#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edp s SER 2 N 0.00 6.10 -1.65 1.61 0.15 -1.26 -4.63 113.70 114.01 2edp s SER 2 Ca 0.00 -1.89 -0.18 0.00 0.70 0.00 0.00 55.95 54.58 2edp s SER 2 Cb 0.00 -2.16 0.18 0.00 -1.71 0.00 0.00 66.02 62.33 2edp s SER 2 CO 0.00 -0.80 0.45 -1.20 1.20 0.00 0.00 173.24 172.90 2edp n SER 3 N 5.07 -1.25 -3.68 5.45 7.64 -1.26 -4.85 113.62 120.74 2edp n SER 3 Ca -0.11 -1.13 -0.28 0.00 1.01 0.00 0.00 58.87 58.37 2edp n SER 3 Cb 0.41 -1.44 -0.11 0.00 -1.01 0.00 0.00 64.21 62.05 2edp n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2edp s GLY 4 N -3.22 2.10 0.19 0.23 0.00 -1.26 -5.09 107.32 100.27 2edp s GLY 4 Ca 0.64 -3.14 0.00 0.00 0.00 0.00 0.00 44.72 42.22 2edp s GLY 4 CO 0.92 1.55 0.07 -1.35 0.00 0.00 0.00 173.10 174.29 2edp s SER 5 N -0.63 0.74 0.31 1.64 1.04 -1.26 -5.00 113.70 110.54 2edp s SER 5 Ca 0.27 -1.29 0.06 0.00 0.48 0.00 0.00 55.95 55.47 2edp s SER 5 Cb -0.04 0.24 -0.06 0.00 0.10 0.00 0.00 66.02 66.25 2edp s SER 5 CO -0.16 -0.72 -0.03 -0.55 0.98 0.00 0.00 173.24 172.77 2edp s SER 6 N -3.18 2.91 0.36 7.02 0.15 -1.26 -5.13 113.70 114.57 2edp s SER 6 Ca 0.32 -1.25 0.07 0.00 0.70 0.00 0.00 55.95 55.78 2edp s SER 6 Cb 0.07 -0.20 -0.03 0.00 -1.71 0.00 0.00 66.02 64.16 2edp s SER 6 CO 0.08 -0.40 0.26 -0.83 1.20 0.00 0.00 173.24 173.55 2edp s GLY 7 N -3.50 2.48 -0.32 9.45 0.00 -1.26 -5.09 107.32 109.08 2edp s GLY 7 Ca 0.32 -1.90 0.18 0.00 0.00 0.00 0.00 44.72 43.32 2edp s GLY 7 CO 0.14 -1.55 0.99 0.61 0.00 0.00 0.00 173.10 173.28 2edp n GLY 8 N -0.72 1.90 3.66 0.20 0.00 -1.26 -4.68 105.19 104.29 2edp n GLY 8 Ca 0.05 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 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 -3.26 6.92 0.64 1.61 0.01 -1.26 -4.89 113.70 113.47 2edp s SER 9 Ca 0.29 1.70 -0.12 0.00 1.31 0.00 0.00 55.95 59.13 2edp s SER 9 Cb 0.43 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 64.10 2edp s SER 9 CO 0.01 -0.78 1.04 -0.36 0.41 0.00 0.00 173.24 173.56 2edp s PHE 10 N 3.55 3.38 -0.11 2.43 0.40 -1.26 -3.83 117.98 122.54 2edp s PHE 10 Ca 0.55 1.37 0.02 0.00 -0.60 0.00 0.00 56.93 58.28 2edp s PHE 10 Cb -0.22 -2.80 0.01 0.00 0.51 0.00 0.00 43.02 40.52 2edp s PHE 10 CO 0.15 -0.91 -0.18 -1.14 0.70 0.00 0.00 175.22 173.85 2edp s GLN 11 N -4.98 2.44 -0.33 0.44 0.74 -1.24 -4.92 119.66 111.80 2edp s GLN 11 Ca 0.57 -0.65 -0.15 0.00 0.05 0.00 0.00 55.36 55.18 2edp s GLN 11 Cb -0.12 -1.98 -0.02 0.00 1.10 0.00 0.00 33.01 31.98 2edp s GLN 11 CO 0.52 0.01 0.34 0.71 -0.55 0.00 0.00 175.29 176.32 2edp s TYR 12 N 0.78 3.22 -0.61 1.67 2.02 -1.26 -2.14 117.35 121.02 2edp s TYR 12 Ca -0.10 0.04 -0.13 0.00 -0.37 0.00 0.00 57.07 56.51 2edp s TYR 12 Cb -0.16 -2.62 0.15 0.00 -0.40 0.00 0.00 41.96 38.94 2edp s TYR 12 CO 0.01 -0.37 0.53 0.08 -1.57 0.00 0.00 175.55 174.23 2edp s VAL 13 N 1.98 4.97 -0.93 0.71 1.01 0.51 -4.88 120.40 123.77 2edp s VAL 13 Ca 0.11 -1.95 -0.24 0.00 0.00 0.00 0.00 61.98 59.90 2edp s VAL 13 Cb -0.16 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 2edp s VAL 13 CO 0.11 -0.89 1.95 -2.16 0.00 0.00 0.00 175.10 174.10 2edp s PRO 14 N 1.02 2.55 -0.66 2.72 0.04 -1.25 -2.93 135.00 136.49 2edp s PRO 14 Ca 0.09 -0.38 -0.26 0.00 0.04 0.00 0.00 61.00 60.48 2edp s PRO 14 Cb -0.23 -5.08 -0.01 0.00 0.04 0.00 0.00 34.50 29.22 2edp s PRO 14 CO -0.02 -3.44 1.76 0.08 0.04 0.00 0.00 177.00 175.42 2edp s VAL 15 N 10.18 3.43 -0.69 -0.36 1.01 0.33 -4.80 120.40 129.50 2edp s VAL 15 Ca 0.70 0.18 -0.20 0.00 0.00 0.00 0.00 61.98 62.66 2edp s VAL 15 Cb -0.06 -4.14 0.10 0.00 0.00 0.00 0.00 36.38 32.28 2edp s VAL 15 CO 0.01 -1.10 0.88 -1.58 0.00 0.00 0.00 175.10 173.30 2edp s GLN 16 N 6.78 3.19 0.82 2.72 0.74 -1.26 -2.23 119.66 130.42 2edp s GLN 16 Ca 0.61 -1.27 -0.12 0.00 0.05 0.00 0.00 55.36 54.64 2edp s GLN 16 Cb -0.11 -4.37 0.08 0.00 1.10 0.00 0.00 33.01 29.71 2edp s GLN 16 CO 0.18 -1.67 1.10 -0.51 -0.55 0.00 0.00 175.29 173.84 2edp s LEU 17 N 3.08 2.47 -0.13 3.68 1.43 0.15 -4.87 118.68 124.49 2edp s LEU 17 Ca 0.19 1.24 -0.16 0.00 -1.03 0.00 0.00 54.13 54.38 2edp s LEU 17 Cb -0.18 -3.79 0.04 0.00 0.03 0.00 0.00 46.19 42.29 2edp s LEU 17 CO 0.04 -2.11 0.43 -1.10 0.23 0.00 0.00 176.35 173.84 2edp s GLN 18 N -5.17 0.57 0.00 1.70 -0.21 -1.26 -2.86 119.66 112.42 2edp s GLN 18 Ca 0.61 0.44 0.00 0.00 0.02 0.00 0.00 55.36 56.44 2edp s GLN 18 Cb -0.15 0.27 0.00 0.00 1.00 0.00 0.00 33.01 34.13 2edp s GLN 18 CO 0.54 -0.10 0.00 0.41 -2.12 0.00 0.00 175.29 174.02 2edp n GLY 19 N 2.46 3.16 0.00 3.09 0.00 0.38 -4.98 105.19 109.31 2edp n GLY 19 Ca -0.15 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.81 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 2.65 3.13 -0.02 0.00 -0.19 -4.79 105.19 105.96 2edp n GLY 20 Ca 0.00 -1.64 -0.35 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 1.08 -4.65 -1.24 4.61 0.00 -1.26 -4.72 120.51 114.33 2edp n ALA 21 Ca 0.00 -0.68 -0.31 0.00 0.00 0.00 0.00 53.44 52.45 2edp n ALA 21 Cb 0.00 -1.33 0.11 0.00 0.00 0.00 0.00 19.45 18.22 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 -2.50 1.94 -0.19 0.00 0.04 -1.26 -5.12 135.00 127.91 2edp s PRO 22 Ca 0.45 1.06 -0.06 0.00 0.04 0.00 0.00 61.00 62.48 2edp s PRO 22 Cb -0.18 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.39 2edp s PRO 22 CO 0.78 -1.83 -0.23 0.91 0.04 0.00 0.00 177.00 176.67 2edp n TRP 23 N -3.64 0.00 -0.40 0.56 7.02 -1.26 -4.47 117.44 115.25 2edp n TRP 23 Ca 0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.56 2edp n TRP 23 Cb 0.54 -0.71 0.00 0.00 -2.42 0.00 0.00 31.31 28.72 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 2.04 0.78 3.14 6.99 0.00 -1.26 -0.02 105.19 116.86 2edp n GLY 24 Ca -0.37 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.82 -0.23 0.41 1.61 -0.12 -1.26 0.13 117.98 116.69 2edp s PHE 25 Ca 0.00 0.54 0.05 0.00 -0.05 0.00 0.00 56.93 57.47 2edp s PHE 25 Cb 0.00 0.08 -0.02 0.00 -0.63 0.00 0.00 43.02 42.45 2edp s PHE 25 CO 0.00 -0.18 0.18 0.95 -0.05 0.00 0.00 175.22 176.13 2edp s THR 26 N -0.19 0.37 0.22 -4.49 -4.23 0.88 -4.98 115.64 103.22 2edp s THR 26 Ca -0.03 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.48 2edp s THR 26 Cb -0.03 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 2edp s THR 26 CO 0.01 0.00 0.12 -0.76 -0.54 0.00 0.00 174.62 173.45 2edp s LEU 27 N -3.58 1.30 0.00 4.79 1.43 -1.26 -1.77 118.68 119.60 2edp s LEU 27 Ca 0.26 -1.38 0.05 0.00 -1.03 0.00 0.00 54.13 52.03 2edp s LEU 27 Cb 0.01 0.28 -0.02 0.00 0.03 0.00 0.00 46.19 46.49 2edp s LEU 27 CO 0.18 -0.81 0.20 2.29 0.23 0.00 0.00 176.35 178.45 2edp n LYS 28 N -0.32 0.30 0.00 1.70 2.85 -0.25 -4.43 118.16 118.01 2edp n LYS 28 Ca 0.01 -2.37 0.00 0.00 -1.05 0.00 0.00 58.31 54.90 2edp n LYS 28 Cb 0.66 1.92 0.00 0.00 -0.65 0.00 0.00 35.03 36.96 2edp n LYS 28 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2edp n GLY 29 N -0.43 3.06 0.00 2.58 0.00 -1.26 -3.72 105.19 105.42 2edp n GLY 29 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 1.52 0.48 -0.02 0.00 0.07 -4.58 105.19 102.66 2edp n GLY 30 Ca 0.00 -1.96 0.32 0.00 0.00 0.00 0.00 46.02 44.38 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 0.23 -0.98 0.99 6.46 -1.28 0.18 115.31 120.91 2edp h LEU 31 Ca 0.00 0.07 0.31 0.00 -0.12 0.00 0.00 57.88 58.14 2edp h LEU 31 Cb 0.00 0.04 -0.15 0.00 -0.73 0.00 0.00 40.66 39.82 2edp h LEU 31 CO 0.00 -0.02 0.50 -0.08 -0.62 0.00 0.00 178.44 178.23 2edp h GLU 32 N 0.17 0.27 -0.82 1.25 4.81 -1.81 -1.31 114.58 117.14 2edp h GLU 32 Ca 0.67 -0.02 -0.43 0.00 -0.13 0.00 0.00 59.36 59.46 2edp h GLU 32 Cb 2.17 -0.06 -0.41 0.00 0.63 0.00 0.00 28.75 31.08 2edp h GLU 32 CO -0.23 0.18 -0.96 0.72 -0.73 0.00 0.00 179.01 178.00 2edp n HIS 33 N -5.10 2.14 -3.18 0.92 8.25 0.54 -4.95 115.22 113.83 2edp n HIS 33 Ca 0.30 -2.43 -0.19 0.00 -0.26 0.00 0.00 57.72 55.14 2edp n HIS 33 Cb 0.95 -0.27 -0.04 0.00 1.12 0.00 0.00 29.99 31.76 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 -5.32 2.73 -0.51 0.00 0.41 -0.60 -4.94 118.70 110.48 2edp s GLU 35 Ca 0.37 -0.83 -0.27 0.00 -0.41 0.00 0.00 54.97 53.83 2edp s GLU 35 Cb -0.22 -2.61 -0.02 0.00 -1.78 0.00 0.00 34.13 29.51 2edp s GLU 35 CO 0.46 0.52 1.80 -1.25 -0.49 0.00 0.00 175.26 176.30 2edp s PRO 36 N -2.62 2.91 -0.76 0.39 0.04 -1.26 -0.75 135.00 132.95 2edp s PRO 36 Ca 0.28 0.87 -0.24 0.00 0.04 0.00 0.00 61.00 61.95 2edp s PRO 36 Cb -0.11 -4.30 -0.15 0.00 0.04 0.00 0.00 34.50 29.98 2edp s PRO 36 CO 0.21 -2.38 2.40 -0.11 0.04 0.00 0.00 177.00 177.16 2edp n LEU 37 N 11.70 1.50 -4.45 -3.56 7.94 -1.26 -4.45 117.00 124.41 2edp n LEU 37 Ca 0.21 -1.12 -0.22 0.00 -1.11 0.00 0.00 56.01 53.77 2edp n LEU 37 Cb 0.50 -1.50 -0.10 0.00 0.53 0.00 0.00 43.42 42.85 2edp n LEU 37 CO 0.70 -2.21 -0.35 0.42 -1.11 0.00 0.00 177.39 174.84 2edp s THR 38 N 12.46 1.65 0.10 1.96 -4.23 -1.24 -2.90 115.64 123.43 2edp s THR 38 Ca 1.00 -2.10 -0.33 0.00 -1.18 0.00 0.00 61.69 59.08 2edp s THR 38 Cb -0.26 -2.56 -0.13 0.00 1.34 0.00 0.00 72.50 70.89 2edp s THR 38 CO 0.19 -0.22 1.72 0.52 -0.54 0.00 0.00 174.62 176.29 2edp n VAL 39 N -0.64 0.22 -0.08 2.29 0.31 0.21 -1.09 118.33 119.54 2edp n VAL 39 Ca -0.05 -0.04 -0.15 0.00 -0.01 0.00 0.00 64.34 64.09 2edp n VAL 39 Cb 0.64 -1.78 -0.14 0.00 -0.91 0.00 0.00 33.84 31.65 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 4.70 1.36 -3.62 4.52 3.41 -0.73 -2.59 113.62 120.67 2edp n SER 40 Ca 0.18 0.06 -0.12 0.00 -0.26 0.00 0.00 58.87 58.73 2edp n SER 40 Cb 0.31 -0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.09 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 -2.53 0.68 -0.21 4.33 2.36 -1.26 -4.97 119.74 118.14 2edp s LYS 41 Ca -0.21 0.67 -0.01 0.00 -2.55 0.00 0.00 55.97 53.86 2edp s LYS 41 Cb 0.08 0.33 0.06 0.00 -1.05 0.00 0.00 37.83 37.24 2edp s LYS 41 CO 0.73 -0.11 0.00 0.42 1.55 0.00 0.00 175.35 177.94 2edp s ILE 42 N 0.03 0.94 -0.25 5.43 1.01 -1.26 -0.08 121.20 127.02 2edp s ILE 42 Ca 0.00 -0.84 -0.41 0.00 0.00 0.00 0.00 60.65 59.40 2edp s ILE 42 Cb -0.04 -1.35 -0.17 0.00 0.01 0.00 0.00 42.46 40.90 2edp s ILE 42 CO -0.02 -0.18 1.60 -0.62 0.00 0.00 0.00 174.94 175.73 2edp n GLU 43 N 4.89 0.82 -2.27 2.79 1.02 0.12 -4.81 120.64 123.20 2edp n GLU 43 Ca -0.10 0.30 -0.39 0.00 -0.02 0.00 0.00 57.16 56.95 2edp n GLU 43 Cb 0.46 -1.92 -0.03 0.00 -0.02 0.00 0.00 31.44 29.92 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 2.67 5.68 0.00 1.62 1.01 -1.26 -2.80 116.67 123.59 2edp s ASP 44 Ca 0.97 -0.16 0.00 0.00 0.71 0.00 0.00 52.55 54.07 2edp s ASP 44 Cb -1.16 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 40.23 2edp s ASP 44 CO 0.65 -2.15 0.00 0.61 0.21 0.00 0.00 175.17 174.50 2edp n GLY 45 N 5.75 1.20 0.00 0.21 0.00 -1.26 -5.09 105.19 106.01 2edp n GLY 45 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.89 0.27 -0.02 0.00 -1.12 -4.52 105.19 96.91 2edp n GLY 46 Ca 0.00 -1.32 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.59 -0.98 1.61 1.79 -0.66 -0.32 116.57 117.42 2edp h LYS 47 Ca 0.00 0.04 0.34 0.00 -2.18 0.00 0.00 60.65 58.85 2edp h LYS 47 Cb 0.00 0.14 -0.16 0.00 -1.58 0.00 0.00 32.23 30.62 2edp h LYS 47 CO 0.00 -0.33 0.44 0.00 -1.08 0.00 0.00 179.45 178.48 2edp h ALA 48 N -0.95 1.82 0.03 3.86 0.00 -1.40 0.27 119.26 122.88 2edp h ALA 48 Ca -0.06 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2edp h ALA 48 Cb 0.54 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2edp h ALA 48 CO 0.10 -0.69 -0.01 0.00 0.00 0.00 0.00 179.25 178.65 2edp h ALA 49 N 1.91 -0.03 -0.95 0.00 0.00 -1.75 -3.27 119.26 115.17 2edp h ALA 49 Ca 0.73 -0.35 0.20 0.00 0.00 0.00 0.00 54.91 55.49 2edp h ALA 49 Cb 1.73 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.45 2edp h ALA 49 CO -0.71 -0.13 0.61 -0.07 0.00 0.00 0.00 179.25 178.94 2edp h LEU 50 N -0.80 0.54 -0.92 0.00 3.38 0.88 0.73 115.31 119.12 2edp h LEU 50 Ca -0.00 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.05 2edp h LEU 50 Cb 0.71 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 2edp h LEU 50 CO 0.01 0.21 0.60 0.77 0.09 0.00 0.00 178.44 180.12 2edp h SER 51 N 0.54 1.02 -3.86 -0.43 4.64 -0.63 -3.46 113.55 111.36 2edp h SER 51 Ca 0.51 -0.02 -0.36 0.00 -0.47 0.00 0.00 61.79 61.45 2edp h SER 51 Cb 1.09 -0.24 0.05 0.00 -0.31 0.00 0.00 62.40 62.98 2edp h SER 51 CO -0.25 0.72 -0.53 0.00 -0.87 0.00 0.00 176.83 175.89 2edp n GLN 52 N -4.48 -4.04 -0.04 4.77 1.13 0.25 -4.88 117.38 110.08 2edp n GLN 52 Ca 0.11 0.83 -0.05 0.00 -1.94 0.00 0.00 57.00 55.95 2edp n GLN 52 Cb 0.06 -5.47 -0.06 0.00 0.11 0.00 0.00 30.24 24.88 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 -3.57 2.07 -4.15 -1.09 4.76 -1.26 -5.04 118.16 109.88 2edp n LYS 53 Ca -0.12 0.01 -0.16 0.00 -2.87 0.00 0.00 58.31 55.17 2edp n LYS 53 Cb 0.62 -1.21 -0.12 0.00 -1.84 0.00 0.00 35.03 32.48 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 -2.21 0.76 0.19 1.97 0.23 -1.26 -4.99 119.30 113.99 2edp s MET 54 Ca -0.07 -0.96 0.01 0.00 -1.03 0.00 0.00 55.69 53.65 2edp s MET 54 Cb 0.03 -0.64 -0.00 0.00 -1.53 0.00 0.00 34.83 32.68 2edp s MET 54 CO 0.32 0.13 0.23 0.54 -2.03 0.00 0.00 175.02 174.21 2edp n ARG 55 N 1.15 0.34 -1.73 3.16 5.12 -1.26 -4.79 116.66 118.65 2edp n ARG 55 Ca -0.20 -1.68 -0.42 0.00 -1.93 0.00 0.00 57.85 53.62 2edp n ARG 55 Cb 0.55 1.52 -0.03 0.00 -1.16 0.00 0.00 32.46 33.34 2edp n ARG 55 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2edp s THR 56 N -2.69 2.80 0.00 0.55 -4.23 -1.26 -2.41 115.64 108.40 2edp s THR 56 Ca 0.19 0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2edp s THR 56 Cb 0.00 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.77 2edp s THR 56 CO 0.13 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2edp n GLY 57 N 4.32 0.66 3.76 3.99 0.00 -1.07 -4.96 105.19 111.89 2edp n GLY 57 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.12 5.75 -0.60 1.61 1.01 -1.01 -4.57 116.67 117.73 2edp s ASP 58 Ca 0.00 2.91 -0.16 0.00 0.71 0.00 0.00 52.55 56.01 2edp s ASP 58 Cb 0.00 -2.65 0.14 0.00 1.01 0.00 0.00 42.92 41.42 2edp s ASP 58 CO 0.00 -1.26 0.57 -0.70 0.21 0.00 0.00 175.17 173.99 2edp s GLU 59 N -2.54 3.11 -0.36 8.23 2.12 -1.25 -0.62 118.70 127.39 2edp s GLU 59 Ca 0.63 -1.82 -0.24 0.00 0.36 0.00 0.00 54.97 53.91 2edp s GLU 59 Cb -0.44 -4.33 0.01 0.00 0.26 0.00 0.00 34.13 29.64 2edp s GLU 59 CO 0.55 -1.35 0.81 -1.17 -0.54 0.00 0.00 175.26 173.56 2edp s LEU 60 N 1.44 4.11 -0.09 2.70 0.20 -1.14 -2.32 118.68 123.57 2edp s LEU 60 Ca 0.07 0.40 0.08 0.00 0.69 0.00 0.00 54.13 55.37 2edp s LEU 60 Cb -0.26 -3.06 -0.11 0.00 -0.43 0.00 0.00 46.19 42.33 2edp s LEU 60 CO 0.01 -0.75 0.03 1.33 -0.29 0.00 0.00 176.35 176.68 2edp n VAL 61 N 5.81 0.64 -3.72 1.68 0.24 -1.22 -4.83 118.33 116.92 2edp n VAL 61 Ca 0.04 -0.39 -0.38 0.00 -2.04 0.00 0.00 64.34 61.57 2edp n VAL 61 Cb 0.48 -0.75 -0.12 0.00 -1.47 0.00 0.00 33.84 31.98 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 -4.14 5.26 -0.18 -1.34 3.04 -1.25 -1.04 114.94 115.30 2edp s ASN 62 Ca -0.05 -0.61 0.01 0.00 0.04 0.00 0.00 52.86 52.25 2edp s ASN 62 Cb 0.03 -1.92 0.02 0.00 -1.54 0.00 0.00 41.25 37.83 2edp s ASN 62 CO 0.38 -0.18 -0.19 -0.63 -3.04 0.00 0.00 177.10 173.44 2edp s ILE 63 N 1.55 2.16 -1.73 -5.21 1.01 -0.73 -1.99 121.20 116.26 2edp s ILE 63 Ca 0.04 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 2edp s ILE 63 Cb -0.17 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.39 2edp s ILE 63 CO 0.04 0.53 0.10 0.59 0.00 0.00 0.00 174.94 176.20 2edp n ASN 64 N 4.62 -5.91 -0.06 3.58 5.03 0.16 -0.97 115.26 121.71 2edp n ASN 64 Ca -0.21 -0.06 -0.01 0.00 0.87 0.00 0.00 54.58 55.17 2edp n ASN 64 Cb 0.50 -4.89 -0.00 0.00 -1.02 0.00 0.00 39.78 34.37 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 -1.10 0.48 3.31 7.41 0.00 -1.24 -4.93 105.19 109.12 2edp n GLY 65 Ca -0.22 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.94 3.41 -0.37 2.61 2.01 -0.14 -5.07 115.64 116.15 2edp s THR 66 Ca 0.00 -0.52 -0.28 0.00 0.31 0.00 0.00 61.69 61.20 2edp s THR 66 Cb 0.00 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 2edp s THR 66 CO 0.00 0.39 1.71 -2.16 -0.69 0.00 0.00 174.62 173.87 2edp s PRO 67 N 1.48 3.35 0.66 4.92 0.04 -1.26 -1.76 135.00 142.42 2edp s PRO 67 Ca 0.05 1.26 -0.13 0.00 0.04 0.00 0.00 61.00 62.23 2edp s PRO 67 Cb -0.15 -4.17 -0.00 0.00 0.04 0.00 0.00 34.50 30.22 2edp s PRO 67 CO -0.03 -1.84 1.07 -0.51 0.04 0.00 0.00 177.00 175.72 2edp s LEU 68 N 6.68 3.29 -0.39 -3.56 1.43 -0.20 -4.98 118.68 120.95 2edp s LEU 68 Ca 0.75 1.75 0.05 0.00 -1.03 0.00 0.00 54.13 55.65 2edp s LEU 68 Cb -0.20 -4.52 0.48 0.00 0.03 0.00 0.00 46.19 41.98 2edp s LEU 68 CO 0.33 -1.41 1.51 -1.22 0.23 0.00 0.00 176.35 175.78 2edp n TYR 69 N -2.68 2.28 0.00 0.29 4.02 -1.26 -4.95 117.16 114.86 2edp n TYR 69 Ca 0.08 -2.20 0.00 0.00 -0.01 0.00 0.00 57.90 55.78 2edp n TYR 69 Cb 0.53 -0.68 0.00 0.00 -0.02 0.00 0.00 39.34 39.17 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 -0.92 2.02 3.14 2.72 0.00 -1.26 -4.76 105.19 106.13 2edp n GLY 70 Ca 0.45 -0.28 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 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 2.73 -1.04 -0.06 1.61 2.88 -1.26 -1.24 113.62 117.23 2edp n SER 71 Ca 0.00 1.04 -0.08 0.00 -1.33 0.00 0.00 58.87 58.50 2edp n SER 71 Cb 0.00 -0.87 -0.07 0.00 -0.75 0.00 0.00 64.21 62.52 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 1.09 0.00 0.00 -1.46 2.43 -1.90 -3.35 114.38 111.20 2edp h ARG 72 Ca -0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 2edp h ARG 72 Cb 1.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2edp h ARG 72 CO 0.53 0.52 0.00 1.04 -1.51 0.00 0.00 179.97 180.55 2edp n GLN 73 N -4.67 0.00 -0.27 0.20 3.00 -1.26 -0.57 117.38 113.81 2edp n GLN 73 Ca -0.07 0.74 -0.01 0.00 -0.01 0.00 0.00 57.00 57.65 2edp n GLN 73 Cb 0.28 -1.18 0.03 0.00 0.00 0.00 0.00 30.24 29.37 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 -2.31 -0.17 0.00 -1.09 2.13 -1.26 -0.21 120.64 117.73 2edp n GLU 74 Ca 0.00 1.08 0.00 0.00 0.66 0.00 0.00 57.16 58.90 2edp n GLU 74 Cb 0.00 -1.61 0.00 0.00 0.27 0.00 0.00 31.44 30.10 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 -3.63 -0.11 -0.30 4.31 0.00 0.26 -0.45 120.51 120.59 2edp n ALA 75 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.62 2edp n ALA 75 Cb 0.28 0.19 0.24 0.00 0.00 0.00 0.00 19.45 20.16 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 -0.31 -0.70 0.00 3.38 -0.55 0.41 115.31 117.54 2edp h LEU 76 Ca 0.00 0.23 0.11 0.00 0.09 0.00 0.00 57.88 58.30 2edp h LEU 76 Cb 0.00 0.38 -0.08 0.00 0.09 0.00 0.00 40.66 41.05 2edp h LEU 76 CO 0.00 -0.24 0.31 0.40 0.09 0.00 0.00 178.44 179.01 2edp h ILE 77 N 0.10 0.78 -0.38 1.22 2.04 -0.22 -1.70 117.51 119.35 2edp h ILE 77 Ca 0.52 -0.18 0.07 0.00 1.00 0.00 0.00 64.86 66.27 2edp h ILE 77 Cb 1.01 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 2edp h ILE 77 CO -0.76 0.09 0.02 0.25 0.00 0.00 0.00 178.15 177.76 2edp h LEU 78 N 0.52 -0.11 -0.08 1.44 5.85 0.26 -2.48 115.31 120.72 2edp h LEU 78 Ca 0.36 0.08 0.02 0.00 0.84 0.00 0.00 57.88 59.18 2edp h LEU 78 Cb 0.44 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2edp h LEU 78 CO -0.31 -0.02 -0.07 0.40 -0.34 0.00 0.00 178.44 178.10 2edp h ILE 79 N 0.13 0.79 -0.70 4.05 2.04 -1.08 -2.37 117.51 120.38 2edp h ILE 79 Ca 0.18 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.33 2edp h ILE 79 Cb 0.25 0.79 -0.13 0.00 -0.74 0.00 0.00 36.82 36.99 2edp h ILE 79 CO -0.29 0.00 0.37 0.29 0.00 0.00 0.00 178.15 178.52 2edp n LYS 80 N -5.20 -0.04 -2.04 2.37 4.76 -0.85 0.19 118.16 117.35 2edp n LYS 80 Ca -0.05 0.97 -0.32 0.00 -2.87 0.00 0.00 58.31 56.05 2edp n LYS 80 Cb 0.13 -1.73 0.03 0.00 -1.84 0.00 0.00 35.03 31.62 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 -1.19 5.92 2.38 0.72 0.00 -0.89 -5.04 105.19 107.09 2edp n GLY 81 Ca 0.26 -2.59 -0.20 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.61 -1.64 -3.38 1.61 3.41 0.51 -5.05 113.62 108.47 2edp n SER 82 Ca 0.48 -0.97 -0.20 0.00 -0.26 0.00 0.00 58.87 57.92 2edp n SER 82 Cb 0.59 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.81 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 -4.05 0.16 -0.25 7.33 3.72 -1.26 -4.97 117.46 118.14 2edp n PHE 83 Ca 0.10 -2.02 0.26 0.00 -0.05 0.00 0.00 57.45 55.74 2edp n PHE 83 Cb 0.40 -0.02 0.63 0.00 -0.94 0.00 0.00 39.48 39.54 2edp n PHE 83 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2edp h ARG 84 N 0.00 0.19 -5.13 -1.08 2.43 -1.95 -3.38 114.38 105.45 2edp h ARG 84 Ca -0.25 -0.01 -0.55 0.00 -0.81 0.00 0.00 59.98 58.36 2edp h ARG 84 Cb 0.94 -0.04 -0.32 0.00 -0.42 0.00 0.00 29.97 30.14 2edp h ARG 84 CO 0.40 0.12 -0.83 0.42 -1.51 0.00 0.00 179.97 178.57 2edp s ILE 85 N -5.20 1.36 0.00 1.20 1.01 -1.26 -0.47 121.20 117.84 2edp s ILE 85 Ca -0.07 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 59.96 2edp s ILE 85 Cb 0.23 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.49 2edp s ILE 85 CO 0.79 0.40 -0.11 -0.22 0.00 0.00 0.00 174.94 175.79 2edp s LEU 86 N 0.16 2.96 -0.19 2.97 2.96 -1.13 -4.92 118.68 121.47 2edp s LEU 86 Ca -0.06 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.63 2edp s LEU 86 Cb -0.12 -1.70 0.04 0.00 0.50 0.00 0.00 46.19 44.92 2edp s LEU 86 CO 0.03 0.29 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.72 2edp s LYS 87 N -1.30 1.81 -0.04 1.98 1.02 -1.26 0.32 119.74 122.27 2edp s LYS 87 Ca 0.15 -0.75 0.03 0.00 0.02 0.00 0.00 55.97 55.42 2edp s LYS 87 Cb -0.11 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 2edp s LYS 87 CO 0.06 -0.44 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.41 2edp s LEU 88 N 1.47 1.81 -0.37 3.17 1.43 -0.95 0.36 118.68 125.60 2edp s LEU 88 Ca -0.01 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 52.79 2edp s LEU 88 Cb -0.16 -0.76 0.09 0.00 0.03 0.00 0.00 46.19 45.39 2edp s LEU 88 CO -0.08 0.10 0.14 -0.63 0.23 0.00 0.00 176.35 176.11 2edp s ILE 89 N 0.20 3.26 -0.05 -0.59 1.09 -0.84 0.12 121.20 124.38 2edp s ILE 89 Ca -0.05 -1.80 -0.04 0.00 -1.10 0.00 0.00 60.65 57.66 2edp s ILE 89 Cb -0.11 -3.11 -0.04 0.00 -1.06 0.00 0.00 42.46 38.15 2edp s ILE 89 CO 0.02 -0.50 0.15 0.68 -0.10 0.00 0.00 174.94 175.19 2edp s VAL 90 N 1.19 5.33 -0.21 2.92 -7.23 -1.15 -3.38 120.40 117.88 2edp s VAL 90 Ca 0.04 -0.05 -0.05 0.00 -1.81 0.00 0.00 61.98 60.11 2edp s VAL 90 Cb -0.22 -3.41 -0.02 0.00 0.56 0.00 0.00 36.38 33.29 2edp s VAL 90 CO -0.03 0.45 -0.02 0.00 -0.31 0.00 0.00 175.10 175.19 2edp s ARG 91 N -1.53 3.50 -0.23 4.82 1.70 -0.98 -0.36 118.95 125.87 2edp s ARG 91 Ca 0.22 -0.57 0.02 0.00 -0.47 0.00 0.00 55.73 54.92 2edp s ARG 91 Cb -0.12 -3.05 0.04 0.00 -0.57 0.00 0.00 34.95 31.25 2edp s ARG 91 CO 0.12 -0.09 -0.13 -0.98 -1.08 0.00 0.00 175.30 173.14 2edp s ARG 92 N 1.25 2.58 -0.45 3.89 1.70 -0.91 -3.80 118.95 123.21 2edp s ARG 92 Ca 0.03 -1.12 -0.43 0.00 -0.47 0.00 0.00 55.73 53.74 2edp s ARG 92 Cb -0.14 -2.81 -0.18 0.00 -0.57 0.00 0.00 34.95 31.25 2edp s ARG 92 CO 0.00 -0.43 1.95 0.54 -1.08 0.00 0.00 175.30 176.28 2edp n ARG 93 N 4.53 0.31 -3.31 3.89 1.74 -1.26 -3.66 116.66 118.90 2edp n ARG 93 Ca -0.17 0.10 -0.47 0.00 -0.77 0.00 0.00 57.85 56.55 2edp n ARG 93 Cb 0.45 -1.72 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 2edp n ARG 93 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2edp s ASN 94 N 5.03 6.62 1.12 0.55 2.47 -1.25 -4.99 114.94 124.50 2edp s ASN 94 Ca 1.11 -2.45 -0.18 0.00 0.42 0.00 0.00 52.86 51.77 2edp s ASN 94 Cb -1.35 -2.22 0.25 0.00 -1.45 0.00 0.00 41.25 36.49 2edp s ASN 94 CO 0.68 -0.66 1.17 -0.44 -3.72 0.00 0.00 177.10 174.13 2edp s SER 95 N 2.55 1.69 0.00 -4.21 0.01 -1.26 -4.43 113.70 108.04 2edp s SER 95 Ca 0.15 0.54 0.00 0.00 1.31 0.00 0.00 55.95 57.95 2edp s SER 95 Cb -0.15 -0.74 0.00 0.00 0.21 0.00 0.00 66.02 65.34 2edp s SER 95 CO -0.06 -3.64 0.00 0.61 0.41 0.00 0.00 173.24 170.56 2edp n GLY 96 N -1.85 2.23 3.55 3.44 0.00 -1.26 -5.01 105.19 106.29 2edp n GLY 96 Ca 0.13 -2.14 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 2edp n GLY 96 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edp s PRO 97 N -1.83 2.61 0.08 1.61 0.04 -1.26 -4.96 135.00 131.28 2edp s PRO 97 Ca 0.00 0.48 0.08 0.00 0.04 0.00 0.00 61.00 61.60 2edp s PRO 97 Cb 0.00 -4.49 -0.03 0.00 0.04 0.00 0.00 34.50 30.02 2edp s PRO 97 CO 0.00 -2.84 -0.22 -1.54 0.04 0.00 0.00 177.00 172.44 2edp s SER 98 N 8.13 2.66 -0.06 6.66 1.04 -1.26 -5.06 113.70 125.80 2edp s SER 98 Ca 0.68 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 56.39 2edp s SER 98 Cb -0.12 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.78 2edp s SER 98 CO 0.17 0.13 -0.19 -0.24 0.98 0.00 0.00 173.24 174.09 2edp n SER 99 N 1.41 1.51 0.00 7.02 2.88 -1.26 -5.26 113.62 119.92 2edp n SER 99 Ca -0.18 0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2edp n SER 99 Cb 0.53 -0.54 0.00 0.00 -0.75 0.00 0.00 64.21 63.45 2edp n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42