#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 1.01 -4.12 1.61 3.41 -1.26 -4.99 113.62 109.28 2edp n SER 2 Ca 0.00 1.16 -0.12 0.00 -0.26 0.00 0.00 58.87 59.66 2edp n SER 2 Cb 0.00 -1.26 -0.11 0.00 -0.26 0.00 0.00 64.21 62.59 2edp n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2edp s SER 3 N -0.62 0.99 0.00 4.04 1.04 -1.26 -4.86 113.70 113.04 2edp s SER 3 Ca 0.59 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2edp s SER 3 Cb -0.71 0.07 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2edp s SER 3 CO 0.59 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.08 2edp n GLY 4 N 0.68 -1.19 3.57 7.32 0.00 -1.26 -5.06 105.19 109.26 2edp n GLY 4 Ca -0.17 -1.00 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 2edp n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edp s SER 5 N -0.45 4.64 -0.20 1.61 1.04 -1.26 -4.78 113.70 114.29 2edp s SER 5 Ca 0.00 -1.23 -0.30 0.00 0.48 0.00 0.00 55.95 54.90 2edp s SER 5 Cb 0.00 -2.58 0.15 0.00 0.10 0.00 0.00 66.02 63.69 2edp s SER 5 CO 0.00 -3.43 1.12 -0.55 0.98 0.00 0.00 173.24 171.37 2edp s SER 6 N 7.49 -0.25 0.00 7.02 0.15 -1.26 -5.15 113.70 121.70 2edp s SER 6 Ca 0.73 0.27 0.00 0.00 0.70 0.00 0.00 55.95 57.65 2edp s SER 6 Cb -0.04 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 2edp s SER 6 CO 0.11 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.93 2edp n GLY 7 N 0.65 1.84 0.00 9.45 0.00 -1.26 -4.84 105.19 111.04 2edp n GLY 7 Ca -0.07 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 1.05 -1.66 3.59 -0.02 0.00 -1.25 -4.70 105.19 102.19 2edp n GLY 8 Ca 0.00 0.55 -0.43 0.00 0.00 0.00 0.00 46.02 46.14 2edp n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2edp s SER 9 N 0.00 6.59 0.78 1.61 0.01 -1.16 -4.63 113.70 116.89 2edp s SER 9 Ca 0.00 0.36 -0.15 0.00 1.31 0.00 0.00 55.95 57.47 2edp s SER 9 Cb 0.00 -2.46 -0.01 0.00 0.21 0.00 0.00 66.02 63.77 2edp s SER 9 CO 0.00 -0.94 0.59 0.49 0.41 0.00 0.00 173.24 173.79 2edp n PHE 10 N 6.95 -0.66 -4.08 2.43 3.01 -1.26 -3.28 117.46 120.57 2edp n PHE 10 Ca 0.06 0.33 -0.33 0.00 1.01 0.00 0.00 57.45 58.53 2edp n PHE 10 Cb 0.48 -1.91 -0.15 0.00 -0.01 0.00 0.00 39.48 37.88 2edp n PHE 10 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 2edp s GLN 11 N -3.12 2.76 -0.83 -1.08 0.74 0.45 -4.84 119.66 113.74 2edp s GLN 11 Ca 0.65 -1.00 -0.15 0.00 0.05 0.00 0.00 55.36 54.91 2edp s GLN 11 Cb -0.31 -2.73 0.20 0.00 1.10 0.00 0.00 33.01 31.27 2edp s GLN 11 CO 0.59 -0.34 0.83 0.71 -0.55 0.00 0.00 175.29 176.52 2edp s TYR 12 N 1.24 3.60 -0.50 1.67 2.02 -1.25 -2.65 117.35 121.47 2edp s TYR 12 Ca 0.00 -1.82 -0.17 0.00 -0.37 0.00 0.00 57.07 54.71 2edp s TYR 12 Cb -0.16 -3.92 0.07 0.00 -0.40 0.00 0.00 41.96 37.56 2edp s TYR 12 CO -0.09 -1.10 0.51 0.54 -1.57 0.00 0.00 175.55 173.84 2edp s VAL 13 N 0.79 5.07 -0.98 0.71 0.11 -1.11 -4.90 120.40 120.09 2edp s VAL 13 Ca 0.20 -0.87 -0.24 0.00 -2.93 0.00 0.00 61.98 58.14 2edp s VAL 13 Cb -0.10 -4.23 -0.06 0.00 -1.53 0.00 0.00 36.38 30.46 2edp s VAL 13 CO -0.08 -0.72 1.95 -2.16 -3.33 0.00 0.00 175.10 170.75 2edp s PRO 14 N 2.09 2.53 -0.97 1.54 0.04 -1.25 -3.70 135.00 135.27 2edp s PRO 14 Ca 0.09 -0.53 -0.25 0.00 0.04 0.00 0.00 61.00 60.35 2edp s PRO 14 Cb -0.23 -5.11 -0.13 0.00 0.04 0.00 0.00 34.50 29.07 2edp s PRO 14 CO 0.08 -3.56 2.13 0.08 0.04 0.00 0.00 177.00 175.77 2edp s VAL 15 N 10.39 3.23 -0.54 -0.36 1.01 0.63 -4.77 120.40 129.98 2edp s VAL 15 Ca 0.70 -0.29 -0.27 0.00 0.00 0.00 0.00 61.98 62.12 2edp s VAL 15 Cb -0.05 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.53 2edp s VAL 15 CO 0.03 -0.45 1.10 -1.58 0.00 0.00 0.00 175.10 174.20 2edp s GLN 16 N 7.84 3.52 0.76 2.72 0.74 -1.26 -3.37 119.66 130.61 2edp s GLN 16 Ca 0.79 0.19 -0.08 0.00 0.05 0.00 0.00 55.36 56.31 2edp s GLN 16 Cb -0.07 -3.99 0.10 0.00 1.10 0.00 0.00 33.01 30.15 2edp s GLN 16 CO 0.10 -1.53 1.08 -0.51 -0.55 0.00 0.00 175.29 173.88 2edp s LEU 17 N 4.51 2.80 -0.23 3.68 1.43 0.62 -4.91 118.68 126.58 2edp s LEU 17 Ca 0.41 0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 53.67 2edp s LEU 17 Cb -0.09 -2.80 0.06 0.00 0.03 0.00 0.00 46.19 43.39 2edp s LEU 17 CO 0.25 -1.87 0.58 -1.10 0.23 0.00 0.00 176.35 174.44 2edp s GLN 18 N -5.38 0.62 0.00 1.70 -0.21 -1.26 -3.24 119.66 111.90 2edp s GLN 18 Ca 0.64 0.94 0.00 0.00 0.02 0.00 0.00 55.36 56.96 2edp s GLN 18 Cb -0.09 0.19 0.00 0.00 1.00 0.00 0.00 33.01 34.11 2edp s GLN 18 CO 0.47 -0.12 0.00 0.41 -2.12 0.00 0.00 175.29 173.92 2edp n GLY 19 N 3.63 3.54 0.00 3.09 0.00 -0.94 -5.02 105.19 109.49 2edp n GLY 19 Ca -0.18 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 1.70 3.17 -0.02 0.00 -0.60 -4.88 105.19 104.56 2edp n GLY 20 Ca 0.00 -1.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.03 2edp n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edp n ALA 21 N 1.70 -3.98 -1.62 4.61 0.00 -1.26 -4.65 120.51 115.31 2edp n ALA 21 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 53.44 52.74 2edp n ALA 21 Cb 0.00 -1.35 0.03 0.00 0.00 0.00 0.00 19.45 18.13 2edp n ALA 21 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2edp s PRO 22 N -1.70 3.02 -0.25 0.00 0.04 -1.26 -5.13 135.00 129.72 2edp s PRO 22 Ca 0.50 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.96 2edp s PRO 22 Cb -0.33 -1.97 -0.13 0.00 0.04 0.00 0.00 34.50 32.10 2edp s PRO 22 CO 0.73 -1.09 -0.28 0.91 0.04 0.00 0.00 177.00 177.30 2edp n TRP 23 N -1.97 0.00 -0.43 0.56 7.02 -1.26 -4.53 117.44 116.82 2edp n TRP 23 Ca 0.11 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.59 2edp n TRP 23 Cb 0.52 -0.94 0.00 0.00 -2.42 0.00 0.00 31.31 28.46 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 1.79 0.86 3.35 6.99 0.00 -1.26 0.03 105.19 116.96 2edp n GLY 24 Ca -0.48 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.96 -0.45 0.38 1.61 -0.12 -1.26 -0.36 117.98 115.82 2edp s PHE 25 Ca 0.00 1.00 0.06 0.00 -0.05 0.00 0.00 56.93 57.94 2edp s PHE 25 Cb 0.00 0.19 -0.02 0.00 -0.63 0.00 0.00 43.02 42.55 2edp s PHE 25 CO 0.00 -0.33 0.21 0.25 -0.05 0.00 0.00 175.22 175.30 2edp n THR 26 N 2.20 0.00 -4.20 -4.49 -2.24 0.16 -4.97 114.28 100.74 2edp n THR 26 Ca -0.16 -2.47 -0.12 0.00 -2.27 0.00 0.00 64.05 59.03 2edp n THR 26 Cb 0.57 1.05 -0.10 0.00 -2.10 0.00 0.00 70.33 69.74 2edp n THR 26 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2edp s LEU 27 N 0.00 2.11 0.08 3.22 1.43 -1.26 -2.15 118.68 122.10 2edp s LEU 27 Ca 0.30 -1.15 -0.03 0.00 -1.03 0.00 0.00 54.13 52.22 2edp s LEU 27 Cb 0.01 0.04 -0.03 0.00 0.03 0.00 0.00 46.19 46.24 2edp s LEU 27 CO 0.21 -0.59 0.05 -1.59 0.23 0.00 0.00 176.35 174.66 2edp s LYS 28 N -3.94 0.75 4.43 1.70 -2.85 -1.13 -4.63 119.74 114.08 2edp s LYS 28 Ca 0.22 -1.20 0.00 0.00 -1.00 0.00 0.00 55.97 53.99 2edp s LYS 28 Cb 0.06 0.26 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2edp s LYS 28 CO 0.02 -0.19 0.00 0.41 0.10 0.00 0.00 175.35 175.69 2edp n GLY 29 N 0.02 1.03 0.00 0.59 0.00 -1.26 -3.22 105.19 102.35 2edp n GLY 29 Ca -0.12 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 2.09 0.43 -0.02 0.00 0.81 -4.51 105.19 103.99 2edp n GLY 30 Ca 0.00 -2.01 0.31 0.00 0.00 0.00 0.00 46.02 44.32 2edp n GLY 30 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2edp h LEU 31 N 0.00 0.34 -0.92 0.99 5.85 -0.57 0.23 115.31 121.23 2edp h LEU 31 Ca 0.00 0.13 0.25 0.00 0.84 0.00 0.00 57.88 59.11 2edp h LEU 31 Cb 0.00 0.10 -0.16 0.00 0.37 0.00 0.00 40.66 40.97 2edp h LEU 31 CO 0.00 -0.11 0.11 -0.33 -0.34 0.00 0.00 178.44 177.76 2edp h GLU 32 N 0.20 0.08 -0.05 1.25 4.39 -1.83 0.40 114.58 119.01 2edp h GLU 32 Ca 0.75 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.44 2edp h GLU 32 Cb 2.14 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.78 2edp h GLU 32 CO -0.43 0.05 0.00 0.72 -1.16 0.00 0.00 179.01 178.19 2edp n HIS 33 N -5.38 0.13 -2.97 4.33 8.25 0.55 -4.97 115.22 115.16 2edp n HIS 33 Ca 0.22 -0.77 -0.21 0.00 -0.26 0.00 0.00 57.72 56.70 2edp n HIS 33 Cb 0.72 -0.12 0.03 0.00 1.12 0.00 0.00 29.99 31.74 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 -5.63 2.53 -0.79 0.00 2.02 -0.37 -4.90 118.70 111.56 2edp s GLU 35 Ca 0.29 -0.88 -0.25 0.00 0.02 0.00 0.00 54.97 54.14 2edp s GLU 35 Cb -0.13 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.55 2edp s GLU 35 CO 0.35 0.53 1.91 -1.25 0.02 0.00 0.00 175.26 176.82 2edp s PRO 36 N -2.43 2.59 -0.88 0.39 0.04 -1.26 -0.13 135.00 133.32 2edp s PRO 36 Ca 0.26 0.04 -0.25 0.00 0.04 0.00 0.00 61.00 61.10 2edp s PRO 36 Cb -0.11 -4.81 -0.21 0.00 0.04 0.00 0.00 34.50 29.41 2edp s PRO 36 CO 0.18 -3.13 2.49 -0.11 0.04 0.00 0.00 177.00 176.47 2edp n LEU 37 N 13.49 0.45 -4.07 -3.56 7.94 -1.26 -4.67 117.00 125.32 2edp n LEU 37 Ca 0.33 -0.29 -0.15 0.00 -1.11 0.00 0.00 56.01 54.78 2edp n LEU 37 Cb 0.49 -1.04 -0.12 0.00 0.53 0.00 0.00 43.42 43.28 2edp n LEU 37 CO 0.64 -1.25 -0.42 0.42 -1.11 0.00 0.00 177.39 175.67 2edp s THR 38 N 8.21 0.68 -0.02 1.96 -4.23 -1.20 -2.47 115.64 118.57 2edp s THR 38 Ca 1.23 -0.99 -0.35 0.00 -1.18 0.00 0.00 61.69 60.40 2edp s THR 38 Cb -0.83 -0.69 -0.17 0.00 1.34 0.00 0.00 72.50 72.14 2edp s THR 38 CO 0.42 -0.25 0.96 0.52 -0.54 0.00 0.00 174.62 175.73 2edp n VAL 39 N 1.68 0.00 -0.11 2.29 0.31 -0.34 -2.82 118.33 119.34 2edp n VAL 39 Ca -0.21 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 63.90 2edp n VAL 39 Cb 0.55 -0.02 -0.08 0.00 -0.91 0.00 0.00 33.84 33.38 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 1.42 1.65 -3.85 4.52 3.41 -0.91 -3.19 113.62 116.67 2edp n SER 40 Ca 0.18 0.21 -0.12 0.00 -0.26 0.00 0.00 58.87 58.88 2edp n SER 40 Cb 0.06 -0.59 -0.12 0.00 -0.26 0.00 0.00 64.21 63.31 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 -2.40 0.26 -0.23 4.33 2.47 -1.26 -4.88 119.74 118.03 2edp s LYS 41 Ca -0.30 -0.02 -0.04 0.00 -1.56 0.00 0.00 55.97 54.05 2edp s LYS 41 Cb 0.11 0.11 0.08 0.00 -1.46 0.00 0.00 37.83 36.68 2edp s LYS 41 CO 0.39 -0.05 0.12 0.42 0.16 0.00 0.00 175.35 176.40 2edp s ILE 42 N -0.41 -0.10 0.13 5.43 1.01 -1.26 0.40 121.20 126.39 2edp s ILE 42 Ca -0.05 -0.44 -0.35 0.00 0.00 0.00 0.00 60.65 59.81 2edp s ILE 42 Cb -0.03 -0.78 -0.16 0.00 0.01 0.00 0.00 42.46 41.50 2edp s ILE 42 CO 0.00 -0.49 1.34 -0.62 0.00 0.00 0.00 174.94 175.18 2edp n GLU 43 N 5.27 1.40 -2.39 2.79 -0.58 0.51 -4.87 120.64 122.77 2edp n GLU 43 Ca -0.06 0.50 -0.43 0.00 -0.42 0.00 0.00 57.16 56.75 2edp n GLU 43 Cb 0.46 -2.13 -0.02 0.00 -0.57 0.00 0.00 31.44 29.17 2edp n GLU 43 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2edp s ASP 44 N 0.41 6.68 0.00 1.62 1.01 -1.26 -3.03 116.67 122.11 2edp s ASP 44 Ca 0.79 1.32 0.00 0.00 0.71 0.00 0.00 52.55 55.37 2edp s ASP 44 Cb -0.85 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 40.54 2edp s ASP 44 CO 0.47 -1.05 0.00 0.61 0.21 0.00 0.00 175.17 175.41 2edp n GLY 45 N 4.25 0.92 2.41 0.21 0.00 -1.26 -5.07 105.19 106.65 2edp n GLY 45 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.01 -3.89 0.12 -0.02 0.00 -1.17 -4.35 105.19 95.87 2edp n GLY 46 Ca 0.00 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 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 0.31 -0.26 1.61 6.56 -0.63 0.20 116.57 124.36 2edp h LYS 47 Ca -0.30 -0.02 0.06 0.00 -1.06 0.00 0.00 60.65 59.33 2edp h LYS 47 Cb 1.01 -0.07 -0.06 0.00 -0.57 0.00 0.00 32.23 32.54 2edp h LYS 47 CO 0.18 0.23 -0.13 0.00 -2.06 0.00 0.00 179.45 177.67 2edp h ALA 48 N 1.06 0.08 0.16 3.86 0.00 -1.67 -1.07 119.26 121.68 2edp h ALA 48 Ca 0.08 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2edp h ALA 48 Cb -0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2edp h ALA 48 CO -0.02 -0.53 -0.08 0.00 0.00 0.00 0.00 179.25 178.62 2edp h ALA 49 N 1.12 -0.21 -0.99 0.00 0.00 -1.71 -3.06 119.26 114.40 2edp h ALA 49 Ca 0.14 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 55.17 2edp h ALA 49 Cb 0.31 0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.04 2edp h ALA 49 CO -0.33 -0.46 0.55 -0.07 0.00 0.00 0.00 179.25 178.95 2edp h LEU 50 N -0.54 0.52 -0.83 0.00 3.38 -0.36 0.49 115.31 117.97 2edp h LEU 50 Ca -0.02 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2edp h LEU 50 Cb 0.41 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2edp h LEU 50 CO 0.04 -0.07 0.47 -1.28 0.09 0.00 0.00 178.44 177.68 2edp h SER 51 N 0.38 1.02 -2.21 -0.43 0.87 -1.10 -3.46 113.55 108.63 2edp h SER 51 Ca 0.70 -0.09 -0.36 0.00 -1.23 0.00 0.00 61.79 60.81 2edp h SER 51 Cb 1.52 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 63.17 2edp h SER 51 CO -0.58 0.81 -0.43 0.00 -0.53 0.00 0.00 176.83 176.10 2edp n GLN 52 N -4.41 -1.39 -0.06 2.24 6.02 0.17 -4.86 117.38 115.09 2edp n GLN 52 Ca 0.08 0.92 -0.02 0.00 -0.01 0.00 0.00 57.00 57.97 2edp n GLN 52 Cb 0.08 -5.36 -0.14 0.00 1.02 0.00 0.00 30.24 25.84 2edp n GLN 52 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2edp n LYS 53 N -2.67 0.99 -4.31 -1.09 4.76 -1.26 -5.01 118.16 109.58 2edp n LYS 53 Ca -0.21 -0.07 -0.17 0.00 -2.87 0.00 0.00 58.31 55.00 2edp n LYS 53 Cb 0.65 -1.43 -0.10 0.00 -1.84 0.00 0.00 35.03 32.30 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 -2.72 1.23 -0.11 1.97 0.23 -1.26 -5.01 119.30 113.63 2edp s MET 54 Ca -0.08 -1.52 -0.30 0.00 -1.03 0.00 0.00 55.69 52.76 2edp s MET 54 Cb 0.07 -0.97 0.10 0.00 -1.53 0.00 0.00 34.83 32.50 2edp s MET 54 CO 0.71 0.15 0.83 0.50 -2.03 0.00 0.00 175.02 175.19 2edp s ARG 55 N -3.59 0.84 -0.46 3.16 3.52 -1.26 -4.85 118.95 116.31 2edp s ARG 55 Ca 0.20 0.24 -0.28 0.00 -0.13 0.00 0.00 55.73 55.76 2edp s ARG 55 Cb -0.00 0.40 -0.14 0.00 -1.56 0.00 0.00 34.95 33.65 2edp s ARG 55 CO 0.05 -0.25 1.61 0.25 -0.81 0.00 0.00 175.30 176.14 2edp n THR 56 N 0.91 0.00 0.00 4.11 -2.24 -1.26 -2.05 114.28 113.75 2edp n THR 56 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2edp n THR 56 Cb 0.57 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 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 4.98 1.08 3.79 3.38 0.00 -1.19 -4.98 105.19 112.25 2edp n GLY 57 Ca 0.41 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 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 5.42 -0.44 1.61 1.01 -0.87 -4.78 116.67 118.62 2edp s ASP 58 Ca 0.00 1.84 -0.07 0.00 0.71 0.00 0.00 52.55 55.03 2edp s ASP 58 Cb 0.00 -2.53 0.11 0.00 1.01 0.00 0.00 42.92 41.51 2edp s ASP 58 CO 0.00 -1.42 0.28 -0.70 0.21 0.00 0.00 175.17 173.54 2edp s GLU 59 N -4.30 2.35 -0.18 8.23 2.12 -1.21 -1.20 118.70 124.51 2edp s GLU 59 Ca 0.63 -1.72 -0.23 0.00 0.36 0.00 0.00 54.97 54.02 2edp s GLU 59 Cb -0.17 -3.78 -0.02 0.00 0.26 0.00 0.00 34.13 30.42 2edp s GLU 59 CO 0.43 -1.11 0.72 -1.17 -0.54 0.00 0.00 175.26 173.59 2edp s LEU 60 N 1.30 4.16 0.00 2.70 0.20 -1.03 -0.89 118.68 125.12 2edp s LEU 60 Ca 0.06 0.99 0.00 0.00 0.69 0.00 0.00 54.13 55.87 2edp s LEU 60 Cb -0.25 -3.04 0.00 0.00 -0.43 0.00 0.00 46.19 42.47 2edp s LEU 60 CO -0.01 -0.32 0.00 1.33 -0.29 0.00 0.00 176.35 177.05 2edp n VAL 61 N 4.69 0.00 -4.19 1.68 0.24 -1.23 -4.80 118.33 114.72 2edp n VAL 61 Ca 0.01 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.97 2edp n VAL 61 Cb 0.49 -0.50 -0.14 0.00 -1.47 0.00 0.00 33.84 32.22 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 -2.37 4.15 -0.08 -1.34 3.84 -1.24 -0.49 114.94 117.41 2edp s ASN 62 Ca 0.00 -0.38 0.01 0.00 0.21 0.00 0.00 52.86 52.71 2edp s ASN 62 Cb 0.00 -1.69 0.02 0.00 -0.55 0.00 0.00 41.25 39.03 2edp s ASN 62 CO 0.00 0.04 -0.11 -0.63 -2.79 0.00 0.00 177.10 173.61 2edp s ILE 63 N 1.09 1.11 -1.31 -5.21 1.01 -0.85 -1.86 121.20 115.17 2edp s ILE 63 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.23 2edp s ILE 63 Cb -0.15 -1.04 0.00 0.00 0.01 0.00 0.00 42.46 41.28 2edp s ILE 63 CO -0.01 0.36 0.00 0.59 0.00 0.00 0.00 174.94 175.88 2edp n ASN 64 N 4.14 -4.29 -0.05 3.58 3.02 0.95 -0.24 115.26 122.38 2edp n ASN 64 Ca -0.20 0.19 -0.00 0.00 -0.03 0.00 0.00 54.58 54.54 2edp n ASN 64 Cb 0.51 -3.69 -0.00 0.00 -0.61 0.00 0.00 39.78 35.99 2edp n ASN 64 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2edp n GLY 65 N -0.72 0.37 3.01 7.41 0.00 -1.25 -4.95 105.19 109.05 2edp n GLY 65 Ca -0.17 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.02 1.64 -0.25 2.61 2.01 0.66 -5.09 115.64 115.21 2edp s THR 66 Ca 0.00 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 60.80 2edp s THR 66 Cb 0.00 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.82 2edp s THR 66 CO 0.00 0.26 1.62 -2.16 -0.69 0.00 0.00 174.62 173.66 2edp s PRO 67 N 1.41 3.73 0.48 4.92 0.04 -1.26 -2.01 135.00 142.32 2edp s PRO 67 Ca 0.01 1.59 -0.18 0.00 0.04 0.00 0.00 61.00 62.45 2edp s PRO 67 Cb -0.15 -4.05 -0.09 0.00 0.04 0.00 0.00 34.50 30.25 2edp s PRO 67 CO -0.09 -1.38 0.98 -0.51 0.04 0.00 0.00 177.00 176.04 2edp s LEU 68 N 5.42 3.75 -0.21 -3.56 1.43 0.35 -4.98 118.68 120.88 2edp s LEU 68 Ca 0.72 1.65 0.15 0.00 -1.03 0.00 0.00 54.13 55.62 2edp s LEU 68 Cb -0.24 -4.52 0.63 0.00 0.03 0.00 0.00 46.19 42.08 2edp s LEU 68 CO 0.30 -0.54 1.54 -1.22 0.23 0.00 0.00 176.35 176.66 2edp n TYR 69 N -1.21 1.36 0.00 0.29 4.01 -1.26 -4.94 117.16 115.41 2edp n TYR 69 Ca 0.07 -0.88 0.00 0.00 -0.16 0.00 0.00 57.90 56.93 2edp n TYR 69 Cb 0.54 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 2edp n TYR 69 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2edp n GLY 70 N -0.20 3.10 3.08 2.72 0.00 -1.26 -4.74 105.19 107.89 2edp n GLY 70 Ca 0.25 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 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 0.77 -2.93 -0.04 1.61 2.88 -1.26 -0.03 113.62 114.62 2edp n SER 71 Ca 0.00 0.72 -0.02 0.00 -1.33 0.00 0.00 58.87 58.24 2edp n SER 71 Cb 0.00 -0.82 -0.01 0.00 -0.75 0.00 0.00 64.21 62.64 2edp n SER 71 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2edp h ARG 72 N 0.21 0.00 -0.47 -1.46 9.65 -1.90 -3.37 114.38 117.04 2edp h ARG 72 Ca -0.36 0.00 0.05 0.00 -1.10 0.00 0.00 59.98 58.57 2edp h ARG 72 Cb 1.36 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.87 2edp h ARG 72 CO 0.42 0.00 -0.37 1.96 2.80 0.00 0.00 179.97 184.78 2edp h GLN 73 N -0.70 -0.11 -0.60 0.20 1.08 -1.92 -0.41 115.11 112.64 2edp h GLN 73 Ca 0.00 0.01 0.10 0.00 -1.45 0.00 0.00 58.65 57.31 2edp h GLN 73 Cb 0.22 0.03 -0.10 0.00 -0.05 0.00 0.00 27.48 27.57 2edp h GLN 73 CO 0.00 -0.08 -0.21 -1.91 -0.95 0.00 0.00 178.83 175.68 2edp n GLU 74 N -4.44 -0.12 0.00 1.46 4.07 -1.26 0.22 120.64 120.57 2edp n GLU 74 Ca -0.00 0.93 0.00 0.00 -0.06 0.00 0.00 57.16 58.03 2edp n GLU 74 Cb 0.19 -1.39 0.00 0.00 -0.06 0.00 0.00 31.44 30.19 2edp n GLU 74 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2edp n ALA 75 N -3.71 -0.13 -0.24 4.31 0.00 -0.18 -0.48 120.51 120.09 2edp n ALA 75 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.46 2edp n ALA 75 Cb 0.26 0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 -1.30 -0.95 0.00 3.38 -1.05 0.33 115.31 115.71 2edp h LEU 76 Ca 0.00 0.25 0.23 0.00 0.09 0.00 0.00 57.88 58.45 2edp h LEU 76 Cb 0.00 0.64 -0.12 0.00 0.09 0.00 0.00 40.66 41.27 2edp h LEU 76 CO 0.00 -0.31 0.51 0.40 0.09 0.00 0.00 178.44 179.13 2edp h ILE 77 N -0.14 0.53 -0.32 1.22 2.04 -0.21 0.98 117.51 121.61 2edp h ILE 77 Ca 0.24 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.93 2edp h ILE 77 Cb 0.56 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2edp h ILE 77 CO -0.75 0.09 0.20 0.25 0.00 0.00 0.00 178.15 177.94 2edp h LEU 78 N 0.52 0.33 0.35 1.44 5.85 0.23 -3.11 115.31 120.92 2edp h LEU 78 Ca 0.60 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.30 2edp h LEU 78 Cb 1.12 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2edp h LEU 78 CO -0.49 0.24 -0.17 0.40 -0.34 0.00 0.00 178.44 178.08 2edp h ILE 79 N 0.40 0.64 -1.63 4.05 2.04 -0.39 -2.91 117.51 119.72 2edp h ILE 79 Ca 0.12 -0.47 0.47 0.00 1.00 0.00 0.00 64.86 65.98 2edp h ILE 79 Cb -0.02 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 36.87 2edp h ILE 79 CO -0.05 0.09 1.18 0.29 0.00 0.00 0.00 178.15 179.66 2edp n LYS 80 N -5.18 0.00 -1.17 2.37 5.02 0.02 0.24 118.16 119.45 2edp n LYS 80 Ca -0.10 0.89 -0.27 0.00 -2.02 0.00 0.00 58.31 56.81 2edp n LYS 80 Cb 0.27 -2.07 0.09 0.00 -0.02 0.00 0.00 35.03 33.30 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 -1.76 5.06 3.59 0.72 0.00 -1.10 -4.99 105.19 106.72 2edp n GLY 81 Ca 0.37 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 44.40 2edp n GLY 81 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edp s SER 82 N -1.20 1.79 0.00 1.61 1.04 0.65 -5.03 113.70 112.57 2edp s SER 82 Ca 0.54 1.33 0.00 0.00 0.48 0.00 0.00 55.95 58.30 2edp s SER 82 Cb 0.43 -2.05 0.00 0.00 0.10 0.00 0.00 66.02 64.50 2edp s SER 82 CO 0.02 -3.67 0.00 0.49 0.98 0.00 0.00 173.24 171.06 2edp n PHE 83 N -4.55 0.00 0.08 5.02 3.72 -1.26 -4.94 117.46 115.52 2edp n PHE 83 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 2edp n PHE 83 Cb 0.56 0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 2edp n PHE 83 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2edp n ARG 84 N -1.72 0.00 -4.71 -1.08 1.74 -1.26 -4.63 116.66 105.00 2edp n ARG 84 Ca 0.00 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 2edp n ARG 84 Cb 0.00 -0.13 -0.13 0.00 -1.02 0.00 0.00 32.46 31.18 2edp n ARG 84 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2edp s ILE 85 N -2.00 3.30 -0.09 0.55 1.01 -1.26 -1.55 121.20 121.15 2edp s ILE 85 Ca 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 2edp s ILE 85 Cb 0.00 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2edp s ILE 85 CO 0.00 0.54 -0.02 -0.22 0.00 0.00 0.00 174.94 175.25 2edp s LEU 86 N -0.03 3.46 -0.21 2.97 2.96 -1.20 -4.93 118.68 121.69 2edp s LEU 86 Ca -0.02 0.07 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 2edp s LEU 86 Cb -0.14 -1.79 0.05 0.00 0.50 0.00 0.00 46.19 44.81 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 -0.66 2.07 -0.07 1.98 1.02 -1.26 -0.28 119.74 122.55 2edp s LYS 87 Ca 0.10 -0.96 0.03 0.00 0.02 0.00 0.00 55.97 55.16 2edp s LYS 87 Cb -0.12 -2.54 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 2edp s LYS 87 CO 0.02 -0.47 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.33 2edp s LEU 88 N 1.33 1.74 -0.47 3.17 1.43 -1.22 -0.03 118.68 124.64 2edp s LEU 88 Ca -0.03 -0.34 -0.06 0.00 -1.03 0.00 0.00 54.13 52.67 2edp s LEU 88 Cb -0.17 -0.93 0.12 0.00 0.03 0.00 0.00 46.19 45.24 2edp s LEU 88 CO -0.08 0.07 0.30 -0.63 0.23 0.00 0.00 176.35 176.24 2edp s ILE 89 N 0.54 3.77 0.10 -0.59 1.09 -0.78 -0.27 121.20 125.06 2edp s ILE 89 Ca -0.14 -2.06 -0.09 0.00 -1.10 0.00 0.00 60.65 57.26 2edp s ILE 89 Cb -0.16 -3.52 -0.06 0.00 -1.06 0.00 0.00 42.46 37.67 2edp s ILE 89 CO 0.04 -0.76 0.41 0.68 -0.10 0.00 0.00 174.94 175.22 2edp s VAL 90 N 1.07 5.09 -0.16 2.92 -7.23 -1.24 -3.47 120.40 117.38 2edp s VAL 90 Ca 0.08 0.40 -0.00 0.00 -1.81 0.00 0.00 61.98 60.65 2edp s VAL 90 Cb -0.24 -3.64 -0.00 0.00 0.56 0.00 0.00 36.38 33.06 2edp s VAL 90 CO -0.03 0.23 -0.13 0.00 -0.31 0.00 0.00 175.10 174.86 2edp s ARG 91 N -2.06 3.27 -0.03 4.82 1.70 -0.07 -2.73 118.95 123.85 2edp s ARG 91 Ca 0.35 -0.72 0.03 0.00 -0.47 0.00 0.00 55.73 54.91 2edp s ARG 91 Cb -0.14 -2.68 0.00 0.00 -0.57 0.00 0.00 34.95 31.57 2edp s ARG 91 CO 0.19 0.02 -0.09 -0.98 -1.08 0.00 0.00 175.30 173.36 2edp s ARG 92 N 0.82 1.03 -0.07 3.89 1.70 -1.09 -3.35 118.95 121.89 2edp s ARG 92 Ca -0.05 -0.32 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 2edp s ARG 92 Cb -0.15 -0.95 -0.05 0.00 -0.57 0.00 0.00 34.95 33.22 2edp s ARG 92 CO 0.00 0.11 1.66 1.03 -1.08 0.00 0.00 175.30 177.03 2edp s ARG 93 N 0.22 4.14 -0.25 3.89 0.52 -1.26 -0.41 118.95 125.80 2edp s ARG 93 Ca -0.04 2.16 -0.08 0.00 -0.52 0.00 0.00 55.73 57.25 2edp s ARG 93 Cb -0.09 -4.00 -0.03 0.00 0.52 0.00 0.00 34.95 31.35 2edp s ARG 93 CO 0.01 -0.90 0.09 1.21 0.02 0.00 0.00 175.30 175.73 2edp s ASN 94 N 3.50 5.29 0.32 0.23 3.84 -1.20 -4.95 114.94 121.96 2edp s ASN 94 Ca 0.74 -0.16 -0.27 0.00 0.21 0.00 0.00 52.86 53.38 2edp s ASN 94 Cb -0.33 -1.95 -0.10 0.00 -0.55 0.00 0.00 41.25 38.32 2edp s ASN 94 CO 0.30 -0.03 0.97 -0.55 -2.79 0.00 0.00 177.10 175.00 2edp s SER 95 N 1.57 7.32 0.19 -4.21 0.15 -1.26 -3.00 113.70 114.46 2edp s SER 95 Ca 0.06 1.90 -0.19 0.00 0.70 0.00 0.00 55.95 58.42 2edp s SER 95 Cb -0.15 -2.59 0.07 0.00 -1.71 0.00 0.00 66.02 61.64 2edp s SER 95 CO 0.05 -0.09 0.93 0.61 1.20 0.00 0.00 173.24 175.94 2edp n GLY 96 N 0.71 0.70 2.60 9.45 0.00 -1.26 -4.99 105.19 112.41 2edp n GLY 96 Ca 0.01 -1.15 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 2edp n GLY 96 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edp n PRO 97 N -0.65 -2.61 -4.10 1.61 -0.04 -1.26 -4.78 135.00 123.17 2edp n PRO 97 Ca -0.03 -1.30 -0.26 0.00 -0.04 0.00 0.00 63.50 61.87 2edp n PRO 97 Cb 0.54 -1.22 -0.06 0.00 -0.04 0.00 0.00 33.50 32.73 2edp n PRO 97 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2edp s SER 98 N -3.70 5.44 -0.22 3.54 0.01 -1.26 -4.71 113.70 112.80 2edp s SER 98 Ca 0.53 -0.17 -0.14 0.00 1.31 0.00 0.00 55.95 57.48 2edp s SER 98 Cb -0.05 -1.39 -0.18 0.00 0.21 0.00 0.00 66.02 64.61 2edp s SER 98 CO 0.40 0.06 -0.00 -1.20 0.41 0.00 0.00 173.24 172.92 2edp n SER 99 N -0.37 1.95 0.00 2.44 7.64 -1.26 -5.13 113.62 118.90 2edp n SER 99 Ca -0.08 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.09 2edp n SER 99 Cb 0.55 -0.83 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 2edp n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64