#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edp h SER 2 N 0.00 -0.17 -4.10 1.61 0.02 -2.07 -3.48 113.55 105.36 2edp h SER 2 Ca 0.00 -0.30 0.20 0.00 -0.84 0.00 0.00 61.79 60.85 2edp h SER 2 Cb 0.00 0.04 -0.20 0.00 0.14 0.00 0.00 62.40 62.38 2edp h SER 2 CO 0.00 0.24 0.74 -0.55 -1.14 0.00 0.00 176.83 176.11 2edp s SER 3 N -5.37 -0.20 0.95 3.07 0.15 -1.26 -5.13 113.70 105.91 2edp s SER 3 Ca -0.15 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2edp s SER 3 Cb 0.02 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 2edp s SER 3 CO 0.59 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.36 2edp n GLY 4 N 0.14 1.54 2.80 9.45 0.00 -1.26 -4.75 105.19 113.10 2edp n GLY 4 Ca -0.03 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 2edp n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edp s SER 5 N -4.00 0.17 -0.12 1.61 0.15 -1.26 -5.05 113.70 105.21 2edp s SER 5 Ca 0.00 0.01 -0.26 0.00 0.70 0.00 0.00 55.95 56.41 2edp s SER 5 Cb 0.00 -0.11 -0.27 0.00 -1.71 0.00 0.00 66.02 63.93 2edp s SER 5 CO 0.00 -0.11 0.76 0.77 1.20 0.00 0.00 173.24 175.86 2edp h SER 6 N 7.16 0.15 0.00 5.45 4.64 -2.03 -3.49 113.55 125.43 2edp h SER 6 Ca -0.43 -0.95 0.00 0.00 -0.47 0.00 0.00 61.79 59.94 2edp h SER 6 Cb 1.13 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2edp h SER 6 CO 0.48 1.18 0.00 0.61 -0.87 0.00 0.00 176.83 178.23 2edp n GLY 7 N 1.62 1.48 0.00 -0.77 0.00 -1.26 -4.87 105.19 101.38 2edp n GLY 7 Ca -0.13 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 0.13 3.05 -0.02 0.00 -1.26 -5.16 105.19 101.93 2edp n GLY 8 Ca 0.00 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 2edp n GLY 8 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edp s SER 9 N 0.00 1.88 0.55 1.61 1.04 -1.26 -5.07 113.70 112.44 2edp s SER 9 Ca 0.00 -0.32 -0.13 0.00 0.48 0.00 0.00 55.95 55.98 2edp s SER 9 Cb 0.00 -0.81 -0.06 0.00 0.10 0.00 0.00 66.02 65.25 2edp s SER 9 CO 0.00 0.06 0.98 -0.36 0.98 0.00 0.00 173.24 174.90 2edp s PHE 10 N 0.54 3.53 -0.18 5.02 0.40 -1.26 -2.33 117.98 123.69 2edp s PHE 10 Ca -0.13 1.33 0.00 0.00 -0.60 0.00 0.00 56.93 57.54 2edp s PHE 10 Cb -0.15 -2.71 0.01 0.00 0.51 0.00 0.00 43.02 40.68 2edp s PHE 10 CO 0.04 -0.47 -0.18 -1.14 0.70 0.00 0.00 175.22 174.17 2edp s GLN 11 N -4.53 3.05 -0.71 0.44 0.74 -1.01 -4.84 119.66 112.80 2edp s GLN 11 Ca 0.56 -0.80 -0.16 0.00 0.05 0.00 0.00 55.36 55.02 2edp s GLN 11 Cb -0.10 -2.63 0.17 0.00 1.10 0.00 0.00 33.01 31.54 2edp s GLN 11 CO 0.41 -0.20 0.71 0.71 -0.55 0.00 0.00 175.29 176.37 2edp s TYR 12 N 1.29 3.43 -0.42 1.67 1.51 -1.25 -2.63 117.35 120.95 2edp s TYR 12 Ca 0.04 -1.57 -0.15 0.00 -1.01 0.00 0.00 57.07 54.38 2edp s TYR 12 Cb -0.13 -3.88 0.03 0.00 -0.11 0.00 0.00 41.96 37.86 2edp s TYR 12 CO -0.11 -1.09 0.33 0.54 -1.11 0.00 0.00 175.55 174.11 2edp s VAL 13 N 1.20 5.23 -1.13 0.71 0.11 -1.05 -4.89 120.40 120.59 2edp s VAL 13 Ca 0.14 -0.65 -0.23 0.00 -2.93 0.00 0.00 61.98 58.30 2edp s VAL 13 Cb -0.18 -3.97 -0.08 0.00 -1.53 0.00 0.00 36.38 30.62 2edp s VAL 13 CO -0.03 -0.36 1.94 -2.16 -3.33 0.00 0.00 175.10 171.16 2edp s PRO 14 N 1.75 2.51 -0.79 1.54 0.04 -1.25 -3.57 135.00 135.23 2edp s PRO 14 Ca 0.06 -1.00 -0.23 0.00 0.04 0.00 0.00 61.00 59.87 2edp s PRO 14 Cb -0.19 -5.21 -0.17 0.00 0.04 0.00 0.00 34.50 28.97 2edp s PRO 14 CO 0.10 -3.87 2.38 0.28 0.04 0.00 0.00 177.00 175.94 2edp n VAL 15 N 7.82 -0.01 -2.75 -0.36 0.31 0.15 -4.68 118.33 118.80 2edp n VAL 15 Ca 0.44 -0.52 -0.43 0.00 -0.01 0.00 0.00 64.34 63.82 2edp n VAL 15 Cb 0.47 -1.70 -0.03 0.00 -0.91 0.00 0.00 33.84 31.67 2edp n VAL 15 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2edp s GLN 16 N 8.50 3.54 0.19 5.55 0.74 -1.26 -2.98 119.66 133.95 2edp s GLN 16 Ca 1.03 0.20 -0.09 0.00 0.05 0.00 0.00 55.36 56.54 2edp s GLN 16 Cb -0.31 -3.95 -0.07 0.00 1.10 0.00 0.00 33.01 29.78 2edp s GLN 16 CO 0.21 -1.34 0.51 -0.51 -0.55 0.00 0.00 175.29 173.61 2edp s LEU 17 N 4.05 4.22 -0.02 3.68 1.43 0.11 -4.91 118.68 127.24 2edp s LEU 17 Ca 0.39 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.36 2edp s LEU 17 Cb -0.09 -3.53 0.03 0.00 0.03 0.00 0.00 46.19 42.63 2edp s LEU 17 CO 0.27 -0.01 0.02 -1.10 0.23 0.00 0.00 176.35 175.75 2edp s GLN 18 N -2.63 0.01 0.00 1.70 -0.21 -1.26 -1.68 119.66 115.59 2edp s GLN 18 Ca 0.44 0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.98 2edp s GLN 18 Cb -0.12 -0.27 0.00 0.00 1.00 0.00 0.00 33.01 33.62 2edp s GLN 18 CO 0.21 -0.15 0.00 0.41 -2.12 0.00 0.00 175.29 173.64 2edp n GLY 19 N 4.10 1.18 0.00 3.09 0.00 -0.63 -5.03 105.19 107.90 2edp n GLY 19 Ca -0.27 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 1.87 3.60 -0.02 0.00 -1.14 -4.95 105.19 104.55 2edp n GLY 20 Ca 0.00 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.27 0.54 0.32 4.61 0.00 -1.26 -4.54 121.76 119.16 2edp s ALA 21 Ca 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 51.96 51.63 2edp s ALA 21 Cb 0.00 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.78 2edp s ALA 21 CO 0.00 -3.16 1.23 -1.25 0.00 0.00 0.00 175.76 172.58 2edp s PRO 22 N -4.69 4.43 -0.17 0.00 0.04 -1.26 -5.13 135.00 128.23 2edp s PRO 22 Ca 0.66 2.05 -0.25 0.00 0.04 0.00 0.00 61.00 63.50 2edp s PRO 22 Cb -0.22 -3.09 -0.23 0.00 0.04 0.00 0.00 34.50 31.00 2edp s PRO 22 CO 0.61 -0.06 0.53 -1.49 0.04 0.00 0.00 177.00 176.62 2edp h TRP 23 N 3.48 0.02 0.00 0.56 4.06 -1.99 -3.41 115.95 118.68 2edp h TRP 23 Ca -0.48 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.45 2edp h TRP 23 Cb 1.22 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.38 2edp h TRP 23 CO 0.57 1.23 0.00 0.41 -3.56 0.00 0.00 178.44 177.09 2edp n GLY 24 N 1.54 0.77 3.63 1.49 0.00 -1.26 0.72 105.19 112.07 2edp n GLY 24 Ca -0.20 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.48 -0.71 0.40 1.61 -0.12 -1.26 -2.17 117.98 114.26 2edp s PHE 25 Ca 0.00 1.71 0.05 0.00 -0.05 0.00 0.00 56.93 58.64 2edp s PHE 25 Cb 0.00 0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.68 2edp s PHE 25 CO 0.00 -0.34 0.18 0.95 -0.05 0.00 0.00 175.22 175.96 2edp s THR 26 N 0.38 0.36 0.25 -4.49 -4.23 0.16 -4.98 115.64 103.10 2edp s THR 26 Ca 0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 2edp s THR 26 Cb -0.05 -2.34 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 2edp s THR 26 CO -0.02 0.00 0.23 -0.76 -0.54 0.00 0.00 174.62 173.53 2edp s LEU 27 N -3.56 1.22 0.29 4.79 1.43 -1.26 -1.61 118.68 119.98 2edp s LEU 27 Ca 0.27 -1.45 0.00 0.00 -1.03 0.00 0.00 54.13 51.92 2edp s LEU 27 Cb 0.02 0.63 -0.02 0.00 0.03 0.00 0.00 46.19 46.85 2edp s LEU 27 CO 0.19 -0.96 0.32 -1.59 0.23 0.00 0.00 176.35 174.53 2edp s LYS 28 N -3.88 1.64 7.89 1.70 0.00 -1.11 -4.60 119.74 121.38 2edp s LYS 28 Ca 0.37 -1.77 0.00 0.00 0.00 0.00 0.00 55.97 54.58 2edp s LYS 28 Cb 0.05 0.36 0.00 0.00 0.00 0.00 0.00 37.83 38.24 2edp s LYS 28 CO 0.16 -0.62 0.00 0.41 0.00 0.00 0.00 175.35 175.30 2edp n GLY 29 N -0.49 3.65 0.00 0.59 0.00 -1.26 -3.82 105.19 103.86 2edp n GLY 29 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 1.19 0.27 -0.02 0.00 0.58 -4.46 105.19 102.75 2edp n GLY 30 Ca 0.00 -2.02 0.06 0.00 0.00 0.00 0.00 46.02 44.06 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 0.08 -0.94 0.99 5.85 -1.71 0.16 115.31 119.74 2edp h LEU 31 Ca 0.00 0.14 0.28 0.00 0.84 0.00 0.00 57.88 59.14 2edp h LEU 31 Cb 0.00 0.17 -0.16 0.00 0.37 0.00 0.00 40.66 41.04 2edp h LEU 31 CO 0.00 -0.01 0.20 -0.08 -0.34 0.00 0.00 178.44 178.21 2edp h GLU 32 N 0.31 0.10 -0.58 1.25 4.22 -1.83 0.29 114.58 118.33 2edp h GLU 32 Ca 0.42 -0.01 -0.40 0.00 0.08 0.00 0.00 59.36 59.46 2edp h GLU 32 Cb 0.72 -0.02 -0.27 0.00 0.50 0.00 0.00 28.75 29.67 2edp h GLU 32 CO -0.49 0.06 -0.37 0.72 -2.18 0.00 0.00 179.01 176.76 2edp n HIS 33 N -5.33 2.01 -3.32 0.92 8.25 -0.10 -4.94 115.22 112.71 2edp n HIS 33 Ca 0.25 -2.08 -0.25 0.00 -0.26 0.00 0.00 57.72 55.38 2edp n HIS 33 Cb 0.81 -0.52 -0.05 0.00 1.12 0.00 0.00 29.99 31.35 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 -4.97 2.22 -0.46 0.00 0.41 0.36 -4.91 118.70 111.34 2edp s GLU 35 Ca 0.49 -1.26 -0.28 0.00 -0.41 0.00 0.00 54.97 53.51 2edp s GLU 35 Cb -0.28 -2.22 -0.02 0.00 -1.78 0.00 0.00 34.13 29.83 2edp s GLU 35 CO 0.60 0.42 1.77 -1.25 -0.49 0.00 0.00 175.26 176.31 2edp s PRO 36 N -3.08 3.06 -0.79 0.39 0.04 -1.26 -0.31 135.00 133.05 2edp s PRO 36 Ca 0.27 1.00 -0.26 0.00 0.04 0.00 0.00 61.00 62.06 2edp s PRO 36 Cb -0.08 -4.26 -0.10 0.00 0.04 0.00 0.00 34.50 30.10 2edp s PRO 36 CO 0.17 -2.20 2.23 -1.17 0.04 0.00 0.00 177.00 176.08 2edp s LEU 37 N 7.64 3.03 0.14 -3.56 2.96 -1.26 -4.45 118.68 123.18 2edp s LEU 37 Ca 0.72 -0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.62 2edp s LEU 37 Cb -0.17 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 2edp s LEU 37 CO 0.28 -3.35 -0.12 0.42 -1.32 0.00 0.00 176.35 172.26 2edp s THR 38 N 12.77 1.26 -0.25 3.68 -4.23 -1.25 -2.87 115.64 124.75 2edp s THR 38 Ca 0.85 -1.89 -0.40 0.00 -1.18 0.00 0.00 61.69 59.07 2edp s THR 38 Cb -0.11 -1.68 -0.15 0.00 1.34 0.00 0.00 72.50 71.90 2edp s THR 38 CO 0.08 -0.58 1.74 0.52 -0.54 0.00 0.00 174.62 175.84 2edp n VAL 39 N 0.17 0.31 -0.08 2.29 0.31 -0.03 -2.74 118.33 118.55 2edp n VAL 39 Ca -0.13 -0.06 -0.23 0.00 -0.01 0.00 0.00 64.34 63.92 2edp n VAL 39 Cb 0.59 -1.26 -0.12 0.00 -0.91 0.00 0.00 33.84 32.14 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 5.36 1.99 -3.75 4.52 3.41 -0.63 -2.83 113.62 121.68 2edp n SER 40 Ca 0.26 0.24 -0.13 0.00 -0.26 0.00 0.00 58.87 58.98 2edp n SER 40 Cb 0.14 -0.81 -0.09 0.00 -0.26 0.00 0.00 64.21 63.19 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 -2.48 0.63 -0.23 4.33 2.36 -1.25 -4.89 119.74 118.22 2edp s LYS 41 Ca -0.30 -0.07 -0.04 0.00 -2.55 0.00 0.00 55.97 53.01 2edp s LYS 41 Cb 0.08 0.28 0.08 0.00 -1.05 0.00 0.00 37.83 37.22 2edp s LYS 41 CO 0.63 -0.16 0.09 0.42 1.55 0.00 0.00 175.35 177.88 2edp s ILE 42 N -1.07 0.17 -0.54 5.43 1.01 -1.26 0.36 121.20 125.30 2edp s ILE 42 Ca -0.11 -0.58 -0.38 0.00 0.00 0.00 0.00 60.65 59.58 2edp s ILE 42 Cb -0.05 -0.93 -0.17 0.00 0.01 0.00 0.00 42.46 41.33 2edp s ILE 42 CO 0.04 -0.45 2.27 -0.62 0.00 0.00 0.00 174.94 176.18 2edp n GLU 43 N 5.17 0.37 -1.62 2.79 1.02 -0.92 -4.78 120.64 122.67 2edp n GLU 43 Ca -0.07 0.09 -0.44 0.00 -0.02 0.00 0.00 57.16 56.72 2edp n GLU 43 Cb 0.46 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 29.96 2edp n GLU 43 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2edp n ASP 44 N 9.13 3.59 0.00 1.62 2.03 -1.26 -1.94 116.55 129.72 2edp n ASP 44 Ca 0.52 0.59 0.00 0.00 0.52 0.00 0.00 54.79 56.42 2edp n ASP 44 Cb 0.08 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 38.98 2edp n ASP 44 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2edp n GLY 45 N 5.16 2.96 0.00 0.27 0.00 -1.26 -5.08 105.19 107.24 2edp n GLY 45 Ca 0.26 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.00 0.35 -0.02 0.00 -0.82 -4.33 105.19 97.37 2edp n GLY 46 Ca 0.00 -0.99 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.81 -0.99 1.61 1.79 0.06 0.05 116.57 118.29 2edp h LYS 47 Ca 0.00 0.06 0.30 0.00 -2.18 0.00 0.00 60.65 58.82 2edp h LYS 47 Cb 0.00 0.18 -0.18 0.00 -1.58 0.00 0.00 32.23 30.65 2edp h LYS 47 CO 0.00 -0.49 0.13 0.00 -1.08 0.00 0.00 179.45 178.01 2edp h ALA 48 N -0.83 1.35 -0.04 3.86 0.00 -1.72 0.28 119.26 122.16 2edp h ALA 48 Ca -0.09 0.32 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2edp h ALA 48 Cb 0.69 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2edp h ALA 48 CO 0.14 -0.63 -0.18 0.00 0.00 0.00 0.00 179.25 178.57 2edp h ALA 49 N 1.98 0.07 -0.98 0.00 0.00 -1.77 -3.19 119.26 115.37 2edp h ALA 49 Ca 0.64 -0.40 0.20 0.00 0.00 0.00 0.00 54.91 55.35 2edp h ALA 49 Cb 1.40 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 19.08 2edp h ALA 49 CO -0.88 0.04 0.58 -0.07 0.00 0.00 0.00 179.25 178.91 2edp h LEU 50 N -0.38 0.71 -1.03 0.00 3.38 0.15 0.14 115.31 118.28 2edp h LEU 50 Ca -0.01 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2edp h LEU 50 Cb 0.84 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2edp h LEU 50 CO 0.04 0.22 0.37 0.28 0.09 0.00 0.00 178.44 179.44 2edp h SER 51 N 0.70 0.95 -2.09 -0.43 0.02 -0.84 -3.46 113.55 108.39 2edp h SER 51 Ca 0.58 -0.10 -0.39 0.00 -0.84 0.00 0.00 61.79 61.04 2edp h SER 51 Cb 0.94 -0.24 -0.07 0.00 0.14 0.00 0.00 62.40 63.17 2edp h SER 51 CO -0.41 0.79 -0.45 0.00 -1.14 0.00 0.00 176.83 175.63 2edp n GLN 52 N -4.33 -1.47 -0.10 3.45 6.02 0.50 -4.85 117.38 116.59 2edp n GLN 52 Ca 0.07 1.02 -0.11 0.00 -0.01 0.00 0.00 57.00 57.98 2edp n GLN 52 Cb 0.13 -5.51 -0.14 0.00 1.02 0.00 0.00 30.24 25.74 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 -2.71 0.86 -4.41 -1.09 4.76 -1.26 -4.99 118.16 109.32 2edp n LYS 53 Ca -0.22 0.02 -0.27 0.00 -2.87 0.00 0.00 58.31 54.97 2edp n LYS 53 Cb 0.66 -1.48 -0.12 0.00 -1.84 0.00 0.00 35.03 32.25 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 -2.46 1.49 -0.02 1.97 0.23 -1.26 -5.00 119.30 114.25 2edp s MET 54 Ca -0.14 -1.48 -0.25 0.00 -1.03 0.00 0.00 55.69 52.79 2edp s MET 54 Cb 0.06 -1.86 0.05 0.00 -1.53 0.00 0.00 34.83 31.55 2edp s MET 54 CO 0.72 0.41 0.55 0.50 -2.03 0.00 0.00 175.02 175.17 2edp s ARG 55 N -2.52 0.95 -0.68 3.16 3.52 -1.26 -4.83 118.95 117.28 2edp s ARG 55 Ca 0.19 0.04 -0.37 0.00 -0.13 0.00 0.00 55.73 55.47 2edp s ARG 55 Cb -0.08 0.44 -0.19 0.00 -1.56 0.00 0.00 34.95 33.55 2edp s ARG 55 CO 0.09 -0.30 2.27 0.25 -0.81 0.00 0.00 175.30 176.81 2edp n THR 56 N 0.92 0.00 0.00 4.11 -2.24 -1.26 -1.85 114.28 113.95 2edp n THR 56 Ca -0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2edp n THR 56 Cb 0.57 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 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 6.74 0.89 3.83 3.38 0.00 -1.13 -5.00 105.19 113.90 2edp n GLY 57 Ca 0.57 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.26 2edp n GLY 57 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2edp s ASP 58 N 0.00 6.83 -0.38 1.61 1.47 -0.77 -4.81 116.67 120.62 2edp s ASP 58 Ca 0.00 1.65 -0.13 0.00 1.18 0.00 0.00 52.55 55.24 2edp s ASP 58 Cb 0.00 -2.53 0.01 0.00 -0.34 0.00 0.00 42.92 40.06 2edp s ASP 58 CO 0.00 -0.44 0.25 -0.70 0.68 0.00 0.00 175.17 174.96 2edp s GLU 59 N -3.49 3.08 -0.35 2.11 2.12 -1.20 -0.86 118.70 120.11 2edp s GLU 59 Ca 0.61 -0.93 -0.21 0.00 0.36 0.00 0.00 54.97 54.80 2edp s GLU 59 Cb -0.09 -3.85 0.00 0.00 0.26 0.00 0.00 34.13 30.45 2edp s GLU 59 CO 0.19 -0.65 0.64 -1.17 -0.54 0.00 0.00 175.26 173.74 2edp s LEU 60 N 1.65 4.23 0.00 2.70 0.20 -1.14 -2.00 118.68 124.33 2edp s LEU 60 Ca 0.04 0.21 0.00 0.00 0.69 0.00 0.00 54.13 55.07 2edp s LEU 60 Cb -0.19 -2.80 0.00 0.00 -0.43 0.00 0.00 46.19 42.77 2edp s LEU 60 CO 0.09 -0.58 0.11 1.33 -0.29 0.00 0.00 176.35 177.01 2edp n VAL 61 N 5.56 0.00 -3.90 1.68 0.24 -1.24 -4.86 118.33 115.81 2edp n VAL 61 Ca -0.01 -0.46 -0.24 0.00 -2.04 0.00 0.00 64.34 61.59 2edp n VAL 61 Cb 0.49 1.02 -0.17 0.00 -1.47 0.00 0.00 33.84 33.70 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 -0.69 1.71 -0.19 -1.34 3.04 -1.25 -0.18 114.94 116.05 2edp s ASN 62 Ca 0.00 -0.17 0.00 0.00 0.04 0.00 0.00 52.86 52.73 2edp s ASN 62 Cb 0.00 -0.59 0.04 0.00 -1.54 0.00 0.00 41.25 39.16 2edp s ASN 62 CO 0.00 -0.14 -0.09 -0.63 -3.04 0.00 0.00 177.10 173.20 2edp s ILE 63 N 1.70 1.45 -1.90 -5.21 1.01 -0.57 -2.14 121.20 115.54 2edp s ILE 63 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.81 2edp s ILE 63 Cb -0.13 -1.56 0.00 0.00 0.01 0.00 0.00 42.46 40.79 2edp s ILE 63 CO -0.05 0.17 0.00 0.59 0.00 0.00 0.00 174.94 175.64 2edp n ASN 64 N 4.75 -5.46 0.00 3.58 3.02 0.25 -1.00 115.26 120.40 2edp n ASN 64 Ca -0.14 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 2edp n ASN 64 Cb 0.47 -4.69 0.00 0.00 -0.61 0.00 0.00 39.78 34.95 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 -0.68 0.67 3.15 7.41 0.00 -1.24 -4.92 105.19 109.59 2edp n GLY 65 Ca -0.22 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.00 2.37 -0.01 2.61 2.01 -0.17 -5.10 115.64 115.36 2edp s THR 66 Ca 0.00 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.75 2edp s THR 66 Cb 0.00 -2.08 -0.06 0.00 0.01 0.00 0.00 72.50 70.37 2edp s THR 66 CO 0.00 0.42 1.46 -2.16 -0.69 0.00 0.00 174.62 173.65 2edp s PRO 67 N 1.30 4.26 -0.88 4.92 0.04 -1.26 -1.51 135.00 141.87 2edp s PRO 67 Ca 0.03 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.95 2edp s PRO 67 Cb -0.14 -3.63 0.22 0.00 0.04 0.00 0.00 34.50 30.98 2edp s PRO 67 CO -0.10 -0.63 0.85 -0.51 0.04 0.00 0.00 177.00 176.65 2edp s LEU 68 N 2.67 6.53 -0.63 -3.56 1.43 0.75 -4.96 118.68 120.90 2edp s LEU 68 Ca 0.66 -2.74 -0.25 0.00 -1.03 0.00 0.00 54.13 50.77 2edp s LEU 68 Cb -0.32 -2.23 -0.21 0.00 0.03 0.00 0.00 46.19 43.46 2edp s LEU 68 CO 0.27 -0.59 1.85 0.00 0.23 0.00 0.00 176.35 178.11 2edp n TYR 69 N 4.09 1.45 -2.83 0.29 0.18 -1.26 -4.40 117.16 114.68 2edp n TYR 69 Ca 0.16 -1.35 -0.01 0.00 1.88 0.00 0.00 57.90 58.58 2edp n TYR 69 Cb 0.46 -1.61 -0.01 0.00 -0.38 0.00 0.00 39.34 37.81 2edp n TYR 69 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2edp n GLY 70 N 4.87 -3.24 3.63 -7.48 0.00 -1.26 -4.96 105.19 96.76 2edp n GLY 70 Ca 0.48 0.52 -0.05 0.00 0.00 0.00 0.00 46.02 46.97 2edp n GLY 70 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edp s SER 71 N -1.28 -0.16 -0.19 1.61 0.15 -1.26 -4.09 113.70 108.49 2edp s SER 71 Ca -0.04 0.25 -0.15 0.00 0.70 0.00 0.00 55.95 56.71 2edp s SER 71 Cb 0.00 0.24 -0.08 0.00 -1.71 0.00 0.00 66.02 64.48 2edp s SER 71 CO 0.57 -0.09 -0.24 -1.14 1.20 0.00 0.00 173.24 173.54 2edp n ARG 72 N 1.26 0.52 0.00 5.44 0.63 -1.26 -4.19 116.66 119.06 2edp n ARG 72 Ca -0.08 0.35 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 2edp n ARG 72 Cb 0.57 -1.55 0.00 0.00 0.45 0.00 0.00 32.46 31.93 2edp n ARG 72 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2edp n GLN 73 N -4.46 0.00 -0.29 -0.14 3.00 -1.26 -1.46 117.38 112.77 2edp n GLN 73 Ca -0.21 0.57 -0.02 0.00 -0.01 0.00 0.00 57.00 57.33 2edp n GLN 73 Cb 0.53 -1.23 0.02 0.00 0.00 0.00 0.00 30.24 29.56 2edp n GLN 73 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2edp n GLU 74 N -1.69 -0.19 0.00 -1.09 4.07 -1.26 -0.11 120.64 120.36 2edp n GLU 74 Ca 0.00 1.13 0.00 0.00 -0.06 0.00 0.00 57.16 58.23 2edp n GLU 74 Cb 0.00 -1.67 0.00 0.00 -0.06 0.00 0.00 31.44 29.71 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 -3.59 -0.11 -0.22 4.31 0.00 -0.90 -0.01 120.51 119.99 2edp n ALA 75 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 2edp n ALA 75 Cb 0.28 0.23 0.05 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.82 -0.87 0.00 3.38 -0.13 0.18 115.31 117.05 2edp h LEU 76 Ca 0.00 0.21 0.19 0.00 0.09 0.00 0.00 57.88 58.37 2edp h LEU 76 Cb 0.00 0.47 -0.11 0.00 0.09 0.00 0.00 40.66 41.11 2edp h LEU 76 CO 0.00 -0.25 0.41 0.40 0.09 0.00 0.00 178.44 179.09 2edp h ILE 77 N -0.06 0.59 -0.90 1.22 2.04 -0.22 0.10 117.51 120.28 2edp h ILE 77 Ca 0.29 -0.17 0.10 0.00 1.00 0.00 0.00 64.86 66.08 2edp h ILE 77 Cb 0.52 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 36.56 2edp h ILE 77 CO -0.69 0.09 0.54 0.25 0.00 0.00 0.00 178.15 178.35 2edp h LEU 78 N 0.50 0.79 -0.19 1.44 5.85 0.27 -2.14 115.31 121.83 2edp h LEU 78 Ca 0.51 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.26 2edp h LEU 78 Cb 0.87 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 2edp h LEU 78 CO -0.45 0.44 0.02 0.40 -0.34 0.00 0.00 178.44 178.51 2edp h ILE 79 N 0.89 1.23 -0.70 4.05 2.04 -0.60 -3.06 117.51 121.36 2edp h ILE 79 Ca 0.44 -0.77 0.26 0.00 1.00 0.00 0.00 64.86 65.79 2edp h ILE 79 Cb 0.41 1.37 -0.13 0.00 -0.74 0.00 0.00 36.82 37.74 2edp h ILE 79 CO -0.25 0.24 0.25 0.29 0.00 0.00 0.00 178.15 178.67 2edp n LYS 80 N -4.74 -0.05 -1.76 2.37 4.76 -0.81 0.22 118.16 118.16 2edp n LYS 80 Ca -0.04 1.00 -0.35 0.00 -2.87 0.00 0.00 58.31 56.05 2edp n LYS 80 Cb 0.20 -1.72 0.05 0.00 -1.84 0.00 0.00 35.03 31.72 2edp n LYS 80 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2edp n GLY 81 N -1.24 5.82 3.53 0.72 0.00 -1.16 -5.02 105.19 107.84 2edp n GLY 81 Ca 0.23 -2.47 -0.30 0.00 0.00 0.00 0.00 46.02 43.48 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 -1.95 0.60 0.37 1.61 1.04 0.60 -5.07 113.70 110.89 2edp s SER 82 Ca 0.57 0.77 0.01 0.00 0.48 0.00 0.00 55.95 57.78 2edp s SER 82 Cb 0.46 -1.10 -0.00 0.00 0.10 0.00 0.00 66.02 65.48 2edp s SER 82 CO -0.18 -4.34 0.04 0.33 0.98 0.00 0.00 173.24 170.08 2edp n PHE 83 N -4.92 0.62 0.31 5.02 7.35 -1.26 -4.99 117.46 119.58 2edp n PHE 83 Ca 0.12 -2.02 0.14 0.00 -0.76 0.00 0.00 57.45 54.93 2edp n PHE 83 Cb 0.59 -0.16 0.72 0.00 0.35 0.00 0.00 39.48 40.97 2edp n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2edp h ARG 84 N 0.00 0.00 -3.64 -4.13 3.08 -1.95 -3.39 114.38 104.34 2edp h ARG 84 Ca -0.30 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.46 2edp h ARG 84 Cb 0.99 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.72 2edp h ARG 84 CO 0.49 0.00 -0.73 0.42 -1.07 0.00 0.00 179.97 179.08 2edp s ILE 85 N -4.13 0.02 -0.02 2.04 1.01 -1.26 -1.60 121.20 117.25 2edp s ILE 85 Ca -0.03 0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.75 2edp s ILE 85 Cb 0.08 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.41 2edp s ILE 85 CO 0.26 0.08 -0.04 -0.22 0.00 0.00 0.00 174.94 175.03 2edp s LEU 86 N 0.73 3.33 -0.26 2.97 2.96 -0.67 -4.91 118.68 122.83 2edp s LEU 86 Ca -0.06 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.81 2edp s LEU 86 Cb -0.09 -1.86 0.08 0.00 0.50 0.00 0.00 46.19 44.82 2edp s LEU 86 CO -0.02 0.31 0.02 -0.54 -1.32 0.00 0.00 176.35 174.80 2edp s LYS 87 N -1.27 1.16 -0.08 1.98 1.02 -1.26 0.04 119.74 121.33 2edp s LYS 87 Ca 0.16 -1.00 0.04 0.00 0.02 0.00 0.00 55.97 55.20 2edp s LYS 87 Cb -0.11 -2.40 -0.00 0.00 -0.52 0.00 0.00 37.83 34.80 2edp s LYS 87 CO 0.06 -0.75 -0.23 -0.51 -0.92 0.00 0.00 175.35 173.00 2edp s LEU 88 N 1.49 2.04 -0.47 3.17 1.43 -1.16 0.84 118.68 126.03 2edp s LEU 88 Ca 0.01 -0.51 -0.07 0.00 -1.03 0.00 0.00 54.13 52.53 2edp s LEU 88 Cb -0.18 -1.33 0.12 0.00 0.03 0.00 0.00 46.19 44.83 2edp s LEU 88 CO -0.12 0.17 0.32 -0.63 0.23 0.00 0.00 176.35 176.32 2edp s ILE 89 N 0.21 3.94 -0.02 -0.59 1.09 -0.91 0.32 121.20 125.24 2edp s ILE 89 Ca -0.14 -1.95 -0.03 0.00 -1.10 0.00 0.00 60.65 57.43 2edp s ILE 89 Cb -0.16 -3.62 -0.04 0.00 -1.06 0.00 0.00 42.46 37.58 2edp s ILE 89 CO 0.07 -0.76 0.18 0.68 -0.10 0.00 0.00 174.94 175.00 2edp s VAL 90 N 1.19 5.43 -0.22 2.92 -7.23 -1.23 -3.67 120.40 117.58 2edp s VAL 90 Ca 0.07 -0.13 -0.03 0.00 -1.81 0.00 0.00 61.98 60.08 2edp s VAL 90 Cb -0.25 -3.52 -0.00 0.00 0.56 0.00 0.00 36.38 33.17 2edp s VAL 90 CO -0.02 0.35 -0.06 0.00 -0.31 0.00 0.00 175.10 175.06 2edp s ARG 91 N -1.85 3.31 -0.05 4.82 1.70 -0.85 -2.51 118.95 123.53 2edp s ARG 91 Ca 0.26 -0.66 0.01 0.00 -0.47 0.00 0.00 55.73 54.87 2edp s ARG 91 Cb -0.13 -2.96 0.02 0.00 -0.57 0.00 0.00 34.95 31.32 2edp s ARG 91 CO 0.17 -0.21 -0.06 -0.98 -1.08 0.00 0.00 175.30 173.15 2edp s ARG 92 N 1.45 0.95 -0.25 3.89 1.70 -1.08 -3.23 118.95 122.38 2edp s ARG 92 Ca 0.06 -0.15 -0.42 0.00 -0.47 0.00 0.00 55.73 54.74 2edp s ARG 92 Cb -0.14 -0.91 -0.18 0.00 -0.57 0.00 0.00 34.95 33.15 2edp s ARG 92 CO -0.05 -0.06 1.50 0.54 -1.08 0.00 0.00 175.30 176.16 2edp n ARG 93 N 3.98 0.52 -1.39 3.89 1.74 -1.26 -2.41 116.66 121.72 2edp n ARG 93 Ca -0.25 0.19 -0.58 0.00 -0.77 0.00 0.00 57.85 56.44 2edp n ARG 93 Cb 0.51 -1.77 -0.10 0.00 -1.02 0.00 0.00 32.46 30.09 2edp n ARG 93 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2edp n ASN 94 N 3.72 0.92 -3.74 0.55 5.15 -0.99 -4.89 115.26 115.99 2edp n ASN 94 Ca 0.26 0.89 -0.13 0.00 -0.60 0.00 0.00 54.58 54.99 2edp n ASN 94 Cb 0.06 -0.79 -0.10 0.00 -0.53 0.00 0.00 39.78 38.42 2edp n ASN 94 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2edp s SER 95 N 3.70 -0.36 0.06 1.20 1.04 -1.26 -5.02 113.70 113.06 2edp s SER 95 Ca 0.99 0.59 0.00 0.00 0.48 0.00 0.00 55.95 58.01 2edp s SER 95 Cb -1.34 0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.43 2edp s SER 95 CO 0.68 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 175.27 2edp n GLY 96 N 2.37 -1.91 0.00 7.32 0.00 -1.26 -4.94 105.19 106.77 2edp n GLY 96 Ca -0.16 0.59 0.07 0.00 0.00 0.00 0.00 46.02 46.53 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 -2.27 0.32 -4.24 1.61 -0.04 -1.26 -4.74 135.00 124.39 2edp n PRO 97 Ca 0.00 0.09 -0.24 0.00 -0.04 0.00 0.00 63.50 63.30 2edp n PRO 97 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 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 -2.34 4.35 -0.31 3.54 0.01 -1.26 -5.12 113.70 112.57 2edp s SER 98 Ca 0.18 -0.97 -0.08 0.00 1.31 0.00 0.00 55.95 56.39 2edp s SER 98 Cb 0.10 -0.56 0.01 0.00 0.21 0.00 0.00 66.02 65.78 2edp s SER 98 CO 0.21 -0.34 0.11 -0.94 0.41 0.00 0.00 173.24 172.68 2edp s SER 99 N -3.79 5.27 0.00 2.44 1.04 -1.26 -5.07 113.70 112.32 2edp s SER 99 Ca 0.37 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 56.07 2edp s SER 99 Cb 0.01 -1.91 0.00 0.00 0.10 0.00 0.00 66.02 64.21 2edp s SER 99 CO 0.21 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.82