114.27 2edp n SER 2 Ca 0.00 -0.93 -0.43 0.00 1.01 0.00 0.00 58.87 58.52 2edp n SER 2 Cb 0.00 -1.61 -0.04 0.00 -1.01 0.00 0.00 64.21 61.55 2edp n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2edp s SER 3 N 11.58 6.27 0.03 6.43 0.01 -1.26 -5.01 113.70 131.76 2edp s SER 3 Ca 0.97 -0.52 0.04 0.00 1.31 0.00 0.00 55.95 57.75 2edp s SER 3 Cb -0.17 -2.46 -0.02 0.00 0.21 0.00 0.00 66.02 63.58 2edp s SER 3 CO 0.19 -1.40 -0.12 -0.83 0.41 0.00 0.00 173.24 171.49 2edp s GLY 4 N 3.23 0.65 1.07 3.44 0.00 -1.26 -5.14 107.32 109.31 2edp s GLY 4 Ca 0.30 -0.70 -0.12 0.00 0.00 0.00 0.00 44.72 44.19 2edp s GLY 4 CO 0.16 -0.68 0.93 1.44 0.00 0.00 0.00 173.10 174.95 2edp n SER 5 N 2.06 -1.11 -3.88 1.64 7.64 -1.26 -5.05 113.62 113.67 2edp n SER 5 Ca -0.18 0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.65 2edp n SER 5 Cb 0.55 -1.31 -0.14 0.00 -1.01 0.00 0.00 64.21 62.31 2edp n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2edp s SER 6 N -2.40 0.10 0.00 6.43 0.01 -1.26 -5.04 113.70 111.54 2edp s SER 6 Ca 0.66 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.91 2edp s SER 6 Cb -0.23 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2edp s SER 6 CO 0.63 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.90 2edp n GLY 7 N 3.09 -0.03 0.00 3.44 0.00 -1.26 -5.13 105.19 105.29 2edp n GLY 7 Ca -0.13 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2edp n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2edp n GLY 8 N 0.00 2.36 3.34 -0.02 0.00 -1.26 -5.18 105.19 104.43 2edp n GLY 8 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.32 2edp n GLY 8 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edp s SER 9 N 0.00 0.06 0.25 1.61 0.15 -1.26 -5.10 113.70 109.41 2edp s SER 9 Ca 0.00 -1.01 0.08 0.00 0.70 0.00 0.00 55.95 55.72 2edp s SER 9 Cb 0.00 0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2edp s SER 9 CO 0.00 -0.92 0.12 -0.36 1.20 0.00 0.00 173.24 173.28 2edp s PHE 10 N -4.02 2.96 -0.09 3.44 0.40 -1.26 -2.81 117.98 116.60 2edp s PHE 10 Ca 0.23 -0.15 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 2edp s PHE 10 Cb 0.04 -1.33 0.02 0.00 0.51 0.00 0.00 43.02 42.26 2edp s PHE 10 CO 0.04 0.56 -0.08 -1.14 0.70 0.00 0.00 175.22 175.30 2edp s GLN 11 N -3.72 1.40 -0.32 0.44 0.74 -1.21 -4.95 119.66 112.05 2edp s GLN 11 Ca 0.32 -0.25 -0.15 0.00 0.05 0.00 0.00 55.36 55.33 2edp s GLN 11 Cb -0.07 -1.38 -0.02 0.00 1.10 0.00 0.00 33.01 32.64 2edp s GLN 11 CO 0.23 -0.16 0.36 0.71 -0.55 0.00 0.00 175.29 175.88 2edp s TYR 12 N 1.31 3.22 -0.66 1.67 1.51 -1.26 -1.75 117.35 121.39 2edp s TYR 12 Ca -0.03 0.11 -0.11 0.00 -1.01 0.00 0.00 57.07 56.04 2edp s TYR 12 Cb -0.14 -2.64 0.17 0.00 -0.11 0.00 0.00 41.96 39.24 2edp s TYR 12 CO -0.03 -0.37 0.56 0.08 -1.11 0.00 0.00 175.55 174.68 2edp s VAL 13 N 2.04 4.80 -0.78 0.71 1.01 0.75 -4.92 120.40 124.01 2edp s VAL 13 Ca 0.13 -2.31 -0.25 0.00 0.00 0.00 0.00 61.98 59.54 2edp s VAL 13 Cb -0.16 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 2edp s VAL 13 CO 0.11 -0.92 1.91 -2.16 0.00 0.00 0.00 175.10 174.04 2edp s PRO 14 N 0.56 2.59 -0.53 2.72 0.04 -1.26 -2.86 135.00 136.25 2edp s PRO 14 Ca 0.13 0.10 -0.28 0.00 0.04 0.00 0.00 61.00 60.98 2edp s PRO 14 Cb -0.19 -4.77 0.02 0.00 0.04 0.00 0.00 34.50 29.60 2edp s PRO 14 CO -0.04 -3.10 1.37 0.08 0.04 0.00 0.00 177.00 175.35 2edp s VAL 15 N 9.64 3.86 -0.33 -0.36 1.01 0.37 -4.85 120.40 129.73 2edp s VAL 15 Ca 0.69 0.78 -0.10 0.00 0.00 0.00 0.00 61.98 63.35 2edp s VAL 15 Cb -0.09 -4.43 -0.00 0.00 0.00 0.00 0.00 36.38 31.85 2edp s VAL 15 CO 0.08 -1.10 0.17 -1.58 0.00 0.00 0.00 175.10 172.68 2edp s GLN 16 N 5.27 3.24 0.30 2.72 0.74 -1.26 -1.76 119.66 128.91 2edp s GLN 16 Ca 0.53 -0.79 -0.03 0.00 0.05 0.00 0.00 55.36 55.12 2edp s GLN 16 Cb -0.11 -3.63 -0.04 0.00 1.10 0.00 0.00 33.01 30.33 2edp s GLN 16 CO 0.27 -0.48 0.54 -0.51 -0.55 0.00 0.00 175.29 174.56 2edp s LEU 17 N 1.61 4.05 -0.09 3.68 1.43 0.78 -4.93 118.68 125.21 2edp s LEU 17 Ca 0.04 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 53.70 2edp s LEU 17 Cb -0.18 -3.42 0.05 0.00 0.03 0.00 0.00 46.19 42.67 2edp s LEU 17 CO 0.07 -0.22 0.18 -1.10 0.23 0.00 0.00 176.35 175.51 2edp s GLN 18 N -3.82 0.08 0.00 1.70 -0.21 -1.26 -2.44 119.66 113.70 2edp s GLN 18 Ca 0.42 0.55 0.00 0.00 0.02 0.00 0.00 55.36 56.35 2edp s GLN 18 Cb -0.10 -0.20 0.00 0.00 1.00 0.00 0.00 33.01 33.71 2edp s GLN 18 CO 0.32 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.64 2edp n GLY 19 N 5.00 4.40 0.00 3.09 0.00 0.07 -5.01 105.19 112.73 2edp n GLY 19 Ca -0.11 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2edp n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2edp n GLY 20 N 0.00 2.89 3.69 -0.02 0.00 0.12 -4.83 105.19 107.05 2edp n GLY 20 Ca 0.00 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 2edp n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edp s ALA 21 N -2.57 1.48 1.13 4.61 0.00 -1.26 -4.66 121.76 120.50 2edp s ALA 21 Ca 0.00 0.17 -0.17 0.00 0.00 0.00 0.00 51.96 51.96 2edp s ALA 21 Cb 0.00 -3.28 0.25 0.00 0.00 0.00 0.00 23.12 20.09 2edp s ALA 21 CO 0.00 -2.47 1.10 -1.25 0.00 0.00 0.00 175.76 173.14 2edp s PRO 22 N -4.80 -0.66 0.00 0.00 0.04 -1.26 -5.12 135.00 123.20 2edp s PRO 22 Ca 0.64 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.82 2edp s PRO 22 Cb -0.20 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2edp s PRO 22 CO 0.58 -3.38 0.00 0.91 0.04 0.00 0.00 177.00 175.15 2edp n TRP 23 N -4.56 0.00 0.00 0.56 7.02 -1.26 -4.62 117.44 114.58 2edp n TRP 23 Ca 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 2edp n TRP 23 Cb 0.59 0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.48 2edp n TRP 23 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2edp n GLY 24 N 3.12 0.70 3.46 6.99 0.00 -1.26 0.20 105.19 118.39 2edp n GLY 24 Ca 0.00 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 2edp n GLY 24 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2edp s PHE 25 N -1.12 -0.57 0.35 1.61 -0.12 -1.26 -0.72 117.98 116.14 2edp s PHE 25 Ca 0.00 1.22 0.05 0.00 -0.05 0.00 0.00 56.93 58.14 2edp s PHE 25 Cb 0.00 0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.62 2edp s PHE 25 CO 0.00 -0.42 0.19 0.95 -0.05 0.00 0.00 175.22 175.89 2edp s THR 26 N -0.45 0.31 0.08 -4.49 -4.23 0.80 -4.98 115.64 102.68 2edp s THR 26 Ca -0.06 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.46 2edp s THR 26 Cb -0.03 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 2edp s THR 26 CO 0.04 0.00 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.31 2edp s LEU 27 N -3.46 2.50 0.13 4.79 1.43 -1.26 -1.53 118.68 121.28 2edp s LEU 27 Ca 0.33 -1.00 -0.06 0.00 -1.03 0.00 0.00 54.13 52.37 2edp s LEU 27 Cb 0.03 0.02 -0.02 0.00 0.03 0.00 0.00 46.19 46.25 2edp s LEU 27 CO 0.20 -0.51 0.17 -1.59 0.23 0.00 0.00 176.35 174.85 2edp s LYS 28 N -3.85 0.99 4.89 1.70 -2.85 -0.99 -4.60 119.74 115.04 2edp s LYS 28 Ca 0.10 -1.23 0.00 0.00 -1.00 0.00 0.00 55.97 53.84 2edp s LYS 28 Cb 0.06 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.15 2edp s LYS 28 CO -0.06 -0.32 0.00 0.41 0.10 0.00 0.00 175.35 175.47 2edp n GLY 29 N -0.13 0.34 0.00 0.59 0.00 -1.26 -3.30 105.19 101.43 2edp n GLY 29 Ca -0.08 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2edp n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2edp n GLY 30 N 0.00 2.73 0.34 -0.02 0.00 0.09 -4.61 105.19 103.71 2edp n GLY 30 Ca 0.00 -1.93 0.16 0.00 0.00 0.00 0.00 46.02 44.25 2edp n GLY 30 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 2edp h LEU 31 N 0.00 0.59 -0.99 0.99 8.10 -1.51 0.17 115.31 122.66 2edp h LEU 31 Ca 0.00 0.14 0.28 0.00 0.11 0.00 0.00 57.88 58.40 2edp h LEU 31 Cb 0.00 0.05 -0.14 0.00 -0.44 0.00 0.00 40.66 40.14 2edp h LEU 31 CO 0.00 0.10 0.56 -0.33 -4.11 0.00 0.00 178.44 174.66 2edp h GLU 32 N 0.55 0.44 -0.64 0.17 5.08 -1.86 0.38 114.58 118.71 2edp h GLU 32 Ca 0.61 -0.03 -0.39 0.00 -1.00 0.00 0.00 59.36 58.55 2edp h GLU 32 Cb 1.13 -0.10 -0.23 0.00 0.50 0.00 0.00 28.75 30.05 2edp h GLU 32 CO -0.48 0.29 0.08 0.72 -1.00 0.00 0.00 179.01 178.63 2edp n HIS 33 N -4.97 2.09 -4.25 4.33 8.25 0.49 -4.94 115.22 116.22 2edp n HIS 33 Ca 0.29 -2.02 -0.33 0.00 -0.26 0.00 0.00 57.72 55.39 2edp n HIS 33 Cb 0.84 -0.72 -0.09 0.00 1.12 0.00 0.00 29.99 31.14 2edp n HIS 33 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2edp s GLU 35 N -6.98 0.64 -0.27 0.00 0.41 -0.56 -4.98 118.70 106.96 2edp s GLU 35 Ca 0.31 -0.52 -0.29 0.00 -0.41 0.00 0.00 54.97 54.06 2edp s GLU 35 Cb -0.18 -0.57 -0.02 0.00 -1.78 0.00 0.00 34.13 31.58 2edp s GLU 35 CO 0.94 0.14 1.64 -1.25 -0.49 0.00 0.00 175.26 176.24 2edp s PRO 36 N -0.82 3.66 -0.38 0.39 0.04 -1.26 -0.74 135.00 135.89 2edp s PRO 36 Ca -0.01 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.27 2edp s PRO 36 Cb -0.06 -4.07 -0.08 0.00 0.04 0.00 0.00 34.50 30.33 2edp s PRO 36 CO 0.00 -1.46 2.32 -0.11 0.04 0.00 0.00 177.00 177.79 2edp n LEU 37 N 8.94 2.54 -4.15 -3.56 7.94 -1.26 -4.54 117.00 122.92 2edp n LEU 37 Ca 0.20 -0.01 -0.11 0.00 -1.11 0.00 0.00 56.01 54.97 2edp n LEU 37 Cb 0.46 -1.48 -0.10 0.00 0.53 0.00 0.00 43.42 42.83 2edp n LEU 37 CO 0.66 -1.02 -0.39 0.42 -1.11 0.00 0.00 177.39 175.96 2edp s THR 38 N 9.58 0.66 -0.16 1.96 -4.23 -1.21 -2.64 115.64 119.60 2edp s THR 38 Ca 1.04 -1.78 -0.39 0.00 -1.18 0.00 0.00 61.69 59.38 2edp s THR 38 Cb -0.43 -1.49 -0.16 0.00 1.34 0.00 0.00 72.50 71.76 2edp s THR 38 CO 0.35 -0.79 1.63 0.52 -0.54 0.00 0.00 174.62 175.80 2edp n VAL 39 N 0.23 0.23 -0.03 2.29 0.31 -0.25 -2.34 118.33 118.77 2edp n VAL 39 Ca -0.14 -0.04 -0.22 0.00 -0.01 0.00 0.00 64.34 63.93 2edp n VAL 39 Cb 0.60 -1.14 -0.13 0.00 -0.91 0.00 0.00 33.84 32.25 2edp n VAL 39 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2edp n SER 40 N 4.59 2.05 -3.58 4.52 3.41 -0.58 -3.31 113.62 120.72 2edp n SER 40 Ca 0.24 0.27 -0.16 0.00 -0.26 0.00 0.00 58.87 58.95 2edp n SER 40 Cb 0.16 -0.89 -0.06 0.00 -0.26 0.00 0.00 64.21 63.15 2edp n SER 40 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2edp s LYS 41 N -2.50 0.98 -0.09 4.33 2.36 -1.25 -4.96 119.74 118.61 2edp s LYS 41 Ca -0.25 0.08 -0.01 0.00 -2.55 0.00 0.00 55.97 53.24 2edp s LYS 41 Cb 0.07 0.46 0.03 0.00 -1.05 0.00 0.00 37.83 37.33 2edp s LYS 41 CO 0.71 -0.31 -0.00 0.42 1.55 0.00 0.00 175.35 177.72 2edp s ILE 42 N -1.46 0.46 -0.21 5.43 1.01 -1.26 -0.14 121.20 125.03 2edp s ILE 42 Ca -0.10 -0.00 -0.35 0.00 0.00 0.00 0.00 60.65 60.20 2edp s ILE 42 Cb -0.01 -0.65 -0.11 0.00 0.01 0.00 0.00 42.46 41.70 2edp s ILE 42 CO 0.07 0.22 1.99 -0.62 0.00 0.00 0.00 174.94 176.59 2edp n GLU 43 N 5.11 1.69 -1.93 2.79 1.02 0.10 -4.82 120.64 124.61 2edp n GLU 43 Ca -0.08 0.57 -0.23 0.00 -0.02 0.00 0.00 57.16 57.40 2edp n GLU 43 Cb 0.50 -2.58 -0.06 0.00 -0.02 0.00 0.00 31.44 29.28 2edp n GLU 43 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2edp s ASP 44 N 5.38 4.82 0.00 1.62 1.01 -1.26 -1.72 116.67 126.52 2edp s ASP 44 Ca 0.99 -0.55 0.00 0.00 0.71 0.00 0.00 52.55 53.71 2edp s ASP 44 Cb -0.76 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 40.61 2edp s ASP 44 CO 0.51 -3.05 0.00 0.61 0.21 0.00 0.00 175.17 173.46 2edp n GLY 45 N 6.80 1.17 2.42 0.21 0.00 -1.26 -5.10 105.19 109.42 2edp n GLY 45 Ca 0.42 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.24 2edp n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2edp n GLY 46 N 0.00 -2.51 0.20 -0.02 0.00 -0.70 -4.62 105.19 97.54 2edp n GLY 46 Ca 0.00 -1.51 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 2edp n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2edp h LYS 47 N 0.00 -0.43 -0.97 1.61 1.79 0.19 0.13 116.57 118.89 2edp h LYS 47 Ca -0.28 0.03 0.24 0.00 -2.18 0.00 0.00 60.65 58.46 2edp h LYS 47 Cb 0.85 0.10 -0.13 0.00 -1.58 0.00 0.00 32.23 31.47 2edp h LYS 47 CO 0.19 -0.25 0.53 0.00 -1.08 0.00 0.00 179.45 178.84 2edp h ALA 48 N 0.16 1.69 -0.01 3.86 0.00 -1.43 0.17 119.26 123.70 2edp h ALA 48 Ca -0.05 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2edp h ALA 48 Cb 0.38 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2edp h ALA 48 CO 0.07 -0.32 -0.06 0.00 0.00 0.00 0.00 179.25 178.95 2edp h ALA 49 N 1.73 0.02 -0.77 0.00 0.00 -1.70 -3.25 119.26 115.30 2edp h ALA 49 Ca 0.63 -0.38 0.15 0.00 0.00 0.00 0.00 54.91 55.30 2edp h ALA 49 Cb 1.21 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2edp h ALA 49 CO -0.50 -0.08 0.51 -0.07 0.00 0.00 0.00 179.25 179.11 2edp h LEU 50 N -0.64 0.42 -1.10 0.00 3.38 0.42 0.06 115.31 117.85 2edp h LEU 50 Ca -0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2edp h LEU 50 Cb 0.79 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 2edp h LEU 50 CO 0.01 0.22 0.40 0.77 0.09 0.00 0.00 178.44 179.93 2edp h SER 51 N 0.45 0.92 -3.92 -0.43 4.64 -0.74 -3.46 113.55 111.01 2edp h SER 51 Ca 0.38 -0.08 -0.41 0.00 -0.47 0.00 0.00 61.79 61.21 2edp h SER 51 Cb 0.83 -0.23 0.03 0.00 -0.31 0.00 0.00 62.40 62.71 2edp h SER 51 CO -0.13 0.74 -0.58 0.00 -0.87 0.00 0.00 176.83 175.99 2edp n GLN 52 N -4.36 -3.68 -0.06 4.77 1.13 0.01 -4.87 117.38 110.33 2edp n GLN 52 Ca 0.07 0.95 -0.05 0.00 -1.94 0.00 0.00 57.00 56.04 2edp n GLN 52 Cb 0.10 -5.75 -0.10 0.00 0.11 0.00 0.00 30.24 24.60 2edp n GLN 52 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2edp n LYS 53 N -3.65 1.67 -4.22 -1.09 4.76 -1.26 -5.01 118.16 109.36 2edp n LYS 53 Ca -0.17 -0.02 -0.20 0.00 -2.87 0.00 0.00 58.31 55.05 2edp n LYS 53 Cb 0.65 -1.34 -0.12 0.00 -1.84 0.00 0.00 35.03 32.38 2edp n LYS 53 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2edp s MET 54 N -2.40 0.95 0.04 1.97 0.23 -1.26 -4.96 119.30 113.87 2edp s MET 54 Ca -0.06 -1.07 -0.07 0.00 -1.03 0.00 0.00 55.69 53.45 2edp s MET 54 Cb 0.05 -1.00 -0.01 0.00 -1.53 0.00 0.00 34.83 32.34 2edp s MET 54 CO 0.54 0.22 0.14 0.50 -2.03 0.00 0.00 175.02 174.39 2edp s ARG 55 N -1.99 0.66 -0.70 3.16 3.00 -1.26 -4.86 118.95 116.96 2edp s ARG 55 Ca 0.03 -0.75 -0.32 0.00 -1.00 0.00 0.00 55.73 53.70 2edp s ARG 55 Cb -0.09 0.27 -0.16 0.00 0.00 0.00 0.00 34.95 34.97 2edp s ARG 55 CO 0.03 -0.18 2.48 0.25 0.00 0.00 0.00 175.30 177.88 2edp n THR 56 N 0.61 0.01 0.00 4.11 -2.24 -1.26 -1.93 114.28 113.58 2edp n THR 56 Ca -0.18 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2edp n THR 56 Cb 0.59 -1.34 0.00 0.00 -2.10 0.00 0.00 70.33 67.48 2edp n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2edp n GLY 57 N 6.46 -0.12 3.86 3.38 0.00 -1.21 -4.99 105.19 112.58 2edp n GLY 57 Ca 0.53 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.23 2edp n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2edp s ASP 58 N 0.00 6.64 -0.38 1.61 1.01 -0.81 -4.83 116.67 119.91 2edp s ASP 58 Ca 0.00 1.15 -0.12 0.00 0.71 0.00 0.00 52.55 54.29 2edp s ASP 58 Cb 0.00 -2.32 0.02 0.00 1.01 0.00 0.00 42.92 41.63 2edp s ASP 58 CO 0.00 -0.26 0.23 -0.70 0.21 0.00 0.00 175.17 174.64 2edp s GLU 59 N -3.33 2.90 -0.24 8.23 2.12 -1.23 -1.09 118.70 126.07 2edp s GLU 59 Ca 0.52 -1.04 -0.16 0.00 0.36 0.00 0.00 54.97 54.65 2edp s GLU 59 Cb -0.10 -3.78 -0.03 0.00 0.26 0.00 0.00 34.13 30.47 2edp s GLU 59 CO 0.24 -0.69 0.43 -1.17 -0.54 0.00 0.00 175.26 173.53 2edp s LEU 60 N 1.59 4.09 0.00 2.70 0.20 -1.08 -1.62 118.68 124.55 2edp s LEU 60 Ca 0.03 0.46 0.00 0.00 0.69 0.00 0.00 54.13 55.31 2edp s LEU 60 Cb -0.19 -2.54 0.00 0.00 -0.43 0.00 0.00 46.19 43.03 2edp s LEU 60 CO 0.07 -0.17 0.00 1.33 -0.29 0.00 0.00 176.35 177.29 2edp n VAL 61 N 4.79 0.00 -4.09 1.68 0.24 -1.23 -4.85 118.33 114.87 2edp n VAL 61 Ca -0.07 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.90 2edp n VAL 61 Cb 0.51 0.41 -0.16 0.00 -1.47 0.00 0.00 33.84 33.13 2edp n VAL 61 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2edp s ASN 62 N -1.86 3.35 -0.13 -1.34 3.84 -1.24 -0.95 114.94 116.61 2edp s ASN 62 Ca 0.00 -0.60 -0.00 0.00 0.21 0.00 0.00 52.86 52.47 2edp s ASN 62 Cb 0.00 -1.53 0.03 0.00 -0.55 0.00 0.00 41.25 39.20 2edp s ASN 62 CO 0.00 -0.00 -0.09 -0.63 -2.79 0.00 0.00 177.10 173.59 2edp s ILE 63 N 1.31 1.17 -1.58 -5.21 1.01 -0.90 -2.11 121.20 114.90 2edp s ILE 63 Ca 0.05 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 2edp s ILE 63 Cb -0.13 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.16 2edp s ILE 63 CO -0.11 0.36 0.06 0.59 0.00 0.00 0.00 174.94 175.84 2edp n ASN 64 N 4.89 -5.44 0.00 3.58 5.03 0.15 -1.18 115.26 122.30 2edp n ASN 64 Ca -0.13 -0.04 0.00 0.00 0.87 0.00 0.00 54.58 55.27 2edp n ASN 64 Cb 0.50 -4.47 0.00 0.00 -1.02 0.00 0.00 39.78 34.79 2edp n ASN 64 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2edp n GLY 65 N -1.07 0.65 3.43 7.41 0.00 -1.25 -4.97 105.19 109.40 2edp n GLY 65 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 2edp n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2edp s THR 66 N -2.68 4.70 -0.64 2.61 2.01 -0.32 -5.04 115.64 116.28 2edp s THR 66 Ca 0.00 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.19 2edp s THR 66 Cb 0.00 -3.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 2edp s THR 66 CO 0.00 -0.05 1.87 -2.16 -0.69 0.00 0.00 174.62 173.59 2edp s PRO 67 N 1.61 2.62 1.13 4.92 0.04 -1.26 -2.11 135.00 141.94 2edp s PRO 67 Ca 0.04 0.52 -0.19 0.00 0.04 0.00 0.00 61.00 61.41 2edp s PRO 67 Cb -0.18 -4.46 0.29 0.00 0.04 0.00 0.00 34.50 30.20 2edp s PRO 67 CO 0.07 -2.80 0.66 1.28 0.04 0.00 0.00 177.00 176.25 2edp n LEU 68 N 12.89 0.00 -1.15 -3.56 4.77 -0.12 -4.99 117.00 124.84 2edp n LEU 68 Ca 0.22 -0.66 0.04 0.00 -0.03 0.00 0.00 56.01 55.58 2edp n LEU 68 Cb 0.52 -0.76 0.10 0.00 -2.33 0.00 0.00 43.42 40.94 2edp n LEU 68 CO 0.70 -2.54 0.19 -1.22 -1.33 0.00 0.00 177.39 173.19 2edp n TYR 69 N -5.16 0.05 0.00 -1.77 4.02 -1.26 -4.97 117.16 108.07 2edp n TYR 69 Ca 0.10 -0.96 0.00 0.00 -0.01 0.00 0.00 57.90 57.03 2edp n TYR 69 Cb 0.46 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.58 2edp n TYR 69 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2edp n GLY 70 N -0.21 2.47 3.16 2.72 0.00 -1.26 -4.90 105.19 107.17 2edp n GLY 70 Ca 0.12 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 2edp n GLY 70 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2edp n SER 71 N 1.03 -3.28 -0.09 1.61 2.88 -1.26 -2.79 113.62 111.72 2edp n SER 71 Ca 0.00 0.06 -0.20 0.00 -1.33 0.00 0.00 58.87 57.39 2edp n SER 71 Cb 0.00 -0.82 -0.07 0.00 -0.75 0.00 0.00 64.21 62.58 2edp n SER 71 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2edp n ARG 72 N 0.36 0.40 -0.01 -1.46 0.63 -1.26 -4.53 116.66 110.80 2edp n ARG 72 Ca 0.00 0.18 -0.01 0.00 -0.92 0.00 0.00 57.85 57.10 2edp n ARG 72 Cb 0.64 -1.18 -0.01 0.00 0.45 0.00 0.00 32.46 32.36 2edp n ARG 72 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2edp h GLN 73 N -0.69 -0.02 -0.75 -0.14 7.50 -1.95 -1.39 115.11 117.67 2edp h GLN 73 Ca -0.48 0.00 0.14 0.00 0.50 0.00 0.00 58.65 58.82 2edp h GLN 73 Cb 1.41 0.01 -0.14 0.00 0.05 0.00 0.00 27.48 28.81 2edp h GLN 73 CO -0.29 -0.02 -0.22 -1.91 -1.50 0.00 0.00 178.83 174.90 2edp n GLU 74 N -2.89 -0.10 0.00 1.46 2.13 -1.26 -0.21 120.64 119.77 2edp n GLU 74 Ca -0.00 1.17 0.00 0.00 0.66 0.00 0.00 57.16 58.98 2edp n GLU 74 Cb 0.02 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 29.99 2edp n GLU 74 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2edp n ALA 75 N -3.69 -0.13 -0.25 4.31 0.00 -0.57 -0.22 120.51 119.96 2edp n ALA 75 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.55 2edp n ALA 75 Cb 0.35 0.16 0.08 0.00 0.00 0.00 0.00 19.45 20.04 2edp n ALA 75 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2edp h LEU 76 N 0.00 -0.70 -0.99 0.00 3.38 -0.76 0.35 115.31 116.59 2edp h LEU 76 Ca 0.00 0.22 0.18 0.00 0.09 0.00 0.00 57.88 58.36 2edp h LEU 76 Cb 0.00 0.45 -0.10 0.00 0.09 0.00 0.00 40.66 41.10 2edp h LEU 76 CO 0.00 -0.24 0.59 0.40 0.09 0.00 0.00 178.44 179.28 2edp h ILE 77 N -0.01 0.73 0.15 1.22 2.04 -0.43 -0.91 117.51 120.30 2edp h ILE 77 Ca 0.34 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 2edp h ILE 77 Cb 0.53 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2edp h ILE 77 CO -0.74 0.14 -0.07 0.25 0.00 0.00 0.00 178.15 177.73 2edp h LEU 78 N 0.77 -0.17 -0.37 1.44 5.85 0.29 -3.07 115.31 120.06 2edp h LEU 78 Ca 0.56 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 59.25 2edp h LEU 78 Cb 0.83 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 2edp h LEU 78 CO -0.37 -0.03 0.10 0.40 -0.34 0.00 0.00 178.44 178.20 2edp h ILE 79 N -0.30 0.84 -0.70 4.05 2.04 -0.71 -2.61 117.51 120.12 2edp h ILE 79 Ca -0.02 -0.08 0.14 0.00 1.00 0.00 0.00 64.86 65.90 2edp h ILE 79 Cb 0.24 0.59 -0.13 0.00 -0.74 0.00 0.00 36.82 36.77 2edp h ILE 79 CO 0.03 0.04 -0.18 0.29 0.00 0.00 0.00 178.15 178.33 2edp n LYS 80 N -5.07 -0.07 -1.57 2.37 5.02 -0.44 0.19 118.16 118.59 2edp n LYS 80 Ca 0.02 1.09 -0.37 0.00 -2.02 0.00 0.00 58.31 57.03 2edp n LYS 80 Cb 0.16 -1.62 0.06 0.00 -0.02 0.00 0.00 35.03 33.61 2edp n LYS 80 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2edp n GLY 81 N -1.43 5.66 2.84 0.72 0.00 -0.98 -5.00 105.19 106.99 2edp n GLY 81 Ca 0.11 -2.35 -0.26 0.00 0.00 0.00 0.00 46.02 43.52 2edp n GLY 81 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2edp n SER 82 N -0.70 -3.05 -2.91 1.61 3.41 0.50 -5.07 113.62 107.41 2edp n SER 82 Ca 0.58 -0.89 -0.15 0.00 -0.26 0.00 0.00 58.87 58.15 2edp n SER 82 Cb 0.47 -0.85 -0.04 0.00 -0.26 0.00 0.00 64.21 63.53 2edp n SER 82 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2edp n PHE 83 N -5.05 0.13 -0.33 7.33 3.72 -1.26 -4.95 117.46 117.04 2edp n PHE 83 Ca 0.12 -1.50 0.19 0.00 -0.05 0.00 0.00 57.45 56.20 2edp n PHE 83 Cb 0.51 -0.02 0.42 0.00 -0.94 0.00 0.00 39.48 39.46 2edp n PHE 83 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 2edp h ARG 84 N 0.00 0.53 -5.52 -1.08 0.11 -1.95 -3.37 114.38 103.09 2edp h ARG 84 Ca -0.19 -0.03 -0.62 0.00 0.10 0.00 0.00 59.98 59.24 2edp h ARG 84 Cb 0.70 -0.12 -0.32 0.00 1.11 0.00 0.00 29.97 31.35 2edp h ARG 84 CO 0.30 0.35 -0.86 0.42 0.10 0.00 0.00 179.97 180.28 2edp s ILE 85 N -5.66 1.73 -0.05 0.08 1.01 -1.26 0.14 121.20 117.19 2edp s ILE 85 Ca -0.10 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.69 2edp s ILE 85 Cb 0.26 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 2edp s ILE 85 CO 0.80 0.49 -0.05 -0.22 0.00 0.00 0.00 174.94 175.95 2edp s LEU 86 N 0.05 3.24 -0.16 2.97 2.96 -1.02 -4.93 118.68 121.79 2edp s LEU 86 Ca -0.07 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 2edp s LEU 86 Cb -0.14 -1.76 0.03 0.00 0.50 0.00 0.00 46.19 44.82 2edp s LEU 86 CO 0.04 0.34 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.76 2edp s LYS 87 N -1.04 1.92 -0.01 1.98 1.02 -1.26 -0.16 119.74 122.19 2edp s LYS 87 Ca 0.14 -0.55 0.01 0.00 0.02 0.00 0.00 55.97 55.59 2edp s LYS 87 Cb -0.11 -2.05 0.01 0.00 -0.52 0.00 0.00 37.83 35.15 2edp s LYS 87 CO 0.04 -0.32 -0.04 -0.51 -0.92 0.00 0.00 175.35 173.60 2edp s LEU 88 N 1.54 1.76 -0.34 3.17 1.43 -0.72 0.32 118.68 125.85 2edp s LEU 88 Ca 0.03 -0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2edp s LEU 88 Cb -0.14 -0.27 0.08 0.00 0.03 0.00 0.00 46.19 45.89 2edp s LEU 88 CO -0.09 0.01 0.06 -0.63 0.23 0.00 0.00 176.35 175.93 2edp s ILE 89 N 0.24 2.89 -0.06 -0.59 1.09 -0.90 0.14 121.20 124.01 2edp s ILE 89 Ca -0.02 -1.77 -0.03 0.00 -1.10 0.00 0.00 60.65 57.73 2edp s ILE 89 Cb -0.06 -2.84 -0.04 0.00 -1.06 0.00 0.00 42.46 38.47 2edp s ILE 89 CO -0.00 -0.36 0.11 0.68 -0.10 0.00 0.00 174.94 175.27 2edp s VAL 90 N 1.15 5.07 -0.15 2.92 -7.23 -1.14 -3.47 120.40 117.55 2edp s VAL 90 Ca 0.01 -0.12 -0.04 0.00 -1.81 0.00 0.00 61.98 60.02 2edp s VAL 90 Cb -0.21 -3.26 -0.03 0.00 0.56 0.00 0.00 36.38 33.44 2edp s VAL 90 CO -0.03 0.48 -0.03 0.00 -0.31 0.00 0.00 175.10 175.21 2edp s ARG 91 N -1.40 3.66 -0.15 4.82 1.70 -0.64 -0.18 118.95 126.76 2edp s ARG 91 Ca 0.20 -0.50 -0.01 0.00 -0.47 0.00 0.00 55.73 54.95 2edp s ARG 91 Cb -0.12 -2.93 0.04 0.00 -0.57 0.00 0.00 34.95 31.37 2edp s ARG 91 CO 0.10 0.27 -0.02 -0.98 -1.08 0.00 0.00 175.30 173.59 2edp s ARG 92 N 0.28 1.02 0.53 3.89 1.70 -0.72 -3.50 118.95 122.16 2edp s ARG 92 Ca -0.02 -0.31 -0.19 0.00 -0.47 0.00 0.00 55.73 54.73 2edp s ARG 92 Cb -0.14 -1.74 -0.10 0.00 -0.57 0.00 0.00 34.95 32.40 2edp s ARG 92 CO 0.03 -0.44 0.46 0.54 -1.08 0.00 0.00 175.30 174.80 2edp n ARG 93 N 5.00 0.48 -0.15 3.89 1.74 -1.26 -3.31 116.66 123.05 2edp n ARG 93 Ca -0.10 0.18 -0.11 0.00 -0.77 0.00 0.00 57.85 57.05 2edp n ARG 93 Cb 0.48 -1.58 -0.01 0.00 -1.02 0.00 0.00 32.46 30.33 2edp n ARG 93 CO 0.00 0.00 0.00 -2.95 -1.52 0.00 0.00 177.63 173.16 2edp h ASN 94 N 0.35 0.90 -3.41 0.55 -1.07 -1.89 -3.43 115.58 107.58 2edp h ASN 94 Ca -0.44 -0.38 -0.52 0.00 0.07 0.00 0.00 56.30 55.02 2edp h ASN 94 Cb 1.40 -0.25 0.02 0.00 -2.07 0.00 0.00 38.32 37.43 2edp h ASN 94 CO 0.47 1.08 0.58 -0.55 0.07 0.00 0.00 177.43 179.09 2edp s SER 95 N -6.56 7.04 0.40 6.14 0.15 -1.26 -5.04 113.70 114.58 2edp s SER 95 Ca -0.12 2.24 0.07 0.00 0.70 0.00 0.00 55.95 58.84 2edp s SER 95 Cb 0.11 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 2edp s SER 95 CO 0.84 -0.42 0.55 -0.83 1.20 0.00 0.00 173.24 174.59 2edp s GLY 96 N 0.31 1.82 0.17 9.45 0.00 -1.26 -5.03 107.32 112.78 2edp s GLY 96 Ca 0.55 -1.56 -0.07 0.00 0.00 0.00 0.00 44.72 43.63 2edp s GLY 96 CO 0.36 -1.40 1.51 -0.56 0.00 0.00 0.00 173.10 173.01 2edp h PRO 97 N 0.67 0.81 -5.56 2.90 0.13 -1.98 -3.44 132.00 125.53 2edp h PRO 97 Ca -0.42 -0.42 -0.64 0.00 -0.87 0.00 0.00 66.00 63.65 2edp h PRO 97 Cb 1.27 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.36 2edp h PRO 97 CO 0.48 1.06 1.53 0.45 -0.23 0.00 0.00 178.00 181.29 2edp n SER 98 N -4.04 0.70 -4.88 1.44 2.88 -1.26 -4.89 113.62 103.56 2edp n SER 98 Ca -0.02 0.41 -0.22 0.00 -1.33 0.00 0.00 58.87 57.71 2edp n SER 98 Cb 0.54 -0.96 0.06 0.00 -0.75 0.00 0.00 64.21 63.10 2edp n SER 98 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2edp s SER 99 N 7.58 4.97 0.00 -3.46 0.15 -1.26 -5.22 113.70 116.46 2edp s SER 99 Ca 1.25 -0.22 0.19 0.00 0.70 0.00 0.00 55.95 57.88 2edp s SER 99 Cb -1.31 -0.48 0.15 0.00 -1.71 0.00 0.00 66.02 62.67 2edp s SER 99 CO 0.56 -1.38 1.10 0.61 1.20 0.00 0.00 173.24 175.34