#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 2.58 0.06 1.61 1.04 -1.26 -5.03 113.70 112.71 2edp s SER 2 Ca 0.00 1.94 0.03 0.00 0.48 0.00 0.00 55.95 58.39 2edp s SER 2 Cb 0.00 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.61 2edp s SER 2 CO 0.00 -3.27 0.06 -0.44 0.98 0.00 0.00 173.24 170.56 2edp s SER 3 N -2.75 5.42 0.00 7.02 0.01 -1.26 -5.10 113.70 117.05 2edp s SER 3 Ca 0.66 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.91 2edp s SER 3 Cb -0.22 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.57 2edp s SER 3 CO 0.59 0.20 0.00 0.61 0.41 0.00 0.00 173.24 175.05 2edp n GLY 4 N 0.68 1.27 3.57 3.44 0.00 -1.26 -5.00 105.19 107.88 2edp n GLY 4 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 2edp n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2edp s SER 5 N 0.62 5.88 0.01 1.61 0.01 -1.26 -4.88 113.70 115.69 2edp s SER 5 Ca 0.00 0.52 -0.25 0.00 1.31 0.00 0.00 55.95 57.52 2edp s SER 5 Cb 0.00 -2.54 -0.16 0.00 0.21 0.00 0.00 66.02 63.53 2edp s SER 5 CO 0.00 -1.86 1.23 0.28 0.41 0.00 0.00 173.24 173.30 2edp h SER 6 N 12.33 -0.44 0.00 2.44 0.02 -2.05 -3.50 113.55 122.36 2edp h SER 6 Ca -0.28 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2edp h SER 6 Cb 1.12 0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2edp h SER 6 CO 1.15 -0.08 0.00 0.61 -1.14 0.00 0.00 176.83 177.38 2edp n GLY 7 N -0.41 -0.69 0.00 -3.77 0.00 -1.26 -5.15 105.19 93.90 2edp n GLY 7 Ca -0.10 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 2.67 3.13 -0.02 0.00 -1.26 -5.14 105.19 104.57 2edp n GLY 8 Ca 0.00 0.21 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.27 0.53 1.61 0.01 -1.26 -5.11 113.70 109.21 2edp s SER 9 Ca 0.00 0.52 -0.11 0.00 1.31 0.00 0.00 55.95 57.67 2edp s SER 9 Cb 0.00 0.51 -0.05 0.00 0.21 0.00 0.00 66.02 66.68 2edp s SER 9 CO 0.00 -0.10 0.93 -0.36 0.41 0.00 0.00 173.24 174.12 2edp s PHE 10 N 0.31 3.55 -0.23 2.43 0.40 -1.26 -2.67 117.98 120.51 2edp s PHE 10 Ca -0.01 1.20 -0.07 0.00 -0.60 0.00 0.00 56.93 57.45 2edp s PHE 10 Cb -0.03 -2.61 -0.03 0.00 0.51 0.00 0.00 43.02 40.86 2edp s PHE 10 CO -0.01 -0.44 0.05 -1.14 0.70 0.00 0.00 175.22 174.38 2edp s GLN 11 N -4.61 3.67 -0.79 0.44 0.74 0.62 -4.80 119.66 114.94 2edp s GLN 11 Ca 0.54 -0.48 -0.13 0.00 0.05 0.00 0.00 55.36 55.34 2edp s GLN 11 Cb -0.10 -3.23 0.21 0.00 1.10 0.00 0.00 33.01 30.98 2edp s GLN 11 CO 0.43 -0.07 0.72 0.71 -0.55 0.00 0.00 175.29 176.52 2edp s TYR 12 N 1.28 3.70 -0.47 1.67 2.02 -1.26 -2.62 117.35 121.66 2edp s TYR 12 Ca 0.04 -2.02 -0.17 0.00 -0.37 0.00 0.00 57.07 54.56 2edp s TYR 12 Cb -0.15 -3.76 0.05 0.00 -0.40 0.00 0.00 41.96 37.71 2edp s TYR 12 CO 0.03 -0.98 0.47 0.54 -1.57 0.00 0.00 175.55 174.04 2edp s VAL 13 N 0.24 5.09 -1.05 0.71 0.11 -1.13 -4.90 120.40 119.48 2edp s VAL 13 Ca 0.17 -0.71 -0.24 0.00 -2.93 0.00 0.00 61.98 58.27 2edp s VAL 13 Cb -0.13 -4.15 -0.07 0.00 -1.53 0.00 0.00 36.38 30.51 2edp s VAL 13 CO -0.08 -0.60 1.94 -2.16 -3.33 0.00 0.00 175.10 170.87 2edp s PRO 14 N 2.05 2.52 -0.77 1.54 0.04 -1.26 -3.58 135.00 135.54 2edp s PRO 14 Ca 0.09 -0.74 -0.26 0.00 0.04 0.00 0.00 61.00 60.14 2edp s PRO 14 Cb -0.21 -5.15 -0.12 0.00 0.04 0.00 0.00 34.50 29.05 2edp s PRO 14 CO 0.10 -3.69 2.36 0.08 0.04 0.00 0.00 177.00 175.89 2edp s VAL 15 N 10.57 3.05 -0.42 -0.36 1.01 0.13 -4.74 120.40 129.65 2edp s VAL 15 Ca 0.69 -0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.38 2edp s VAL 15 Cb -0.04 -3.12 0.02 0.00 0.00 0.00 0.00 36.38 33.24 2edp s VAL 15 CO 0.06 -0.12 0.94 -1.58 0.00 0.00 0.00 175.10 174.40 2edp s GLN 16 N 8.65 3.70 0.11 2.72 0.74 -1.26 -3.01 119.66 131.31 2edp s GLN 16 Ca 0.91 0.39 -0.09 0.00 0.05 0.00 0.00 55.36 56.62 2edp s GLN 16 Cb -0.13 -3.86 -0.06 0.00 1.10 0.00 0.00 33.01 30.06 2edp s GLN 16 CO 0.09 -1.09 0.42 -0.51 -0.55 0.00 0.00 175.29 173.65 2edp s LEU 17 N 3.65 4.32 -0.04 3.68 1.43 0.98 -4.91 118.68 127.78 2edp s LEU 17 Ca 0.38 0.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.28 2edp s LEU 17 Cb -0.11 -3.13 0.02 0.00 0.03 0.00 0.00 46.19 43.01 2edp s LEU 17 CO 0.23 0.12 -0.02 -1.10 0.23 0.00 0.00 176.35 175.81 2edp s GLN 18 N -2.13 0.58 0.00 1.70 -0.21 -1.26 -1.70 119.66 116.63 2edp s GLN 18 Ca 0.36 -0.00 0.00 0.00 0.02 0.00 0.00 55.36 55.74 2edp s GLN 18 Cb -0.13 -0.70 0.00 0.00 1.00 0.00 0.00 33.01 33.18 2edp s GLN 18 CO 0.20 -0.13 0.00 0.41 -2.12 0.00 0.00 175.29 173.65 2edp n GLY 19 N 4.21 3.31 0.00 3.09 0.00 -0.65 -5.04 105.19 110.12 2edp n GLY 19 Ca -0.23 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 2.19 3.40 -0.02 0.00 -0.99 -4.93 105.19 104.84 2edp n GLY 20 Ca 0.00 -1.69 -0.33 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 n ALA 21 N 1.97 -2.61 -1.77 4.61 0.00 -1.26 -4.59 120.51 116.85 2edp n ALA 21 Ca 0.00 -0.57 -0.36 0.00 0.00 0.00 0.00 53.44 52.51 2edp n ALA 21 Cb 0.00 -1.77 -0.00 0.00 0.00 0.00 0.00 19.45 17.68 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 -3.44 3.53 -0.22 0.00 0.04 -1.26 -5.14 135.00 128.51 2edp s PRO 22 Ca 0.57 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 63.12 2edp s PRO 22 Cb -0.23 -2.18 -0.18 0.00 0.04 0.00 0.00 34.50 31.95 2edp s PRO 22 CO 0.67 -0.72 0.08 0.91 0.04 0.00 0.00 177.00 177.98 2edp n TRP 23 N -0.95 0.77 0.00 0.56 7.02 -1.26 -4.54 117.44 119.04 2edp n TRP 23 Ca 0.10 0.31 0.00 0.00 -1.02 0.00 0.00 57.50 56.89 2edp n TRP 23 Cb 0.50 -1.08 0.00 0.00 -2.42 0.00 0.00 31.31 28.31 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 1.47 0.67 3.51 6.99 0.00 -1.26 0.18 105.19 116.76 2edp n GLY 24 Ca -0.38 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.35 -0.76 0.34 1.61 -0.12 -1.26 -0.71 117.98 115.73 2edp s PHE 25 Ca 0.00 1.71 0.04 0.00 -0.05 0.00 0.00 56.93 58.63 2edp s PHE 25 Cb 0.00 0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 42.69 2edp s PHE 25 CO 0.00 -0.38 0.14 0.95 -0.05 0.00 0.00 175.22 175.89 2edp s THR 26 N 0.78 0.50 0.35 -4.49 -4.23 0.13 -4.98 115.64 103.70 2edp s THR 26 Ca -0.04 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.52 2edp s THR 26 Cb -0.05 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 2edp s THR 26 CO -0.06 0.00 0.18 0.18 -0.54 0.00 0.00 174.62 174.38 2edp n LEU 27 N -0.71 0.00 -4.08 4.79 4.77 -1.26 -0.81 117.00 119.70 2edp n LEU 27 Ca -0.01 -2.85 -0.15 0.00 -0.03 0.00 0.00 56.01 52.96 2edp n LEU 27 Cb 0.65 1.15 -0.03 0.00 -2.33 0.00 0.00 43.42 42.86 2edp n LEU 27 CO 0.36 -0.45 0.17 -1.59 -1.33 0.00 0.00 177.39 174.54 2edp s LYS 28 N -3.35 2.00 7.95 3.23 0.00 -0.99 -4.49 119.74 124.10 2edp s LYS 28 Ca 0.25 -1.80 0.00 0.00 0.00 0.00 0.00 55.97 54.42 2edp s LYS 28 Cb 0.01 0.46 0.00 0.00 0.00 0.00 0.00 37.83 38.30 2edp s LYS 28 CO 0.18 -0.84 0.00 0.41 0.00 0.00 0.00 175.35 175.10 2edp n GLY 29 N -0.60 3.71 0.00 0.59 0.00 -1.26 -4.00 105.19 103.63 2edp n GLY 29 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 2.45 0.31 -0.02 0.00 -1.00 -4.62 105.19 102.31 2edp n GLY 30 Ca 0.00 -1.96 0.13 0.00 0.00 0.00 0.00 46.02 44.19 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 0.00 -1.07 0.99 5.85 -1.62 0.65 115.31 120.11 2edp h LEU 31 Ca 0.00 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.89 2edp h LEU 31 Cb 0.00 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 40.94 2edp h LEU 31 CO 0.00 0.00 0.62 -0.33 -0.34 0.00 0.00 178.44 178.39 2edp h GLU 32 N 0.00 0.78 -0.18 1.25 5.08 -1.85 -0.92 114.58 118.74 2edp h GLU 32 Ca 0.10 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2edp h GLU 32 Cb 0.43 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2edp h GLU 32 CO -0.00 0.51 -0.05 0.72 -1.00 0.00 0.00 179.01 179.19 2edp n HIS 33 N -4.69 0.61 -4.07 4.33 8.25 -0.60 -4.96 115.22 114.09 2edp n HIS 33 Ca 0.21 -1.10 -0.33 0.00 -0.26 0.00 0.00 57.72 56.25 2edp n HIS 33 Cb 0.51 -0.29 -0.00 0.00 1.12 0.00 0.00 29.99 31.33 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 -6.75 2.34 -0.52 0.00 2.02 0.12 -4.96 118.70 110.95 2edp s GLU 35 Ca 0.62 -0.90 -0.27 0.00 0.02 0.00 0.00 54.97 54.43 2edp s GLU 35 Cb -0.33 -2.41 -0.02 0.00 0.10 0.00 0.00 34.13 31.48 2edp s GLU 35 CO 0.88 0.54 1.81 -1.25 0.02 0.00 0.00 175.26 177.26 2edp s PRO 36 N -2.03 2.90 -0.80 0.39 0.04 -1.26 -2.36 135.00 131.89 2edp s PRO 36 Ca 0.21 0.87 -0.23 0.00 0.04 0.00 0.00 61.00 61.89 2edp s PRO 36 Cb -0.11 -4.30 -0.17 0.00 0.04 0.00 0.00 34.50 29.95 2edp s PRO 36 CO 0.13 -2.39 2.38 -0.11 0.04 0.00 0.00 177.00 177.05 2edp n LEU 37 N 11.74 1.25 -4.45 -3.56 7.94 -1.26 -4.69 117.00 123.96 2edp n LEU 37 Ca 0.21 -1.17 -0.22 0.00 -1.11 0.00 0.00 56.01 53.72 2edp n LEU 37 Cb 0.50 -1.44 -0.10 0.00 0.53 0.00 0.00 43.42 42.91 2edp n LEU 37 CO 0.70 -2.25 -0.37 0.42 -1.11 0.00 0.00 177.39 174.78 2edp s THR 38 N 11.82 1.78 0.08 1.96 -4.23 -1.26 -3.37 115.64 122.42 2edp s THR 38 Ca 1.02 -2.15 -0.33 0.00 -1.18 0.00 0.00 61.69 59.05 2edp s THR 38 Cb -0.30 -2.47 -0.12 0.00 1.34 0.00 0.00 72.50 70.95 2edp s THR 38 CO 0.20 -0.29 1.78 0.52 -0.54 0.00 0.00 174.62 176.29 2edp n VAL 39 N -0.62 0.33 -0.13 2.29 0.31 -0.50 -2.34 118.33 117.67 2edp n VAL 39 Ca -0.05 -0.06 -0.21 0.00 -0.01 0.00 0.00 64.34 64.00 2edp n VAL 39 Cb 0.63 -1.91 -0.12 0.00 -0.91 0.00 0.00 33.84 31.53 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 5.32 1.98 -3.77 4.52 3.41 0.01 -2.40 113.62 122.68 2edp n SER 40 Ca 0.19 0.01 -0.13 0.00 -0.26 0.00 0.00 58.87 58.68 2edp n SER 40 Cb 0.33 -0.54 -0.09 0.00 -0.26 0.00 0.00 64.21 63.65 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 -2.52 0.61 -0.08 4.33 2.36 -1.23 -4.85 119.74 118.37 2edp s LYS 41 Ca -0.35 -0.15 -0.03 0.00 -2.55 0.00 0.00 55.97 52.88 2edp s LYS 41 Cb 0.10 0.27 0.04 0.00 -1.05 0.00 0.00 37.83 37.20 2edp s LYS 41 CO 0.58 -0.16 0.14 0.42 1.55 0.00 0.00 175.35 177.88 2edp s ILE 42 N -1.18 -0.23 -0.32 5.43 1.01 -1.26 0.21 121.20 124.87 2edp s ILE 42 Ca -0.12 0.37 -0.40 0.00 0.00 0.00 0.00 60.65 60.49 2edp s ILE 42 Cb -0.05 -0.27 -0.16 0.00 0.01 0.00 0.00 42.46 42.00 2edp s ILE 42 CO 0.04 0.15 1.82 -0.62 0.00 0.00 0.00 174.94 176.32 2edp n GLU 43 N 5.32 1.01 -0.41 2.79 -0.58 0.11 -4.77 120.64 124.11 2edp n GLU 43 Ca -0.04 0.36 0.34 0.00 -0.42 0.00 0.00 57.16 57.39 2edp n GLU 43 Cb 0.50 -2.08 0.65 0.00 -0.57 0.00 0.00 31.44 29.94 2edp n GLU 43 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2edp h ASP 44 N 7.84 0.22 -0.43 1.62 3.58 -1.99 0.31 116.42 127.58 2edp h ASP 44 Ca -0.42 0.07 -0.31 0.00 0.42 0.00 0.00 57.03 56.80 2edp h ASP 44 Cb 1.33 0.05 -0.23 0.00 1.72 0.00 0.00 39.33 42.19 2edp h ASP 44 CO 0.98 -0.04 -0.59 0.61 -2.88 0.00 0.00 179.24 177.32 2edp n GLY 45 N -1.61 5.79 3.87 -0.78 0.00 -1.26 -4.61 105.19 106.59 2edp n GLY 45 Ca 0.32 -2.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.05 2edp n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2edp s GLY 46 N -3.33 1.73 0.27 -0.02 0.00 0.11 -4.87 107.32 101.22 2edp s GLY 46 Ca 0.46 -1.11 -0.00 0.00 0.00 0.00 0.00 44.72 44.06 2edp s GLY 46 CO -0.01 -1.11 1.40 0.28 0.00 0.00 0.00 173.10 173.66 2edp n LYS 47 N -0.40 -0.07 -0.11 2.90 4.76 0.49 0.12 118.16 125.84 2edp n LYS 47 Ca -0.08 1.35 -0.07 0.00 -2.87 0.00 0.00 58.31 56.65 2edp n LYS 47 Cb 0.54 -2.12 0.01 0.00 -1.84 0.00 0.00 35.03 31.61 2edp n LYS 47 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2edp h ALA 48 N 1.79 0.44 0.02 7.82 0.00 -1.69 -2.02 119.26 125.62 2edp h ALA 48 Ca 0.52 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.44 2edp h ALA 48 Cb 1.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2edp h ALA 48 CO -0.86 -0.18 -0.01 0.00 0.00 0.00 0.00 179.25 178.20 2edp h ALA 49 N 1.18 -0.03 -0.65 0.00 0.00 0.79 -3.14 119.26 117.40 2edp h ALA 49 Ca 0.15 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.05 2edp h ALA 49 Cb 0.05 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.73 2edp h ALA 49 CO -0.10 -0.38 -0.08 -0.07 0.00 0.00 0.00 179.25 178.62 2edp h LEU 50 N -0.31 -0.45 -1.64 0.00 3.38 -0.43 0.41 115.31 116.27 2edp h LEU 50 Ca -0.00 0.18 0.21 0.00 0.09 0.00 0.00 57.88 58.36 2edp h LEU 50 Cb 0.29 0.35 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 2edp h LEU 50 CO 0.00 -0.18 0.59 0.77 0.09 0.00 0.00 178.44 179.71 2edp h SER 51 N 0.05 0.30 -2.96 -0.43 4.64 -1.32 -3.45 113.55 110.38 2edp h SER 51 Ca 0.33 0.03 -0.36 0.00 -0.47 0.00 0.00 61.79 61.32 2edp h SER 51 Cb 0.54 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.57 2edp h SER 51 CO -0.62 0.12 -0.45 0.00 -0.87 0.00 0.00 176.83 175.01 2edp n GLN 52 N -4.45 -1.80 -0.08 4.77 6.02 0.14 -4.83 117.38 117.16 2edp n GLN 52 Ca 0.18 0.90 -0.08 0.00 -0.01 0.00 0.00 57.00 58.00 2edp n GLN 52 Cb 0.74 -5.50 -0.12 0.00 1.02 0.00 0.00 30.24 26.37 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 -2.84 1.41 -4.35 -1.09 4.76 -1.26 -5.00 118.16 109.80 2edp n LYS 53 Ca -0.21 -0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 54.99 2edp n LYS 53 Cb 0.65 -1.40 -0.13 0.00 -1.84 0.00 0.00 35.03 32.31 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 -2.38 1.14 0.06 1.97 0.23 -1.26 -5.03 119.30 114.04 2edp s MET 54 Ca -0.08 -1.08 -0.18 0.00 -1.03 0.00 0.00 55.69 53.32 2edp s MET 54 Cb 0.05 -1.35 0.04 0.00 -1.53 0.00 0.00 34.83 32.03 2edp s MET 54 CO 0.63 0.32 0.41 -0.98 -2.03 0.00 0.00 175.02 173.38 2edp s ARG 55 N -1.71 0.96 -0.50 3.16 1.70 -1.26 -4.76 118.95 116.54 2edp s ARG 55 Ca 0.06 -0.44 -0.32 0.00 -0.47 0.00 0.00 55.73 54.56 2edp s ARG 55 Cb -0.10 0.43 -0.16 0.00 -0.57 0.00 0.00 34.95 34.55 2edp s ARG 55 CO 0.03 -0.34 1.81 0.25 -1.08 0.00 0.00 175.30 175.97 2edp n THR 56 N 0.33 0.00 0.00 4.99 -2.24 -1.26 -1.81 114.28 114.29 2edp n THR 56 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2edp n THR 56 Cb 0.61 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 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 5.71 1.45 3.73 3.38 0.00 -1.01 -4.98 105.19 113.47 2edp n GLY 57 Ca 0.46 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.12 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 4.48 -0.95 1.61 1.01 -0.75 -4.69 116.67 117.37 2edp s ASP 58 Ca 0.00 2.54 -0.04 0.00 0.71 0.00 0.00 52.55 55.76 2edp s ASP 58 Cb 0.00 -2.61 0.24 0.00 1.01 0.00 0.00 42.92 41.56 2edp s ASP 58 CO 0.00 -2.09 0.87 -0.70 0.21 0.00 0.00 175.17 173.46 2edp s GLU 59 N -3.53 3.52 0.08 8.23 2.12 -1.22 -1.41 118.70 126.50 2edp s GLU 59 Ca 0.80 -3.25 -0.31 0.00 0.36 0.00 0.00 54.97 52.57 2edp s GLU 59 Cb -0.35 -4.12 -0.09 0.00 0.26 0.00 0.00 34.13 29.83 2edp s GLU 59 CO 0.41 -1.26 1.79 -1.17 -0.54 0.00 0.00 175.26 174.50 2edp s LEU 60 N -1.30 4.39 0.00 2.70 0.20 -1.22 -3.11 118.68 120.34 2edp s LEU 60 Ca 0.28 2.64 0.00 0.00 0.69 0.00 0.00 54.13 57.74 2edp s LEU 60 Cb -0.08 -3.56 0.00 0.00 -0.43 0.00 0.00 46.19 42.12 2edp s LEU 60 CO -0.11 -0.98 0.00 1.33 -0.29 0.00 0.00 176.35 176.30 2edp n VAL 61 N 4.90 0.00 -4.06 1.68 0.24 -1.23 -4.83 118.33 115.03 2edp n VAL 61 Ca 0.17 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.17 2edp n VAL 61 Cb 0.40 0.33 -0.16 0.00 -1.47 0.00 0.00 33.84 32.93 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 -1.59 2.77 -0.17 -1.34 3.84 -1.24 -0.94 114.94 116.27 2edp s ASN 62 Ca 0.00 -0.52 0.01 0.00 0.21 0.00 0.00 52.86 52.56 2edp s ASN 62 Cb 0.00 -1.24 0.02 0.00 -0.55 0.00 0.00 41.25 39.48 2edp s ASN 62 CO 0.00 -0.04 -0.19 -0.63 -2.79 0.00 0.00 177.10 173.45 2edp s ILE 63 N 1.42 1.94 -1.71 -5.21 1.01 -0.68 -1.79 121.20 116.18 2edp s ILE 63 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 2edp s ILE 63 Cb -0.13 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.58 2edp s ILE 63 CO -0.11 0.52 0.09 0.59 0.00 0.00 0.00 174.94 176.03 2edp n ASN 64 N 4.65 -5.81 -0.01 3.58 3.02 0.22 -0.77 115.26 120.14 2edp n ASN 64 Ca -0.20 -0.04 -0.00 0.00 -0.03 0.00 0.00 54.58 54.31 2edp n ASN 64 Cb 0.50 -4.82 -0.00 0.00 -0.61 0.00 0.00 39.78 34.85 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 -1.08 0.47 3.32 7.41 0.00 -1.21 -4.92 105.19 109.19 2edp n GLY 65 Ca -0.22 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.99 3.74 -0.02 2.61 2.01 0.05 -5.08 115.64 116.96 2edp s THR 66 Ca 0.00 -0.69 -0.30 0.00 0.31 0.00 0.00 61.69 61.01 2edp s THR 66 Cb 0.00 -2.88 -0.05 0.00 0.01 0.00 0.00 72.50 69.57 2edp s THR 66 CO 0.00 0.16 1.47 -2.16 -0.69 0.00 0.00 174.62 173.39 2edp s PRO 67 N 1.48 4.25 0.54 4.92 0.04 -1.26 -1.69 135.00 143.26 2edp s PRO 67 Ca 0.03 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.11 2edp s PRO 67 Cb -0.17 -3.69 0.03 0.00 0.04 0.00 0.00 34.50 30.72 2edp s PRO 67 CO 0.01 -0.66 0.75 -0.51 0.04 0.00 0.00 177.00 176.62 2edp s LEU 68 N 2.90 3.32 -0.01 -3.56 1.43 -0.12 -5.00 118.68 117.63 2edp s LEU 68 Ca 0.66 -0.08 -0.00 0.00 -1.03 0.00 0.00 54.13 53.68 2edp s LEU 68 Cb -0.32 -2.82 -0.01 0.00 0.03 0.00 0.00 46.19 43.08 2edp s LEU 68 CO 0.26 -1.11 -0.01 -1.22 0.23 0.00 0.00 176.35 174.50 2edp n TYR 69 N -2.29 0.00 0.00 0.29 4.02 -1.26 -4.97 117.16 112.95 2edp n TYR 69 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 2edp n TYR 69 Cb 0.60 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 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 3.34 0.28 3.67 2.72 0.00 -1.26 -4.98 105.19 108.97 2edp n GLY 70 Ca -0.02 -0.02 -0.65 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 1.30 0.33 1.61 2.88 -1.26 -2.41 113.62 116.07 2edp n SER 71 Ca 0.00 1.10 -0.17 0.00 -1.33 0.00 0.00 58.87 58.47 2edp n SER 71 Cb 0.00 -0.92 -0.09 0.00 -0.75 0.00 0.00 64.21 62.46 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 5.91 -0.78 0.00 -1.46 2.43 -1.92 -3.26 114.38 115.30 2edp h ARG 72 Ca -0.40 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2edp h ARG 72 Cb 1.37 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 31.10 2edp h ARG 72 CO 0.99 -0.49 0.00 1.04 -1.51 0.00 0.00 179.97 180.00 2edp n GLN 73 N -5.41 0.00 -0.26 0.20 3.00 -1.26 0.05 117.38 113.70 2edp n GLN 73 Ca -0.13 0.67 -0.00 0.00 -0.01 0.00 0.00 57.00 57.53 2edp n GLN 73 Cb 0.34 -1.03 0.03 0.00 0.00 0.00 0.00 30.24 29.58 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 -2.46 -0.16 0.00 -1.09 2.13 -1.24 0.04 120.64 117.86 2edp n GLU 74 Ca 0.00 1.06 0.00 0.00 0.66 0.00 0.00 57.16 58.88 2edp n GLU 74 Cb 0.00 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.14 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 -3.64 -0.12 -0.23 4.31 0.00 0.11 -0.54 120.51 120.40 2edp n ALA 75 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 2edp n ALA 75 Cb 0.28 0.17 0.03 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.06 -0.69 0.00 3.38 -0.77 0.39 115.31 116.56 2edp h LEU 76 Ca 0.00 0.23 0.14 0.00 0.09 0.00 0.00 57.88 58.34 2edp h LEU 76 Cb 0.00 0.56 -0.13 0.00 0.09 0.00 0.00 40.66 41.18 2edp h LEU 76 CO 0.00 -0.29 -0.15 0.40 0.09 0.00 0.00 178.44 178.49 2edp h ILE 77 N -0.11 0.32 -0.78 1.22 2.04 -0.26 0.15 117.51 120.09 2edp h ILE 77 Ca 0.27 -0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.30 2edp h ILE 77 Cb 0.55 0.31 -0.11 0.00 -0.74 0.00 0.00 36.82 36.83 2edp h ILE 77 CO -0.72 0.00 0.25 0.25 0.00 0.00 0.00 178.15 177.93 2edp h LEU 78 N 0.01 0.13 0.16 1.44 5.85 0.14 -1.40 115.31 121.65 2edp h LEU 78 Ca 0.34 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 59.19 2edp h LEU 78 Cb 0.52 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2edp h LEU 78 CO -0.69 -0.00 -0.08 0.40 -0.34 0.00 0.00 178.44 177.73 2edp h ILE 79 N 0.33 0.86 -0.68 4.05 2.04 -0.53 -2.82 117.51 120.77 2edp h ILE 79 Ca 0.45 -0.09 0.25 0.00 1.00 0.00 0.00 64.86 66.46 2edp h ILE 79 Cb 0.77 0.92 -0.12 0.00 -0.74 0.00 0.00 36.82 37.64 2edp h ILE 79 CO -0.49 0.02 0.24 0.29 0.00 0.00 0.00 178.15 178.21 2edp n LYS 80 N -5.16 -0.05 -2.17 2.37 5.02 -0.53 0.16 118.16 117.80 2edp n LYS 80 Ca -0.09 0.96 -0.34 0.00 -2.02 0.00 0.00 58.31 56.82 2edp n LYS 80 Cb 0.13 -1.65 0.02 0.00 -0.02 0.00 0.00 35.03 33.51 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 -1.23 5.73 3.70 0.72 0.00 -1.07 -5.03 105.19 108.02 2edp n GLY 81 Ca 0.22 -2.61 -0.30 0.00 0.00 0.00 0.00 46.02 43.34 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 -0.51 -1.02 -3.25 1.61 3.41 0.41 -5.04 113.62 109.23 2edp n SER 82 Ca 0.47 -1.33 -0.17 0.00 -0.26 0.00 0.00 58.87 57.59 2edp n SER 82 Cb 0.41 -1.02 -0.04 0.00 -0.26 0.00 0.00 64.21 63.31 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 -4.38 0.46 0.01 7.33 3.72 -1.26 -4.99 117.46 118.36 2edp n PHE 83 Ca 0.16 -1.40 0.20 0.00 -0.05 0.00 0.00 57.45 56.36 2edp n PHE 83 Cb 0.59 -0.12 0.71 0.00 -0.94 0.00 0.00 39.48 39.71 2edp n PHE 83 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2edp h ARG 84 N 0.00 0.00 -4.59 -1.08 -0.00 -1.95 -3.40 114.38 103.36 2edp h ARG 84 Ca -0.21 0.00 -0.49 0.00 -0.50 0.00 0.00 59.98 58.78 2edp h ARG 84 Cb 0.69 0.00 -0.33 0.00 0.00 0.00 0.00 29.97 30.34 2edp h ARG 84 CO 0.35 0.00 -0.81 0.42 0.00 0.00 0.00 179.97 179.93 2edp s ILE 85 N -4.95 1.02 -0.09 2.04 1.01 -1.26 -1.64 121.20 117.33 2edp s ILE 85 Ca -0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 60.65 60.16 2edp s ILE 85 Cb 0.19 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 2edp s ILE 85 CO 0.70 0.32 -0.07 -0.22 0.00 0.00 0.00 174.94 175.67 2edp s LEU 86 N 0.50 3.14 -0.26 2.97 2.96 -0.69 -4.92 118.68 122.38 2edp s LEU 86 Ca -0.10 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2edp s LEU 86 Cb -0.13 -1.70 0.07 0.00 0.50 0.00 0.00 46.19 44.92 2edp s LEU 86 CO 0.02 0.31 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.75 2edp s LYS 87 N -0.50 1.96 -0.09 1.98 3.01 -1.26 -0.02 119.74 124.83 2edp s LYS 87 Ca 0.07 -1.32 0.03 0.00 -1.01 0.00 0.00 55.97 53.75 2edp s LYS 87 Cb -0.12 -2.84 0.00 0.00 -1.01 0.00 0.00 37.83 33.87 2edp s LYS 87 CO 0.02 -0.63 -0.20 -0.51 0.51 0.00 0.00 175.35 174.54 2edp s LEU 88 N 1.16 1.93 -0.45 3.17 1.43 -1.17 0.72 118.68 125.48 2edp s LEU 88 Ca -0.05 -0.46 -0.07 0.00 -1.03 0.00 0.00 54.13 52.51 2edp s LEU 88 Cb -0.20 -1.19 0.11 0.00 0.03 0.00 0.00 46.19 44.94 2edp s LEU 88 CO -0.06 0.11 0.30 -0.63 0.23 0.00 0.00 176.35 176.30 2edp s ILE 89 N 0.45 3.92 0.05 -0.59 1.09 -0.74 0.21 121.20 125.60 2edp s ILE 89 Ca -0.17 -1.85 -0.09 0.00 -1.10 0.00 0.00 60.65 57.44 2edp s ILE 89 Cb -0.17 -3.60 -0.05 0.00 -1.06 0.00 0.00 42.46 37.58 2edp s ILE 89 CO 0.07 -0.73 0.36 0.68 -0.10 0.00 0.00 174.94 175.22 2edp s VAL 90 N 1.30 5.15 -0.19 2.92 -7.23 -1.24 -3.49 120.40 117.63 2edp s VAL 90 Ca 0.06 0.40 -0.03 0.00 -1.81 0.00 0.00 61.98 60.60 2edp s VAL 90 Cb -0.25 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.05 2edp s VAL 90 CO -0.02 0.33 -0.06 0.00 -0.31 0.00 0.00 175.10 175.04 2edp s ARG 91 N -1.80 3.42 0.02 4.82 1.70 -1.18 -2.84 118.95 123.09 2edp s ARG 91 Ca 0.31 -0.63 0.02 0.00 -0.47 0.00 0.00 55.73 54.96 2edp s ARG 91 Cb -0.14 -2.90 -0.01 0.00 -0.57 0.00 0.00 34.95 31.33 2edp s ARG 91 CO 0.17 -0.04 -0.06 -0.98 -1.08 0.00 0.00 175.30 173.31 2edp s ARG 92 N 1.05 0.45 -0.30 3.89 1.70 -1.08 -3.38 118.95 121.28 2edp s ARG 92 Ca 0.00 -0.48 -0.30 0.00 -0.47 0.00 0.00 55.73 54.49 2edp s ARG 92 Cb -0.15 -0.31 -0.07 0.00 -0.57 0.00 0.00 34.95 33.85 2edp s ARG 92 CO -0.00 0.07 2.25 0.54 -1.08 0.00 0.00 175.30 177.07 2edp n ARG 93 N 2.17 1.58 0.04 3.89 1.74 -1.26 -0.27 116.66 124.55 2edp n ARG 93 Ca -0.18 0.40 -0.15 0.00 -0.77 0.00 0.00 57.85 57.14 2edp n ARG 93 Cb 0.56 -3.02 -0.09 0.00 -1.02 0.00 0.00 32.46 28.89 2edp n ARG 93 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 2edp h ASN 94 N 14.81 -1.64 -2.51 0.55 -1.24 -1.82 -3.41 115.58 120.32 2edp h ASN 94 Ca -0.35 0.19 -0.60 0.00 0.71 0.00 0.00 56.30 56.25 2edp h ASN 94 Cb 1.27 0.63 0.09 0.00 0.73 0.00 0.00 38.32 41.04 2edp h ASN 94 CO 1.00 -0.51 0.39 -1.54 -1.29 0.00 0.00 177.43 175.49 2edp n SER 95 N -5.46 2.02 -4.09 1.15 3.41 -1.26 -4.80 113.62 104.59 2edp n SER 95 Ca -0.07 1.16 -0.09 0.00 -0.26 0.00 0.00 58.87 59.61 2edp n SER 95 Cb 0.39 -1.34 -0.10 0.00 -0.26 0.00 0.00 64.21 62.89 2edp n SER 95 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2edp s GLY 96 N -0.07 0.51 0.47 5.00 0.00 -1.25 -4.96 107.32 107.02 2edp s GLY 96 Ca 0.66 -1.09 0.26 0.00 0.00 0.00 0.00 44.72 44.54 2edp s GLY 96 CO 0.54 -1.18 1.90 -0.56 0.00 0.00 0.00 173.10 173.80 2edp h PRO 97 N 3.51 0.00 -3.71 2.90 0.13 -1.94 -3.31 132.00 129.58 2edp h PRO 97 Ca -0.34 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.29 2edp h PRO 97 Cb 1.16 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.91 2edp h PRO 97 CO 0.59 0.18 -0.77 0.45 -0.23 0.00 0.00 178.00 178.22 2edp s SER 98 N -6.13 2.49 -1.65 1.44 0.15 -1.26 -4.85 113.70 103.90 2edp s SER 98 Ca -0.00 -0.57 -0.11 0.00 0.70 0.00 0.00 55.95 55.97 2edp s SER 98 Cb 0.11 -0.61 0.10 0.00 -1.71 0.00 0.00 66.02 63.91 2edp s SER 98 CO 0.61 -0.25 0.42 -1.20 1.20 0.00 0.00 173.24 174.03 2edp n SER 99 N 5.05 -1.03 0.00 5.45 7.64 -1.26 -5.20 113.62 124.27 2edp n SER 99 Ca -0.09 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.63 2edp n SER 99 Cb 0.48 -2.14 0.00 0.00 -1.01 0.00 0.00 64.21 61.54 2edp n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64