#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 6.65 -0.08 1.61 0.01 -1.26 -5.01 113.70 115.61 2edp s SER 2 Ca 0.00 0.77 -0.35 0.00 1.31 0.00 0.00 55.95 57.67 2edp s SER 2 Cb 0.00 -2.24 -0.13 0.00 0.21 0.00 0.00 66.02 63.86 2edp s SER 2 CO 0.00 0.12 1.80 -1.20 0.41 0.00 0.00 173.24 174.38 2edp n SER 3 N 3.11 3.17 0.00 2.44 7.64 -1.26 -4.79 113.62 123.94 2edp n SER 3 Ca -0.10 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2edp n SER 3 Cb 0.52 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2edp n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2edp n GLY 4 N 4.18 -0.96 0.06 0.23 0.00 -1.26 -5.01 105.19 102.44 2edp n GLY 4 Ca 0.22 -1.28 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 2edp n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2edp h SER 5 N 0.00 0.00 -6.28 1.61 4.64 -1.87 -3.43 113.55 108.22 2edp h SER 5 Ca 0.00 -0.50 -0.47 0.00 -0.47 0.00 0.00 61.79 60.35 2edp h SER 5 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2edp h SER 5 CO 0.00 0.77 -0.79 -1.20 -0.87 0.00 0.00 176.83 174.74 2edp n SER 6 N -4.69 -3.47 0.00 4.97 7.64 -1.26 -4.70 113.62 112.12 2edp n SER 6 Ca -0.06 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 59.01 2edp n SER 6 Cb 0.25 -3.83 0.00 0.00 -1.01 0.00 0.00 64.21 59.63 2edp n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2edp n GLY 7 N -1.67 2.29 0.00 0.23 0.00 -1.26 -5.14 105.19 99.65 2edp n GLY 7 Ca -0.07 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.12 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 1.79 -0.61 3.87 -0.02 0.00 -1.26 -5.09 105.19 103.87 2edp n GLY 8 Ca 0.00 0.54 -0.04 0.00 0.00 0.00 0.00 46.02 46.51 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 2.00 0.00 0.03 1.61 1.04 -1.26 -5.14 113.70 111.99 2edp s SER 9 Ca 0.00 -0.77 0.03 0.00 0.48 0.00 0.00 55.95 55.69 2edp s SER 9 Cb 0.00 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 2edp s SER 9 CO 0.00 -1.14 -0.10 -0.36 0.98 0.00 0.00 173.24 172.62 2edp s PHE 10 N -2.20 0.85 -0.09 5.02 0.40 -1.26 -2.88 117.98 117.81 2edp s PHE 10 Ca 0.20 -0.34 -0.11 0.00 -0.60 0.00 0.00 56.93 56.09 2edp s PHE 10 Cb -0.03 -0.51 -0.05 0.00 0.51 0.00 0.00 43.02 42.94 2edp s PHE 10 CO 0.07 -0.02 0.27 -1.14 0.70 0.00 0.00 175.22 175.10 2edp s GLN 11 N -1.03 3.83 -0.06 0.44 -0.44 -0.96 -4.89 119.66 116.54 2edp s GLN 11 Ca -0.02 0.10 0.05 0.00 -2.50 0.00 0.00 55.36 52.99 2edp s GLN 11 Cb -0.07 -3.27 -0.01 0.00 -1.64 0.00 0.00 33.01 28.02 2edp s GLN 11 CO 0.01 0.60 -0.22 0.71 0.50 0.00 0.00 175.29 176.89 2edp s TYR 12 N -0.64 2.51 -0.17 1.67 1.51 -1.26 -0.87 117.35 120.10 2edp s TYR 12 Ca 0.18 -0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 55.61 2edp s TYR 12 Cb -0.14 -1.62 0.05 0.00 -0.11 0.00 0.00 41.96 40.14 2edp s TYR 12 CO 0.07 -0.14 0.01 0.14 -1.11 0.00 0.00 175.55 174.51 2edp s VAL 13 N -0.23 0.71 -0.85 0.71 -7.23 -0.91 -4.97 120.40 107.63 2edp s VAL 13 Ca -0.01 -0.54 -0.25 0.00 -1.81 0.00 0.00 61.98 59.37 2edp s VAL 13 Cb -0.13 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.68 2edp s VAL 13 CO 0.03 -0.07 1.93 -2.16 -0.31 0.00 0.00 175.10 174.53 2edp s PRO 14 N 1.79 2.57 -0.85 4.82 0.04 -1.25 -3.22 135.00 138.89 2edp s PRO 14 Ca -0.00 -0.14 -0.25 0.00 0.04 0.00 0.00 61.00 60.65 2edp s PRO 14 Cb -0.16 -4.95 -0.07 0.00 0.04 0.00 0.00 34.50 29.35 2edp s PRO 14 CO -0.07 -3.27 2.10 0.08 0.04 0.00 0.00 177.00 175.87 2edp s VAL 15 N 9.92 3.30 -0.57 -0.36 1.01 0.43 -4.79 120.40 129.34 2edp s VAL 15 Ca 0.70 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 62.20 2edp s VAL 15 Cb -0.08 -3.68 0.04 0.00 0.00 0.00 0.00 36.38 32.67 2edp s VAL 15 CO 0.03 -0.64 0.99 -1.58 0.00 0.00 0.00 175.10 173.90 2edp s GLN 16 N 7.62 3.33 0.59 2.72 0.74 -1.26 -2.72 119.66 130.68 2edp s GLN 16 Ca 0.77 -0.25 -0.07 0.00 0.05 0.00 0.00 55.36 55.85 2edp s GLN 16 Cb -0.09 -4.07 -0.01 0.00 1.10 0.00 0.00 33.01 29.94 2edp s GLN 16 CO 0.03 -1.57 0.93 -0.51 -0.55 0.00 0.00 175.29 173.62 2edp s LEU 17 N 4.17 3.26 -0.06 3.68 1.43 0.13 -4.91 118.68 126.38 2edp s LEU 17 Ca 0.31 0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 54.22 2edp s LEU 17 Cb -0.12 -3.83 0.03 0.00 0.03 0.00 0.00 46.19 42.30 2edp s LEU 17 CO 0.19 -0.97 0.32 -1.10 0.23 0.00 0.00 176.35 175.01 2edp s GLN 18 N -5.03 0.55 0.00 1.70 -0.21 -1.26 -2.71 119.66 112.70 2edp s GLN 18 Ca 0.53 0.08 0.00 0.00 0.02 0.00 0.00 55.36 55.99 2edp s GLN 18 Cb -0.11 0.25 0.00 0.00 1.00 0.00 0.00 33.01 34.15 2edp s GLN 18 CO 0.48 -0.12 0.00 0.41 -2.12 0.00 0.00 175.29 173.93 2edp n GLY 19 N 1.96 3.23 0.00 3.09 0.00 -0.54 -4.97 105.19 107.97 2edp n GLY 19 Ca -0.18 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 2.94 3.22 -0.02 0.00 -0.77 -4.79 105.19 105.77 2edp n GLY 20 Ca 0.00 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 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 0.13 -4.08 -2.16 4.61 0.00 -1.26 -4.56 120.51 113.20 2edp n ALA 21 Ca 0.00 -0.79 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 2edp n ALA 21 Cb 0.00 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.97 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 -2.91 4.35 -0.06 0.00 0.04 -1.26 -5.12 135.00 130.04 2edp s PRO 22 Ca 0.49 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 63.32 2edp s PRO 22 Cb -0.16 -3.25 -0.21 0.00 0.04 0.00 0.00 34.50 30.93 2edp s PRO 22 CO 0.73 -0.38 1.05 -1.49 0.04 0.00 0.00 177.00 176.95 2edp h TRP 23 N 6.49 -0.04 0.00 0.56 4.06 -1.99 -3.39 115.95 121.64 2edp h TRP 23 Ca -0.43 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.52 2edp h TRP 23 Cb 1.21 0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2edp h TRP 23 CO 0.65 0.56 0.00 0.41 -3.56 0.00 0.00 178.44 176.50 2edp n GLY 24 N 0.67 0.69 3.29 1.49 0.00 -1.26 0.19 105.19 110.25 2edp n GLY 24 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.37 -0.47 0.34 1.61 -0.12 -1.26 -0.52 117.98 116.20 2edp s PHE 25 Ca 0.00 1.11 0.03 0.00 -0.05 0.00 0.00 56.93 58.03 2edp s PHE 25 Cb 0.00 0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.52 2edp s PHE 25 CO 0.00 -0.24 0.12 0.95 -0.05 0.00 0.00 175.22 176.00 2edp s THR 26 N 0.43 0.64 0.30 -4.49 -4.23 0.18 -4.98 115.64 103.49 2edp s THR 26 Ca -0.02 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.52 2edp s THR 26 Cb -0.04 -2.54 -0.04 0.00 1.34 0.00 0.00 72.50 71.23 2edp s THR 26 CO -0.02 0.00 0.15 -0.76 -0.54 0.00 0.00 174.62 173.46 2edp s LEU 27 N -3.47 1.66 0.36 4.79 1.43 -1.26 -1.24 118.68 120.95 2edp s LEU 27 Ca 0.32 -1.54 -0.06 0.00 -1.03 0.00 0.00 54.13 51.82 2edp s LEU 27 Cb 0.05 0.18 0.02 0.00 0.03 0.00 0.00 46.19 46.47 2edp s LEU 27 CO 0.16 -0.87 0.56 -1.59 0.23 0.00 0.00 176.35 174.83 2edp s LYS 28 N -3.84 2.02 7.13 1.70 0.00 -1.11 -4.59 119.74 121.06 2edp s LYS 28 Ca 0.36 -1.70 0.00 0.00 0.00 0.00 0.00 55.97 54.63 2edp s LYS 28 Cb 0.05 0.49 0.00 0.00 0.00 0.00 0.00 37.83 38.37 2edp s LYS 28 CO 0.17 -0.87 0.00 0.41 0.00 0.00 0.00 175.35 175.06 2edp n GLY 29 N -0.57 2.80 0.00 0.59 0.00 -1.26 -3.85 105.19 102.90 2edp n GLY 29 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 0.39 0.17 -0.02 0.00 -0.89 -4.71 105.19 100.13 2edp n GLY 30 Ca 0.00 -2.26 -0.18 0.00 0.00 0.00 0.00 46.02 43.57 2edp n GLY 30 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 2edp h LEU 31 N 0.00 0.74 -2.01 0.99 -0.00 0.83 0.64 115.31 116.50 2edp h LEU 31 Ca 0.00 -0.64 0.11 0.00 -0.00 0.00 0.00 57.88 57.34 2edp h LEU 31 Cb 0.00 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 40.41 2edp h LEU 31 CO 0.00 1.45 0.40 -0.08 -0.00 0.00 0.00 178.44 180.21 2edp h GLU 32 N 0.28 0.00 -0.06 0.17 4.57 -1.88 0.27 114.58 117.94 2edp h GLU 32 Ca -0.13 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 2edp h GLU 32 Cb 1.76 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.35 2edp h GLU 32 CO 0.20 0.00 0.00 0.72 -1.18 0.00 0.00 179.01 178.75 2edp n HIS 33 N -3.71 0.07 -2.05 0.92 8.25 -1.20 -4.98 115.22 112.52 2edp n HIS 33 Ca 0.06 -0.11 -0.18 0.00 -0.26 0.00 0.00 57.72 57.23 2edp n HIS 33 Cb 0.57 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.64 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 -4.40 2.88 -0.67 0.00 2.02 0.22 -4.97 118.70 113.77 2edp s GLU 35 Ca 0.00 -0.59 -0.26 0.00 0.02 0.00 0.00 54.97 54.14 2edp s GLU 35 Cb 0.00 -2.74 -0.03 0.00 0.10 0.00 0.00 34.13 31.47 2edp s GLU 35 CO 0.00 0.62 1.89 -1.25 0.02 0.00 0.00 175.26 176.54 2edp s PRO 36 N -1.77 2.60 -0.79 0.39 0.04 -1.26 -2.09 135.00 132.13 2edp s PRO 36 Ca 0.22 0.43 -0.30 0.00 0.04 0.00 0.00 61.00 61.39 2edp s PRO 36 Cb -0.12 -4.53 -0.16 0.00 0.04 0.00 0.00 34.50 29.72 2edp s PRO 36 CO 0.13 -2.88 2.57 -0.11 0.04 0.00 0.00 177.00 176.75 2edp n LEU 37 N 13.06 1.06 -4.34 -3.56 7.94 -1.26 -4.77 117.00 125.14 2edp n LEU 37 Ca 0.25 -0.03 -0.18 0.00 -1.11 0.00 0.00 56.01 54.94 2edp n LEU 37 Cb 0.51 -1.16 -0.10 0.00 0.53 0.00 0.00 43.42 43.20 2edp n LEU 37 CO 0.69 -1.01 -0.41 0.42 -1.11 0.00 0.00 177.39 175.97 2edp s THR 38 N 9.92 1.53 -0.02 1.96 -4.23 -1.25 -2.86 115.64 120.69 2edp s THR 38 Ca 1.22 -2.15 -0.36 0.00 -1.18 0.00 0.00 61.69 59.22 2edp s THR 38 Cb -0.89 -2.10 -0.15 0.00 1.34 0.00 0.00 72.50 70.71 2edp s THR 38 CO 0.42 -0.56 1.61 0.52 -0.54 0.00 0.00 174.62 176.07 2edp n VAL 39 N -0.38 0.19 -0.11 2.29 0.31 -0.22 -2.77 118.33 117.65 2edp n VAL 39 Ca -0.08 -0.03 -0.17 0.00 -0.01 0.00 0.00 64.34 64.05 2edp n VAL 39 Cb 0.61 -1.31 -0.13 0.00 -0.91 0.00 0.00 33.84 32.10 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 4.26 1.59 -3.65 4.52 3.41 -0.38 -2.79 113.62 120.59 2edp n SER 40 Ca 0.21 -0.06 -0.14 0.00 -0.26 0.00 0.00 58.87 58.62 2edp n SER 40 Cb 0.22 -0.19 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.76 -0.24 4.33 2.47 -1.24 -4.94 119.74 118.34 2edp s LYS 41 Ca -0.28 0.61 -0.03 0.00 -1.56 0.00 0.00 55.97 54.71 2edp s LYS 41 Cb 0.08 0.36 0.08 0.00 -1.46 0.00 0.00 37.83 36.89 2edp s LYS 41 CO 0.67 -0.14 0.09 0.42 0.16 0.00 0.00 175.35 176.55 2edp s ILE 42 N -0.13 0.28 -0.15 5.43 1.01 -1.26 0.47 121.20 126.84 2edp s ILE 42 Ca -0.03 -0.71 -0.40 0.00 0.00 0.00 0.00 60.65 59.50 2edp s ILE 42 Cb -0.03 -1.05 -0.18 0.00 0.01 0.00 0.00 42.46 41.21 2edp s ILE 42 CO 0.03 -0.49 1.47 -0.62 0.00 0.00 0.00 174.94 175.33 2edp n GLU 43 N 5.12 0.73 -2.13 2.79 -0.58 0.32 -4.82 120.64 122.08 2edp n GLU 43 Ca -0.06 0.27 -0.43 0.00 -0.42 0.00 0.00 57.16 56.52 2edp n GLU 43 Cb 0.45 -1.87 -0.02 0.00 -0.57 0.00 0.00 31.44 29.42 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 1.83 6.29 0.00 1.62 1.11 -1.26 -2.47 116.67 123.79 2edp s ASP 44 Ca 0.94 1.46 0.00 0.00 0.18 0.00 0.00 52.55 55.13 2edp s ASP 44 Cb -1.15 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 40.31 2edp s ASP 44 CO 0.61 -1.36 0.00 0.61 1.18 0.00 0.00 175.17 176.21 2edp n GLY 45 N 4.84 1.55 1.96 0.21 0.00 -1.26 -5.08 105.19 107.41 2edp n GLY 45 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.16 -3.74 0.09 -0.02 0.00 -1.03 -4.43 105.19 95.89 2edp n GLY 46 Ca 0.00 -1.29 -0.11 0.00 0.00 0.00 0.00 46.02 44.62 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 0.20 -0.58 1.61 6.56 -0.45 0.22 116.57 124.13 2edp h LYS 47 Ca -0.24 -0.02 0.10 0.00 -1.06 0.00 0.00 60.65 59.43 2edp h LYS 47 Cb 0.81 -0.04 -0.08 0.00 -0.57 0.00 0.00 32.23 32.35 2edp h LYS 47 CO 0.15 0.22 0.14 0.00 -2.06 0.00 0.00 179.45 177.90 2edp h ALA 48 N 0.97 0.69 -0.25 3.86 0.00 -1.70 -0.90 119.26 121.93 2edp h ALA 48 Ca 0.05 0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.89 2edp h ALA 48 Cb 0.08 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2edp h ALA 48 CO -0.01 -0.29 -0.59 0.00 0.00 0.00 0.00 179.25 178.36 2edp h ALA 49 N 1.45 0.47 -0.36 0.00 0.00 -1.71 -3.21 119.26 115.90 2edp h ALA 49 Ca 0.30 -0.53 0.06 0.00 0.00 0.00 0.00 54.91 54.74 2edp h ALA 49 Cb 0.42 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2edp h ALA 49 CO -0.37 0.68 0.00 -0.07 0.00 0.00 0.00 179.25 179.50 2edp h LEU 50 N 0.62 -0.14 -1.73 0.00 3.38 0.31 -0.56 115.31 117.19 2edp h LEU 50 Ca 0.00 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.14 2edp h LEU 50 Cb 1.20 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.06 2edp h LEU 50 CO 0.13 -0.03 0.34 0.28 0.09 0.00 0.00 178.44 179.24 2edp h SER 51 N 0.10 0.28 -5.22 -0.43 0.02 -1.22 -3.46 113.55 103.62 2edp h SER 51 Ca 0.17 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.72 2edp h SER 51 Cb 0.24 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 62.73 2edp h SER 51 CO -0.29 0.17 -0.62 0.00 -1.14 0.00 0.00 176.83 174.95 2edp n GLN 52 N -4.47 -4.88 -0.00 3.45 6.02 -0.22 -4.84 117.38 112.44 2edp n GLN 52 Ca 0.07 0.72 0.03 0.00 -0.01 0.00 0.00 57.00 57.81 2edp n GLN 52 Cb 0.34 -5.56 -0.05 0.00 1.02 0.00 0.00 30.24 25.99 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 -4.15 0.27 -4.28 -1.09 4.76 -1.26 -5.02 118.16 107.38 2edp n LYS 53 Ca -0.04 -0.06 -0.19 0.00 -2.87 0.00 0.00 58.31 55.15 2edp n LYS 53 Cb 0.57 -1.15 -0.13 0.00 -1.84 0.00 0.00 35.03 32.49 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 -2.43 0.84 0.20 1.97 0.23 -1.26 -5.00 119.30 113.85 2edp s MET 54 Ca -0.02 -0.75 -0.06 0.00 -1.03 0.00 0.00 55.69 53.82 2edp s MET 54 Cb 0.04 -0.81 -0.02 0.00 -1.53 0.00 0.00 34.83 32.50 2edp s MET 54 CO 0.26 0.20 0.26 1.03 -2.03 0.00 0.00 175.02 174.74 2edp s ARG 55 N -1.21 1.27 -0.57 3.16 1.81 -1.26 -4.79 118.95 117.35 2edp s ARG 55 Ca -0.00 -1.39 -0.27 0.00 -1.72 0.00 0.00 55.73 52.34 2edp s ARG 55 Cb -0.08 0.35 -0.10 0.00 -0.45 0.00 0.00 34.95 34.67 2edp s ARG 55 CO 0.01 -0.46 2.46 0.25 -0.68 0.00 0.00 175.30 176.88 2edp n THR 56 N -0.27 -0.05 0.00 0.02 -2.24 -1.26 -1.84 114.28 108.64 2edp n THR 56 Ca -0.02 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2edp n THR 56 Cb 0.64 -2.36 0.00 0.00 -2.10 0.00 0.00 70.33 66.51 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 6.10 0.63 3.81 3.38 0.00 -1.12 -4.96 105.19 113.04 2edp n GLY 57 Ca 0.42 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.11 2edp n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2edp s ASP 58 N 0.00 6.03 -0.43 1.61 1.01 -0.76 -4.74 116.67 119.38 2edp s ASP 58 Ca 0.00 1.78 -0.10 0.00 0.71 0.00 0.00 52.55 54.94 2edp s ASP 58 Cb 0.00 -2.53 0.08 0.00 1.01 0.00 0.00 42.92 41.48 2edp s ASP 58 CO 0.00 -1.00 0.29 -0.70 0.21 0.00 0.00 175.17 173.97 2edp s GLU 59 N -3.95 2.63 -0.24 8.23 2.12 -1.24 -1.06 118.70 125.19 2edp s GLU 59 Ca 0.63 -1.49 -0.24 0.00 0.36 0.00 0.00 54.97 54.23 2edp s GLU 59 Cb -0.15 -3.84 -0.01 0.00 0.26 0.00 0.00 34.13 30.39 2edp s GLU 59 CO 0.33 -1.00 0.80 -1.17 -0.54 0.00 0.00 175.26 173.69 2edp s LEU 60 N 1.44 4.09 -0.01 2.70 0.20 -1.13 -2.77 118.68 123.20 2edp s LEU 60 Ca 0.03 1.00 0.02 0.00 0.69 0.00 0.00 54.13 55.87 2edp s LEU 60 Cb -0.24 -3.14 -0.02 0.00 -0.43 0.00 0.00 46.19 42.36 2edp s LEU 60 CO 0.02 -0.48 0.02 1.33 -0.29 0.00 0.00 176.35 176.95 2edp n VAL 61 N 5.18 0.07 -3.99 1.68 0.24 -1.24 -4.88 118.33 115.38 2edp n VAL 61 Ca 0.04 -0.06 -0.34 0.00 -2.04 0.00 0.00 64.34 61.95 2edp n VAL 61 Cb 0.48 -0.42 -0.15 0.00 -1.47 0.00 0.00 33.84 32.29 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 -2.82 4.21 -0.16 -1.34 3.84 -1.25 -0.90 114.94 116.52 2edp s ASN 62 Ca -0.01 -0.94 -0.01 0.00 0.21 0.00 0.00 52.86 52.11 2edp s ASN 62 Cb 0.01 -1.63 -0.01 0.00 -0.55 0.00 0.00 41.25 39.07 2edp s ASN 62 CO 0.07 -0.13 -0.11 -0.63 -2.79 0.00 0.00 177.10 173.52 2edp s ILE 63 N 1.28 3.14 -1.21 -5.21 1.01 -0.23 -1.91 121.20 118.08 2edp s ILE 63 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.03 2edp s ILE 63 Cb -0.17 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 39.95 2edp s ILE 63 CO -0.05 0.50 0.00 0.59 0.00 0.00 0.00 174.94 175.97 2edp n ASN 64 N 3.87 -4.19 0.00 3.58 3.02 0.66 0.28 115.26 122.49 2edp n ASN 64 Ca -0.18 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2edp n ASN 64 Cb 0.52 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 36.12 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 -0.78 0.39 3.17 7.41 0.00 -1.04 -4.82 105.19 109.50 2edp n GLY 65 Ca -0.16 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 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 2.02 0.22 2.61 2.01 0.14 -5.11 115.64 115.53 2edp s THR 66 Ca 0.00 -0.96 -0.30 0.00 0.31 0.00 0.00 61.69 60.74 2edp s THR 66 Cb 0.00 -1.79 -0.09 0.00 0.01 0.00 0.00 72.50 70.63 2edp s THR 66 CO 0.00 0.54 1.29 -2.16 -0.69 0.00 0.00 174.62 173.60 2edp s PRO 67 N 0.79 4.40 0.45 4.92 0.04 -1.26 -1.06 135.00 143.29 2edp s PRO 67 Ca -0.08 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.08 2edp s PRO 67 Cb -0.16 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.20 2edp s PRO 67 CO -0.01 -0.21 0.43 -0.51 0.04 0.00 0.00 177.00 176.73 2edp s LEU 68 N -0.38 3.25 -0.12 -3.56 1.43 -0.08 -4.96 118.68 114.26 2edp s LEU 68 Ca 0.55 -0.84 0.16 0.00 -1.03 0.00 0.00 54.13 52.97 2edp s LEU 68 Cb -0.36 -1.88 0.26 0.00 0.03 0.00 0.00 46.19 44.24 2edp s LEU 68 CO 0.40 -0.80 1.14 -1.22 0.23 0.00 0.00 176.35 176.09 2edp n TYR 69 N -1.66 0.00 -0.54 0.29 4.02 -1.26 -4.94 117.16 113.07 2edp n TYR 69 Ca 0.04 -0.90 0.00 0.00 -0.01 0.00 0.00 57.90 57.03 2edp n TYR 69 Cb 0.62 -0.14 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 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 -1.21 0.73 3.64 2.72 0.00 -1.26 -4.79 105.19 105.00 2edp n GLY 70 Ca 0.14 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.02 6.58 0.09 1.61 0.15 -1.26 0.12 113.70 118.98 2edp s SER 71 Ca 0.00 0.71 -0.21 0.00 0.70 0.00 0.00 55.95 57.15 2edp s SER 71 Cb 0.00 -2.33 -0.10 0.00 -1.71 0.00 0.00 66.02 61.88 2edp s SER 71 CO 0.00 -0.32 1.66 -0.09 1.20 0.00 0.00 173.24 175.69 2edp h ARG 72 N 7.78 0.21 0.00 5.44 9.65 -1.95 -2.90 114.38 132.61 2edp h ARG 72 Ca -0.29 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 2edp h ARG 72 Cb 1.13 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.67 2edp h ARG 72 CO 0.76 0.25 0.00 1.04 2.80 0.00 0.00 179.97 184.82 2edp n GLN 73 N -4.91 0.00 -0.26 0.20 3.00 -1.26 -1.33 117.38 112.81 2edp n GLN 73 Ca -0.05 0.49 0.04 0.00 -0.01 0.00 0.00 57.00 57.47 2edp n GLN 73 Cb 0.09 -1.25 0.10 0.00 0.00 0.00 0.00 30.24 29.18 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 -1.61 -0.07 0.00 -1.09 2.13 -1.25 -0.22 120.64 118.53 2edp n GLU 74 Ca 0.00 1.14 0.00 0.00 0.66 0.00 0.00 57.16 58.96 2edp n GLU 74 Cb 0.00 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 30.00 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 -3.73 -0.16 -0.33 4.31 0.00 -0.98 0.09 120.51 119.71 2edp n ALA 75 Ca 0.12 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.81 2edp n ALA 75 Cb 0.37 0.11 0.50 0.00 0.00 0.00 0.00 19.45 20.42 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 0.48 -0.63 0.00 3.38 -0.07 0.70 115.31 119.16 2edp h LEU 76 Ca 0.00 0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 2edp h LEU 76 Cb 0.00 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2edp h LEU 76 CO 0.00 -0.20 0.22 0.40 0.09 0.00 0.00 178.44 178.95 2edp h ILE 77 N 0.26 1.24 -0.40 1.22 2.04 -0.31 -2.96 117.51 118.61 2edp h ILE 77 Ca 0.76 -0.81 0.05 0.00 1.00 0.00 0.00 64.86 65.87 2edp h ILE 77 Cb 1.80 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 2edp h ILE 77 CO -0.64 0.31 0.12 0.25 0.00 0.00 0.00 178.15 178.19 2edp h LEU 78 N 0.90 0.11 -1.27 1.44 5.85 0.45 -1.47 115.31 121.32 2edp h LEU 78 Ca 0.21 0.05 0.19 0.00 0.84 0.00 0.00 57.88 59.16 2edp h LEU 78 Cb 0.26 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2edp h LEU 78 CO -0.01 0.10 0.61 0.40 -0.34 0.00 0.00 178.44 179.19 2edp h ILE 79 N 0.27 0.72 -1.13 4.05 2.04 -1.29 0.36 117.51 122.53 2edp h ILE 79 Ca 0.19 -0.21 0.32 0.00 1.00 0.00 0.00 64.86 66.15 2edp h ILE 79 Cb 0.19 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.23 2edp h ILE 79 CO -0.21 0.11 0.75 0.11 0.00 0.00 0.00 178.15 178.91 2edp h LYS 80 N 0.61 0.24 0.00 2.37 1.79 -1.21 0.88 116.57 121.25 2edp h LYS 80 Ca 0.51 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.88 2edp h LYS 80 Cb 0.98 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.56 2edp h LYS 80 CO -0.26 0.16 -0.38 0.78 -1.08 0.00 0.00 179.45 178.67 2edp h GLY 81 N 0.25 0.00 -3.34 3.86 0.00 -1.01 -3.46 103.07 99.37 2edp h GLY 81 Ca 0.63 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 47.51 2edp h GLY 81 CO -0.25 0.00 -0.37 -1.14 0.00 0.00 0.00 176.54 174.78 2edp n SER 82 N -3.58 -0.88 0.00 0.19 3.41 0.30 -4.94 113.62 108.13 2edp n SER 82 Ca -0.00 0.75 0.00 0.00 -0.26 0.00 0.00 58.87 59.36 2edp n SER 82 Cb 0.50 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 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 -0.02 0.00 0.00 7.33 3.72 -1.26 -4.95 117.46 122.27 2edp n PHE 83 Ca 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.52 2edp n PHE 83 Cb 0.17 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2edp n PHE 83 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 2edp n ARG 84 N -1.85 0.52 -4.61 -1.08 1.85 -1.26 -4.58 116.66 105.66 2edp n ARG 84 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.52 2edp n ARG 84 Cb 0.00 -0.70 -0.16 0.00 -1.05 0.00 0.00 32.46 30.55 2edp n ARG 84 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2edp s ILE 85 N -1.40 2.41 -0.05 8.89 1.01 -1.26 -1.46 121.20 129.33 2edp s ILE 85 Ca 0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 2edp s ILE 85 Cb 0.00 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 2edp s ILE 85 CO 0.00 0.53 0.02 -0.22 0.00 0.00 0.00 174.94 175.27 2edp s LEU 86 N 0.80 3.62 -0.19 2.97 2.96 -1.10 -4.92 118.68 122.82 2edp s LEU 86 Ca -0.06 0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.95 2edp s LEU 86 Cb -0.15 -1.95 0.04 0.00 0.50 0.00 0.00 46.19 44.62 2edp s LEU 86 CO -0.01 0.33 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.71 2edp s LYS 87 N -1.24 2.03 -0.01 1.98 1.02 -1.26 0.17 119.74 122.43 2edp s LYS 87 Ca 0.17 -0.79 0.03 0.00 0.02 0.00 0.00 55.97 55.39 2edp s LYS 87 Cb -0.11 -2.36 -0.01 0.00 -0.52 0.00 0.00 37.83 34.83 2edp s LYS 87 CO 0.07 -0.40 -0.09 -0.51 -0.92 0.00 0.00 175.35 173.49 2edp s LEU 88 N 1.42 2.00 -0.34 3.17 1.43 -1.10 0.24 118.68 125.50 2edp s LEU 88 Ca -0.00 -0.16 -0.00 0.00 -1.03 0.00 0.00 54.13 52.93 2edp s LEU 88 Cb -0.16 -0.47 0.08 0.00 0.03 0.00 0.00 46.19 45.67 2edp s LEU 88 CO -0.08 0.11 0.06 -0.63 0.23 0.00 0.00 176.35 176.03 2edp s ILE 89 N -0.17 2.83 -0.13 -0.59 1.09 -0.80 0.16 121.20 123.59 2edp s ILE 89 Ca 0.03 -1.83 -0.07 0.00 -1.10 0.00 0.00 60.65 57.68 2edp s ILE 89 Cb -0.04 -2.83 -0.04 0.00 -1.06 0.00 0.00 42.46 38.49 2edp s ILE 89 CO -0.00 -0.38 0.13 0.68 -0.10 0.00 0.00 174.94 175.26 2edp s VAL 90 N 1.12 5.40 -0.16 2.92 -7.23 -1.20 -3.66 120.40 117.60 2edp s VAL 90 Ca 0.02 0.17 -0.04 0.00 -1.81 0.00 0.00 61.98 60.33 2edp s VAL 90 Cb -0.21 -3.36 -0.02 0.00 0.56 0.00 0.00 36.38 33.35 2edp s VAL 90 CO -0.04 0.60 -0.04 0.00 -0.31 0.00 0.00 175.10 175.31 2edp s ARG 91 N -0.84 3.63 -0.16 4.82 1.70 -1.11 -2.14 118.95 124.85 2edp s ARG 91 Ca 0.14 -0.54 0.01 0.00 -0.47 0.00 0.00 55.73 54.87 2edp s ARG 91 Cb -0.12 -2.92 0.02 0.00 -0.57 0.00 0.00 34.95 31.36 2edp s ARG 91 CO 0.03 0.18 -0.17 -0.98 -1.08 0.00 0.00 175.30 173.29 2edp s ARG 92 N 0.51 2.62 0.18 3.89 1.70 -0.05 -3.72 118.95 124.08 2edp s ARG 92 Ca -0.03 -0.69 -0.32 0.00 -0.47 0.00 0.00 55.73 54.22 2edp s ARG 92 Cb -0.14 -2.30 -0.16 0.00 -0.57 0.00 0.00 34.95 31.78 2edp s ARG 92 CO 0.03 -0.20 1.09 2.89 -1.08 0.00 0.00 175.30 178.03 2edp n ARG 93 N 4.62 1.04 -2.93 3.89 1.85 -1.26 -2.26 116.66 121.60 2edp n ARG 93 Ca -0.19 0.37 -0.40 0.00 -1.00 0.00 0.00 57.85 56.63 2edp n ARG 93 Cb 0.50 -1.81 -0.05 0.00 -1.05 0.00 0.00 32.46 30.05 2edp n ARG 93 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 2edp s ASN 94 N -0.14 7.31 -0.27 2.89 0.01 -1.14 -4.86 114.94 118.74 2edp s ASN 94 Ca 0.72 1.56 -0.26 0.00 -0.71 0.00 0.00 52.86 54.17 2edp s ASN 94 Cb -0.86 -2.50 0.15 0.00 0.41 0.00 0.00 41.25 38.45 2edp s ASN 94 CO 0.54 0.05 1.18 -0.55 -1.51 0.00 0.00 177.10 176.81 2edp s SER 95 N -0.30 -0.29 0.00 -1.22 0.15 -1.26 -4.88 113.70 105.90 2edp s SER 95 Ca 0.39 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.56 2edp s SER 95 Cb -0.22 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2edp s SER 95 CO 0.25 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.18 2edp n GLY 96 N 1.74 0.21 0.10 9.45 0.00 -1.26 -4.93 105.19 110.51 2edp n GLY 96 Ca -0.11 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 2edp n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2edp h PRO 97 N 0.00 0.22 -5.83 1.61 0.13 -2.06 -3.43 132.00 122.64 2edp h PRO 97 Ca 0.00 -0.11 -0.64 0.00 -0.87 0.00 0.00 66.00 64.38 2edp h PRO 97 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.11 2edp h PRO 97 CO 0.00 0.64 1.47 0.45 -0.23 0.00 0.00 178.00 180.33 2edp n SER 98 N -4.67 1.76 -0.25 1.44 2.88 -1.26 -4.80 113.62 108.73 2edp n SER 98 Ca -0.07 0.32 0.01 0.00 -1.33 0.00 0.00 58.87 57.79 2edp n SER 98 Cb 0.32 -1.21 0.23 0.00 -0.75 0.00 0.00 64.21 62.80 2edp n SER 98 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2edp h SER 99 N 12.71 0.90 0.00 -3.46 4.64 -2.01 -3.49 113.55 122.85 2edp h SER 99 Ca -0.22 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2edp h SER 99 Cb 1.33 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2edp h SER 99 CO 1.09 0.64 0.00 0.61 -0.87 0.00 0.00 176.83 178.30