#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qd7 s GLN 2 N 0.00 2.88 -0.13 -0.52 0.74 -1.26 -5.11 119.66 116.27 2qd7 s GLN 2 Ca 0.00 -0.79 0.03 0.00 0.05 0.00 0.00 55.36 54.65 2qd7 s GLN 2 Cb 0.00 -2.37 0.01 0.00 1.10 0.00 0.00 33.01 31.74 2qd7 s GLN 2 CO 0.00 0.35 -0.22 0.42 -0.55 0.00 0.00 175.29 175.28 2qd7 s ILE 3 N -0.04 2.10 0.57 -2.34 1.01 -1.26 -5.12 121.20 116.12 2qd7 s ILE 3 Ca -0.05 -0.98 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 2qd7 s ILE 3 Cb -0.14 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.48 2qd7 s ILE 3 CO 0.04 0.55 0.91 0.28 0.00 0.00 0.00 174.94 176.73 2qd7 s THR 4 N 0.67 4.28 -0.20 2.92 -1.32 -1.26 -4.99 115.64 115.74 2qd7 s THR 4 Ca -0.11 0.31 0.15 0.00 -1.21 0.00 0.00 61.69 60.84 2qd7 s THR 4 Cb -0.16 -3.68 0.49 0.00 -1.51 0.00 0.00 72.50 67.64 2qd7 s THR 4 CO 0.02 -0.76 1.39 0.18 -2.21 0.00 0.00 174.62 173.24 2qd7 n LEU 5 N -2.56 3.72 0.26 9.08 4.77 -1.26 -4.51 117.00 126.50 2qd7 n LEU 5 Ca 0.04 -3.18 0.08 0.00 -0.03 0.00 0.00 56.01 52.92 2qd7 n LEU 5 Cb 0.56 -0.55 0.64 0.00 -2.33 0.00 0.00 43.42 41.74 2qd7 n LEU 5 CO 0.55 0.80 1.04 -0.50 -1.33 0.00 0.00 177.39 177.94 2qd7 h TRP 6 N 1.38 0.00 -2.71 -1.77 -0.00 -2.06 -3.44 115.95 107.37 2qd7 h TRP 6 Ca 0.05 0.00 -0.49 0.00 -0.00 0.00 0.00 58.89 58.45 2qd7 h TRP 6 Cb 1.43 0.00 -0.14 0.00 -0.00 0.00 0.00 29.16 30.45 2qd7 h TRP 6 CO 0.54 0.04 -0.64 -1.59 -0.00 0.00 0.00 178.44 176.78 2qd7 s LYS 7 N -4.93 1.60 0.28 0.49 -2.85 -1.26 -5.11 119.74 107.95 2qd7 s LYS 7 Ca -0.05 -1.85 -0.30 0.00 -1.00 0.00 0.00 55.97 52.77 2qd7 s LYS 7 Cb 0.17 -1.03 -0.12 0.00 -2.06 0.00 0.00 37.83 34.78 2qd7 s LYS 7 CO 0.66 -0.07 1.51 0.54 0.10 0.00 0.00 175.35 178.09 2qd7 n ARG 8 N -0.64 2.43 -1.67 1.78 1.74 -1.26 -4.84 116.66 114.20 2qd7 n ARG 8 Ca -0.04 0.86 -0.42 0.00 -0.77 0.00 0.00 57.85 57.48 2qd7 n ARG 8 Cb 0.65 -2.59 -0.01 0.00 -1.02 0.00 0.00 32.46 29.50 2qd7 n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2qd7 n PRO 9 N 1.95 2.72 -3.21 5.56 -0.04 -1.26 -4.93 135.00 135.79 2qd7 n PRO 9 Ca 0.09 -2.52 -0.39 0.00 -0.04 0.00 0.00 63.50 60.64 2qd7 n PRO 9 Cb 0.35 -3.25 -0.06 0.00 -0.04 0.00 0.00 33.50 30.50 2qd7 n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qd7 s LEU 10 N 2.08 4.44 0.18 1.53 1.43 -1.26 -1.16 118.68 125.91 2qd7 s LEU 10 Ca 0.48 1.19 0.02 0.00 -1.03 0.00 0.00 54.13 54.79 2qd7 s LEU 10 Cb 0.14 -2.93 -0.05 0.00 0.03 0.00 0.00 46.19 43.39 2qd7 s LEU 10 CO -0.07 0.13 -0.01 0.68 0.23 0.00 0.00 176.35 177.31 2qd7 s VAL 11 N -0.36 0.77 0.06 -1.59 -7.23 -0.34 -4.92 120.40 106.79 2qd7 s VAL 11 Ca 0.31 -1.99 -0.26 0.00 -1.81 0.00 0.00 61.98 58.23 2qd7 s VAL 11 Cb -0.19 -2.11 -0.06 0.00 0.56 0.00 0.00 36.38 34.59 2qd7 s VAL 11 CO 0.18 -0.49 0.80 -0.89 -0.31 0.00 0.00 175.10 174.38 2qd7 s THR 12 N -3.60 4.67 0.25 5.32 2.01 -1.26 -0.88 115.64 122.15 2qd7 s THR 12 Ca 0.23 1.71 0.11 0.00 0.31 0.00 0.00 61.69 64.05 2qd7 s THR 12 Cb 0.06 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 2qd7 s THR 12 CO 0.04 0.37 -0.19 0.27 -0.69 0.00 0.00 174.62 174.42 2qd7 s ILE 13 N -0.12 2.22 -0.12 1.82 -4.36 0.65 -1.07 121.20 120.22 2qd7 s ILE 13 Ca 0.40 -2.30 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 2qd7 s ILE 13 Cb -0.21 -2.19 0.02 0.00 1.25 0.00 0.00 42.46 41.33 2qd7 s ILE 13 CO 0.24 -0.43 -0.16 -0.75 0.24 0.00 0.00 174.94 174.08 2qd7 s LYS 14 N -3.44 2.37 -0.12 0.37 2.20 -0.01 -1.32 119.74 119.79 2qd7 s LYS 14 Ca 0.26 -0.61 -0.09 0.00 -0.36 0.00 0.00 55.97 55.17 2qd7 s LYS 14 Cb -0.04 -2.03 0.04 0.00 -1.51 0.00 0.00 37.83 34.29 2qd7 s LYS 14 CO 0.12 -0.10 0.31 -1.50 -0.36 0.00 0.00 175.35 173.82 2qd7 s ILE 15 N 1.08 -0.02 -1.89 5.43 2.07 -0.43 -1.35 121.20 126.10 2qd7 s ILE 15 Ca -0.04 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.26 2qd7 s ILE 15 Cb -0.14 -0.46 0.00 0.00 0.13 0.00 0.00 42.46 41.99 2qd7 s ILE 15 CO -0.04 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.62 2qd7 n GLY 16 N 3.54 0.36 2.12 1.50 0.00 -1.26 -1.32 105.19 110.13 2qd7 n GLY 16 Ca -0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 2qd7 n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qd7 n GLY 17 N -0.78 0.48 3.29 -0.02 0.00 -1.26 -5.04 105.19 101.85 2qd7 n GLY 17 Ca -0.23 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 2qd7 n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qd7 s GLN 18 N -0.79 1.66 -0.06 1.61 -1.52 -0.43 -5.13 119.66 115.00 2qd7 s GLN 18 Ca 0.00 -0.98 -0.17 0.00 -1.95 0.00 0.00 55.36 52.26 2qd7 s GLN 18 Cb 0.00 -1.76 -0.05 0.00 -0.22 0.00 0.00 33.01 30.98 2qd7 s GLN 18 CO 0.00 0.46 0.44 -0.51 -0.25 0.00 0.00 175.29 175.43 2qd7 s LEU 19 N -1.06 4.37 0.08 2.90 1.43 -1.26 -1.31 118.68 123.82 2qd7 s LEU 19 Ca 0.09 0.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.08 2qd7 s LEU 19 Cb -0.09 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 2qd7 s LEU 19 CO 0.01 0.15 -0.03 -0.54 0.23 0.00 0.00 176.35 176.17 2qd7 s LYS 20 N -0.16 0.74 -0.11 1.70 1.02 -0.43 -4.98 119.74 117.52 2qd7 s LYS 20 Ca 0.25 -1.30 -0.08 0.00 0.02 0.00 0.00 55.97 54.86 2qd7 s LYS 20 Cb -0.16 0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.17 2qd7 s LYS 20 CO 0.12 -0.10 0.18 -1.21 -0.92 0.00 0.00 175.35 173.41 2qd7 s GLU 21 N -3.91 3.54 0.02 1.68 0.41 -1.26 -0.25 118.70 118.93 2qd7 s GLU 21 Ca 0.11 -0.06 -0.08 0.00 -0.41 0.00 0.00 54.97 54.53 2qd7 s GLU 21 Cb 0.07 -3.20 0.00 0.00 -1.78 0.00 0.00 34.13 29.22 2qd7 s GLU 21 CO -0.06 0.75 0.16 0.00 -0.49 0.00 0.00 175.26 175.61 2qd7 s ALA 22 N -0.97 -0.31 0.03 5.21 0.00 -0.06 -4.57 121.76 121.09 2qd7 s ALA 22 Ca 0.16 -0.23 -0.29 0.00 0.00 0.00 0.00 51.96 51.60 2qd7 s ALA 22 Cb -0.13 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 2qd7 s ALA 22 CO 0.05 -0.28 0.93 -0.51 0.00 0.00 0.00 175.76 175.95 2qd7 s LEU 23 N -1.74 4.41 -0.57 0.00 1.43 0.12 -1.20 118.68 121.12 2qd7 s LEU 23 Ca -0.10 1.63 -0.28 0.00 -1.03 0.00 0.00 54.13 54.35 2qd7 s LEU 23 Cb -0.04 -3.50 0.03 0.00 0.03 0.00 0.00 46.19 42.71 2qd7 s LEU 23 CO -0.01 -0.17 1.20 -0.76 0.23 0.00 0.00 176.35 176.84 2qd7 s LEU 24 N 0.62 3.46 -0.37 1.79 1.43 -0.31 -0.22 118.68 125.08 2qd7 s LEU 24 Ca 0.48 0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.77 2qd7 s LEU 24 Cb -0.21 -3.19 0.10 0.00 0.03 0.00 0.00 46.19 42.92 2qd7 s LEU 24 CO 0.27 -1.48 0.08 -0.62 0.23 0.00 0.00 176.35 174.84 2qd7 s ASP 25 N 3.00 4.67 0.47 2.29 -1.08 -0.19 -4.82 116.67 121.01 2qd7 s ASP 25 Ca 0.44 -2.27 0.32 0.00 -0.52 0.00 0.00 52.55 50.52 2qd7 s ASP 25 Cb -0.08 -1.60 1.53 0.00 -1.46 0.00 0.00 42.92 41.32 2qd7 s ASP 25 CO 0.26 -0.36 1.97 0.71 0.52 0.00 0.00 175.17 178.27 2qd7 h THR 26 N 6.43 0.00 -0.01 1.71 1.35 -1.94 -2.41 112.91 118.04 2qd7 h THR 26 Ca -0.05 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 2qd7 h THR 26 Cb 1.00 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 2qd7 h THR 26 CO 0.54 0.00 -0.04 0.61 -0.25 0.00 0.00 175.52 176.39 2qd7 n GLY 27 N -0.54 -0.53 3.48 5.82 0.00 -1.26 -4.83 105.19 107.34 2qd7 n GLY 27 Ca -0.00 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 2qd7 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qd7 s ALA 28 N -2.12 3.21 0.22 4.61 0.00 -0.91 -4.98 121.76 121.79 2qd7 s ALA 28 Ca 0.38 -1.06 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 2qd7 s ALA 28 Cb 0.21 -2.06 0.20 0.00 0.00 0.00 0.00 23.12 21.48 2qd7 s ALA 28 CO 0.38 -0.36 1.67 -0.44 0.00 0.00 0.00 175.76 177.01 2qd7 h ASP 29 N 7.95 0.84 -2.07 0.00 3.32 -1.88 0.52 116.42 125.09 2qd7 h ASP 29 Ca -0.37 -0.26 -0.60 0.00 0.02 0.00 0.00 57.03 55.81 2qd7 h ASP 29 Cb 1.18 -0.23 -0.13 0.00 0.22 0.00 0.00 39.33 40.37 2qd7 h ASP 29 CO 0.60 0.97 -0.70 -1.81 -1.72 0.00 0.00 179.24 176.57 2qd7 s ASP 30 N -6.69 3.81 -0.17 6.45 1.01 -1.26 -2.74 116.67 117.08 2qd7 s ASP 30 Ca -0.10 -1.05 -0.13 0.00 0.71 0.00 0.00 52.55 51.98 2qd7 s ASP 30 Cb 0.14 -0.40 -0.05 0.00 1.01 0.00 0.00 42.92 43.62 2qd7 s ASP 30 CO 0.83 -0.09 0.26 -0.89 0.21 0.00 0.00 175.17 175.50 2qd7 s THR 31 N -2.53 5.33 -0.10 -1.27 2.01 -1.26 -3.55 115.64 114.27 2qd7 s THR 31 Ca 0.32 0.48 0.01 0.00 0.31 0.00 0.00 61.69 62.80 2qd7 s THR 31 Cb -0.02 -3.60 0.02 0.00 0.01 0.00 0.00 72.50 68.91 2qd7 s THR 31 CO 0.17 0.39 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.70 2qd7 s VAL 32 N 0.48 1.12 -0.01 3.82 1.01 -0.02 -0.83 120.40 125.98 2qd7 s VAL 32 Ca 0.15 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.82 2qd7 s VAL 32 Cb -0.13 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 2qd7 s VAL 32 CO 0.03 0.37 -0.26 -0.63 0.00 0.00 0.00 175.10 174.61 2qd7 s ILE 33 N 1.35 2.03 0.60 2.22 -1.09 0.58 -0.43 121.20 126.46 2qd7 s ILE 33 Ca -0.01 -1.13 -0.19 0.00 -2.23 0.00 0.00 60.65 57.09 2qd7 s ILE 33 Cb -0.14 -1.69 -0.04 0.00 -1.58 0.00 0.00 42.46 39.01 2qd7 s ILE 33 CO -0.05 0.54 1.09 -0.62 -1.23 0.00 0.00 174.94 174.67 2qd7 n GLU 34 N 2.37 1.04 -1.65 2.79 1.02 -1.26 -1.94 120.64 123.01 2qd7 n GLU 34 Ca -0.16 0.40 -0.59 0.00 -0.02 0.00 0.00 57.16 56.79 2qd7 n GLU 34 Cb 0.51 -2.29 -0.08 0.00 -0.02 0.00 0.00 31.44 29.56 2qd7 n GLU 34 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2qd7 n GLU 35 N -1.19 0.65 -3.62 3.49 4.07 -0.82 -4.63 120.64 118.59 2qd7 n GLU 35 Ca 0.14 0.24 -0.14 0.00 -0.06 0.00 0.00 57.16 57.33 2qd7 n GLU 35 Cb 0.47 -1.83 -0.06 0.00 -0.06 0.00 0.00 31.44 29.96 2qd7 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2qd7 s MET 36 N 1.99 0.95 -1.26 5.31 0.23 -1.26 -5.00 119.30 120.25 2qd7 s MET 36 Ca 0.95 -0.21 -0.09 0.00 -1.03 0.00 0.00 55.69 55.31 2qd7 s MET 36 Cb -1.19 0.43 0.18 0.00 -1.53 0.00 0.00 34.83 32.72 2qd7 s MET 36 CO 0.63 -0.32 1.82 0.43 -2.03 0.00 0.00 175.02 175.56 2qd7 n SER 37 N 0.63 5.18 -4.76 -1.18 7.64 -1.26 -5.00 113.62 114.87 2qd7 n SER 37 Ca -0.19 -3.12 -0.41 0.00 1.01 0.00 0.00 58.87 56.16 2qd7 n SER 37 Cb 0.59 -1.47 -0.02 0.00 -1.01 0.00 0.00 64.21 62.30 2qd7 n SER 37 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2qd7 s LEU 38 N -0.20 4.44 0.66 -3.43 1.43 -1.26 -5.01 118.68 115.30 2qd7 s LEU 38 Ca 0.39 2.62 -0.12 0.00 -1.03 0.00 0.00 54.13 55.99 2qd7 s LEU 38 Cb 0.09 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 2qd7 s LEU 38 CO 0.01 -0.50 1.05 -2.16 0.23 0.00 0.00 176.35 174.98 2qd7 s PRO 39 N -1.53 3.18 0.04 1.29 0.04 -1.26 -4.97 135.00 131.79 2qd7 s PRO 39 Ca 0.50 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2qd7 s PRO 39 Cb -0.39 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2qd7 s PRO 39 CO 0.50 -0.91 0.00 0.41 0.04 0.00 0.00 177.00 177.04 2qd7 n GLY 40 N -1.99 -3.45 3.82 0.56 0.00 -1.26 -4.99 105.19 97.88 2qd7 n GLY 40 Ca 0.07 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 2qd7 n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qd7 s ARG 41 N -0.73 3.48 0.19 1.61 0.52 -1.26 -5.06 118.95 117.70 2qd7 s ARG 41 Ca 0.00 1.12 -0.13 0.00 -0.52 0.00 0.00 55.73 56.20 2qd7 s ARG 41 Cb 0.00 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.42 2qd7 s ARG 41 CO 0.00 -0.67 0.41 1.67 0.02 0.00 0.00 175.30 176.72 2qd7 s TRP 42 N -2.54 0.18 -0.04 -0.53 1.48 -1.26 -4.66 118.94 111.56 2qd7 s TRP 42 Ca 0.62 -0.53 0.05 0.00 -1.06 0.00 0.00 56.10 55.17 2qd7 s TRP 42 Cb -0.14 0.16 -0.01 0.00 -1.16 0.00 0.00 33.47 32.32 2qd7 s TRP 42 CO 0.37 -0.83 -0.19 0.21 -4.06 0.00 0.00 176.95 172.44 2qd7 s LYS 43 N -3.93 1.97 0.47 3.25 2.20 -0.55 -4.91 119.74 118.23 2qd7 s LYS 43 Ca 0.14 -0.69 -0.23 0.00 -0.36 0.00 0.00 55.97 54.82 2qd7 s LYS 43 Cb 0.01 -1.71 -0.07 0.00 -1.51 0.00 0.00 37.83 34.55 2qd7 s LYS 43 CO -0.00 0.30 1.26 -2.14 -0.36 0.00 0.00 175.35 174.40 2qd7 s PRO 44 N -0.06 3.64 0.03 4.03 0.02 -1.26 -0.56 135.00 140.85 2qd7 s PRO 44 Ca -0.03 2.00 -0.11 0.00 0.02 0.00 0.00 61.00 62.89 2qd7 s PRO 44 Cb -0.12 -2.46 0.01 0.00 0.02 0.00 0.00 34.50 31.95 2qd7 s PRO 44 CO 0.02 -0.71 0.23 0.21 -0.33 0.00 0.00 177.00 176.42 2qd7 s LYS 45 N -2.63 0.71 -0.05 5.54 2.20 -0.62 -4.85 119.74 120.03 2qd7 s LYS 45 Ca 0.64 -0.56 0.06 0.00 -0.36 0.00 0.00 55.97 55.75 2qd7 s LYS 45 Cb -0.34 0.30 -0.01 0.00 -1.51 0.00 0.00 37.83 36.27 2qd7 s LYS 45 CO 0.42 -0.21 -0.23 -1.64 -0.36 0.00 0.00 175.35 173.34 2qd7 s MET 46 N -2.41 2.31 0.07 4.03 -1.94 -1.26 -1.02 119.30 119.07 2qd7 s MET 46 Ca -0.06 -0.81 0.06 0.00 -1.71 0.00 0.00 55.69 53.17 2qd7 s MET 46 Cb -0.02 -1.97 -0.03 0.00 2.01 0.00 0.00 34.83 34.83 2qd7 s MET 46 CO -0.03 0.34 -0.17 0.96 -0.01 0.00 0.00 175.02 176.11 2qd7 s ILE 47 N -0.10 1.35 0.04 2.53 -4.36 -0.71 -4.97 121.20 114.98 2qd7 s ILE 47 Ca -0.04 -1.27 0.09 0.00 -0.26 0.00 0.00 60.65 59.16 2qd7 s ILE 47 Cb -0.13 -1.23 -0.03 0.00 1.25 0.00 0.00 42.46 42.32 2qd7 s ILE 47 CO 0.03 -0.06 -0.24 -0.83 0.24 0.00 0.00 174.94 174.07 2qd7 s GLY 48 N -1.55 1.30 0.00 6.27 0.00 -1.26 -0.93 107.32 111.15 2qd7 s GLY 48 Ca 0.02 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.56 2qd7 s GLY 48 CO 0.02 -1.08 0.00 0.61 0.00 0.00 0.00 173.10 172.65 2qd7 n GLY 49 N 1.85 3.65 3.72 0.20 0.00 -0.32 -4.98 105.19 109.31 2qd7 n GLY 49 Ca -0.17 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 2qd7 n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qd7 s ILE 50 N -1.95 2.13 0.00 -0.61 1.01 -1.26 -1.44 121.20 119.07 2qd7 s ILE 50 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2qd7 s ILE 50 Cb 0.00 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.41 2qd7 s ILE 50 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.56 2qd7 n GLY 51 N 3.72 2.24 0.00 6.18 0.00 -1.26 -4.95 105.19 111.13 2qd7 n GLY 51 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2qd7 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qd7 n GLY 52 N -2.00 0.44 3.77 -0.02 0.00 -0.52 -5.08 105.19 101.79 2qd7 n GLY 52 Ca 0.00 -2.16 -0.28 0.00 0.00 0.00 0.00 46.02 43.59 2qd7 n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qd7 s PHE 53 N -0.22 3.13 0.14 1.61 0.40 -1.26 -1.17 117.98 120.60 2qd7 s PHE 53 Ca 0.00 0.00 0.08 0.00 -0.60 0.00 0.00 56.93 56.41 2qd7 s PHE 53 Cb 0.00 -1.54 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 2qd7 s PHE 53 CO 0.00 0.52 -0.18 0.96 0.70 0.00 0.00 175.22 177.22 2qd7 s ILE 54 N -1.60 1.67 -0.08 0.64 -4.36 -0.10 -4.97 121.20 112.39 2qd7 s ILE 54 Ca 0.30 -1.76 -0.22 0.00 -0.26 0.00 0.00 60.65 58.71 2qd7 s ILE 54 Cb -0.11 -1.68 -0.04 0.00 1.25 0.00 0.00 42.46 41.88 2qd7 s ILE 54 CO 0.22 -0.27 0.64 -0.54 0.24 0.00 0.00 174.94 175.23 2qd7 s LYS 55 N -2.51 4.41 0.15 0.37 1.02 -1.26 -1.74 119.74 120.17 2qd7 s LYS 55 Ca 0.11 0.75 0.02 0.00 0.02 0.00 0.00 55.97 56.87 2qd7 s LYS 55 Cb -0.07 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 2qd7 s LYS 55 CO 0.05 0.09 -0.01 0.14 -0.92 0.00 0.00 175.35 174.70 2qd7 s VAL 56 N 0.76 0.63 -0.24 3.17 -7.23 -0.19 -4.34 120.40 112.97 2qd7 s VAL 56 Ca 0.34 -1.96 -0.09 0.00 -1.81 0.00 0.00 61.98 58.46 2qd7 s VAL 56 Cb -0.17 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 2qd7 s VAL 56 CO 0.16 -0.58 0.12 -0.13 -0.31 0.00 0.00 175.10 174.36 2qd7 s ARG 57 N -3.90 3.93 -0.28 4.82 0.52 0.33 -1.60 118.95 122.77 2qd7 s ARG 57 Ca 0.21 -0.34 -0.19 0.00 -0.52 0.00 0.00 55.73 54.88 2qd7 s ARG 57 Cb 0.06 -3.44 -0.02 0.00 0.52 0.00 0.00 34.95 32.07 2qd7 s ARG 57 CO 0.01 0.00 0.56 -1.14 0.02 0.00 0.00 175.30 174.75 2qd7 s GLN 58 N 1.18 4.00 -0.15 3.54 0.74 0.28 -0.82 119.66 128.43 2qd7 s GLN 58 Ca 0.06 0.31 -0.02 0.00 0.05 0.00 0.00 55.36 55.75 2qd7 s GLN 58 Cb -0.14 -3.68 -0.02 0.00 1.10 0.00 0.00 33.01 30.27 2qd7 s GLN 58 CO 0.05 -0.43 -0.07 0.71 -0.55 0.00 0.00 175.29 174.99 2qd7 s TYR 59 N 2.41 2.94 0.18 1.67 1.51 -0.21 -1.48 117.35 124.37 2qd7 s TYR 59 Ca 0.23 -0.48 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 2qd7 s TYR 59 Cb -0.15 -1.93 -0.03 0.00 -0.11 0.00 0.00 41.96 39.73 2qd7 s TYR 59 CO 0.10 -0.14 0.28 -0.51 -1.11 0.00 0.00 175.55 174.16 2qd7 s ASP 60 N 0.45 6.16 -1.40 2.29 -0.00 -1.26 -0.88 116.67 122.04 2qd7 s ASP 60 Ca -0.06 0.07 -0.08 0.00 -0.00 0.00 0.00 52.55 52.49 2qd7 s ASP 60 Cb -0.15 -1.80 0.04 0.00 -0.00 0.00 0.00 42.92 41.01 2qd7 s ASP 60 CO 0.04 0.02 0.97 0.00 -0.00 0.00 0.00 175.17 176.19 2qd7 n GLN 61 N -0.78 -6.10 -3.20 8.23 1.13 -1.14 -4.91 117.38 110.61 2qd7 n GLN 61 Ca -0.08 0.69 -0.39 0.00 -1.94 0.00 0.00 57.00 55.28 2qd7 n GLN 61 Cb 0.55 -5.55 -0.05 0.00 0.11 0.00 0.00 30.24 25.29 2qd7 n GLN 61 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2qd7 s ILE 62 N -3.40 5.04 -0.05 5.09 -1.09 -0.08 -4.74 121.20 121.97 2qd7 s ILE 62 Ca 0.41 1.20 -0.28 0.00 -2.23 0.00 0.00 60.65 59.75 2qd7 s ILE 62 Cb -0.19 -3.92 -0.03 0.00 -1.58 0.00 0.00 42.46 36.73 2qd7 s ILE 62 CO 0.79 0.34 0.89 -0.63 -1.23 0.00 0.00 174.94 175.10 2qd7 s ILE 63 N 0.34 4.91 0.06 2.92 1.01 -1.26 -1.26 121.20 127.91 2qd7 s ILE 63 Ca 0.31 1.84 0.03 0.00 0.00 0.00 0.00 60.65 62.83 2qd7 s ILE 63 Cb -0.17 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.05 2qd7 s ILE 63 CO 0.15 0.15 -0.09 -0.51 0.00 0.00 0.00 174.94 174.64 2qd7 s ILE 64 N 1.21 0.69 -0.09 2.92 2.07 -0.46 -4.44 121.20 123.10 2qd7 s ILE 64 Ca 0.46 -1.26 0.03 0.00 -1.41 0.00 0.00 60.65 58.47 2qd7 s ILE 64 Cb -0.19 -0.87 -0.01 0.00 0.13 0.00 0.00 42.46 41.52 2qd7 s ILE 64 CO 0.22 -0.43 -0.20 -0.70 -1.91 0.00 0.00 174.94 171.92 2qd7 s GLU 65 N -1.96 2.96 -0.25 3.50 2.12 -0.45 -0.71 118.70 123.91 2qd7 s GLU 65 Ca -0.05 -0.81 0.02 0.00 0.36 0.00 0.00 54.97 54.49 2qd7 s GLU 65 Cb -0.08 -2.37 0.06 0.00 0.26 0.00 0.00 34.13 32.01 2qd7 s GLU 65 CO 0.00 0.29 -0.08 0.42 -0.54 0.00 0.00 175.26 175.35 2qd7 s ILE 66 N 0.10 1.87 -1.60 -3.70 1.01 0.54 -0.83 121.20 118.60 2qd7 s ILE 66 Ca -0.10 -1.48 -0.12 0.00 0.00 0.00 0.00 60.65 58.96 2qd7 s ILE 66 Cb -0.16 -2.07 0.10 0.00 0.01 0.00 0.00 42.46 40.34 2qd7 s ILE 66 CO 0.06 -0.09 0.64 0.00 0.00 0.00 0.00 174.94 175.54 2qd7 n ALA 67 N 4.54 -1.53 -0.20 9.38 0.00 -0.23 -0.71 120.51 131.75 2qd7 n ALA 67 Ca -0.12 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2qd7 n ALA 67 Cb 0.43 -2.76 0.00 0.00 0.00 0.00 0.00 19.45 17.12 2qd7 n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qd7 n GLY 68 N -1.65 1.50 3.63 0.00 0.00 -1.26 -5.02 105.19 102.39 2qd7 n GLY 68 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2qd7 n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qd7 s HIS 69 N -2.81 3.27 0.31 1.61 4.02 0.11 -5.08 115.29 116.71 2qd7 s HIS 69 Ca 0.00 0.09 -0.28 0.00 1.02 0.00 0.00 55.06 55.90 2qd7 s HIS 69 Cb 0.00 -2.17 -0.09 0.00 -1.02 0.00 0.00 32.58 29.30 2qd7 s HIS 69 CO 0.00 0.08 1.06 0.15 1.02 0.00 0.00 174.74 177.05 2qd7 s LYS 70 N 0.74 4.52 0.12 1.40 1.02 -1.26 -0.34 119.74 125.94 2qd7 s LYS 70 Ca 0.05 1.67 -0.08 0.00 0.02 0.00 0.00 55.97 57.63 2qd7 s LYS 70 Cb -0.13 -2.99 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 2qd7 s LYS 70 CO 0.02 0.15 0.22 0.00 -0.92 0.00 0.00 175.35 174.81 2qd7 s ALA 71 N -1.33 -0.06 -0.18 5.17 0.00 0.11 -4.78 121.76 120.70 2qd7 s ALA 71 Ca 0.48 -0.79 -0.09 0.00 0.00 0.00 0.00 51.96 51.56 2qd7 s ALA 71 Cb -0.28 0.66 0.07 0.00 0.00 0.00 0.00 23.12 23.57 2qd7 s ALA 71 CO 0.35 -0.56 0.43 -1.50 0.00 0.00 0.00 175.76 174.48 2qd7 s ILE 72 N -3.92 -0.18 -0.99 0.00 2.07 -1.26 -1.36 121.20 115.56 2qd7 s ILE 72 Ca 0.11 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.46 2qd7 s ILE 72 Cb 0.04 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 41.99 2qd7 s ILE 72 CO -0.06 0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.63 2qd7 n GLY 73 N 4.56 -0.67 3.73 1.50 0.00 -0.39 -4.87 105.19 109.04 2qd7 n GLY 73 Ca -0.19 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 2qd7 n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qd7 s THR 74 N -3.00 4.48 -0.04 2.61 2.01 -1.26 -0.90 115.64 119.54 2qd7 s THR 74 Ca 0.00 2.04 0.04 0.00 0.31 0.00 0.00 61.69 64.08 2qd7 s THR 74 Cb 0.00 -4.30 -0.00 0.00 0.01 0.00 0.00 72.50 68.21 2qd7 s THR 74 CO 0.00 0.31 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.40 2qd7 s VAL 75 N 0.04 1.22 -0.18 3.82 1.01 -0.06 -4.46 120.40 121.79 2qd7 s VAL 75 Ca 0.47 -0.60 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 2qd7 s VAL 75 Cb -0.24 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2qd7 s VAL 75 CO 0.30 0.36 0.08 -0.76 0.00 0.00 0.00 175.10 175.08 2qd7 s LEU 76 N 0.13 3.91 -0.10 3.92 1.43 -0.01 -1.04 118.68 126.93 2qd7 s LEU 76 Ca -0.04 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2qd7 s LEU 76 Cb -0.11 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 2qd7 s LEU 76 CO 0.02 0.19 -0.23 -0.69 0.23 0.00 0.00 176.35 175.87 2qd7 s VAL 77 N 0.31 2.20 -1.26 -1.59 1.01 0.00 -0.31 120.40 120.77 2qd7 s VAL 77 Ca 0.05 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.05 2qd7 s VAL 77 Cb -0.12 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.42 2qd7 s VAL 77 CO -0.00 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.26 2qd7 n GLY 78 N 3.42 -0.83 2.20 4.51 0.00 -0.82 -0.52 105.19 113.15 2qd7 n GLY 78 Ca -0.19 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.78 2qd7 n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qd7 n PRO 79 N 0.00 2.89 -2.68 1.61 -0.04 -1.26 -1.94 135.00 133.58 2qd7 n PRO 79 Ca 0.00 -1.76 -0.39 0.00 -0.04 0.00 0.00 63.50 61.32 2qd7 n PRO 79 Cb 0.00 -2.37 -0.06 0.00 -0.04 0.00 0.00 33.50 31.04 2qd7 n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2qd7 s THR 80 N 1.03 3.95 -1.50 0.52 -1.32 -1.26 -4.95 115.64 112.11 2qd7 s THR 80 Ca 0.67 1.79 0.28 0.00 -1.21 0.00 0.00 61.69 63.21 2qd7 s THR 80 Cb 0.26 -4.07 0.52 0.00 -1.51 0.00 0.00 72.50 67.71 2qd7 s THR 80 CO -0.05 0.29 1.96 -0.81 -2.21 0.00 0.00 174.62 173.80 2qd7 n PRO 81 N 0.92 0.45 -3.79 7.08 -0.04 -1.26 -4.69 135.00 133.67 2qd7 n PRO 81 Ca 0.00 0.02 -0.13 0.00 -0.04 0.00 0.00 63.50 63.36 2qd7 n PRO 81 Cb 0.48 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 2qd7 n PRO 81 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qd7 s ALA 82 N -2.50 -0.60 -0.09 0.55 0.00 -1.26 -5.11 121.76 112.75 2qd7 s ALA 82 Ca 0.28 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 2qd7 s ALA 82 Cb 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2qd7 s ALA 82 CO 0.41 -0.14 1.10 -0.80 0.00 0.00 0.00 175.76 176.33 2qd7 s ASN 83 N -0.20 7.15 -0.17 0.00 0.01 -1.26 -4.60 114.94 115.86 2qd7 s ASN 83 Ca -0.03 1.66 0.00 0.00 -0.71 0.00 0.00 52.86 53.78 2qd7 s ASN 83 Cb -0.03 -2.56 0.03 0.00 0.41 0.00 0.00 41.25 39.11 2qd7 s ASN 83 CO 0.01 -0.52 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.34 2qd7 s ILE 84 N 2.17 1.47 -0.38 0.60 1.01 0.42 -0.70 121.20 125.80 2qd7 s ILE 84 Ca 0.52 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 60.24 2qd7 s ILE 84 Cb -0.21 -1.49 0.01 0.00 0.01 0.00 0.00 42.46 40.77 2qd7 s ILE 84 CO 0.19 0.29 0.58 -0.63 0.00 0.00 0.00 174.94 175.38 2qd7 s ILE 85 N 1.50 4.93 0.54 2.92 -1.09 0.69 -0.84 121.20 129.85 2qd7 s ILE 85 Ca 0.02 0.34 0.06 0.00 -2.23 0.00 0.00 60.65 58.84 2qd7 s ILE 85 Cb -0.14 -4.06 0.10 0.00 -1.58 0.00 0.00 42.46 36.77 2qd7 s ILE 85 CO -0.09 -0.35 0.74 0.61 -1.23 0.00 0.00 174.94 174.62 2qd7 n GLY 86 N 4.82 1.59 0.25 6.18 0.00 -1.23 -1.02 105.19 115.78 2qd7 n GLY 86 Ca -0.03 -2.16 0.11 0.00 0.00 0.00 0.00 46.02 43.94 2qd7 n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qd7 h ARG 87 N 0.00 0.00 -0.29 1.61 3.08 -0.88 -0.44 114.38 117.46 2qd7 h ARG 87 Ca -0.25 0.00 0.04 0.00 0.07 0.00 0.00 59.98 59.84 2qd7 h ARG 87 Cb 1.07 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2qd7 h ARG 87 CO 0.33 0.14 0.20 -2.95 -1.07 0.00 0.00 179.97 176.62 2qd7 h ASN 88 N 0.00 0.19 0.00 7.04 -1.07 -1.78 -2.33 115.58 117.63 2qd7 h ASN 88 Ca -0.00 -0.00 -0.32 0.00 0.07 0.00 0.00 56.30 56.05 2qd7 h ASN 88 Cb 0.35 -0.04 -0.06 0.00 -2.07 0.00 0.00 38.32 36.50 2qd7 h ASN 88 CO 0.02 0.13 -2.28 0.18 0.07 0.00 0.00 177.43 175.55 2qd7 n LEU 89 N -4.49 0.00 -0.14 6.14 4.77 -0.63 -4.38 117.00 118.27 2qd7 n LEU 89 Ca 0.03 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.03 2qd7 n LEU 89 Cb 0.21 0.43 0.32 0.00 -2.33 0.00 0.00 43.42 42.05 2qd7 n LEU 89 CO 0.35 0.43 1.21 -0.07 -1.33 0.00 0.00 177.39 177.98 2qd7 h LEU 90 N 0.00 0.71 -1.31 2.23 3.38 -0.96 -1.07 115.31 118.28 2qd7 h LEU 90 Ca -0.47 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 2qd7 h LEU 90 Cb 2.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.63 2qd7 h LEU 90 CO 0.03 0.50 -0.11 0.71 0.09 0.00 0.00 178.44 179.66 2qd7 h THR 91 N 0.83 1.19 0.00 0.22 1.35 -1.64 -2.22 112.91 112.65 2qd7 h THR 91 Ca 0.24 -0.83 -0.05 0.00 -0.55 0.00 0.00 66.41 65.22 2qd7 h THR 91 Cb -0.04 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.53 2qd7 h THR 91 CO -0.06 0.27 -0.24 1.56 -0.25 0.00 0.00 175.52 176.80 2qd7 h GLN 92 N 0.32 0.00 -0.54 4.72 4.20 -1.40 -2.68 115.11 119.73 2qd7 h GLN 92 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2qd7 h GLN 92 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2qd7 h GLN 92 CO 0.02 0.24 0.00 0.44 -0.67 0.00 0.00 178.83 178.86 2qd7 n ILE 93 N -3.35 0.73 -1.99 2.54 -5.35 -1.07 -4.96 119.36 105.90 2qd7 n ILE 93 Ca 0.01 -0.86 -0.04 0.00 -0.27 0.00 0.00 62.75 61.58 2qd7 n ILE 93 Cb 0.46 0.77 -0.00 0.00 -1.74 0.00 0.00 39.64 39.13 2qd7 n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qd7 n GLY 94 N 1.55 0.24 3.75 3.28 0.00 -1.01 -5.01 105.19 108.00 2qd7 n GLY 94 Ca 0.21 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 2qd7 n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qd7 s ALA 95 N -2.21 3.33 0.11 4.61 0.00 -0.86 -5.05 121.76 121.69 2qd7 s ALA 95 Ca 0.00 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.61 2qd7 s ALA 95 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2qd7 s ALA 95 CO 0.00 0.19 -0.10 0.95 0.00 0.00 0.00 175.76 176.81 2qd7 s THR 96 N -1.23 0.97 -0.17 0.00 -4.23 -1.26 -4.76 115.64 104.96 2qd7 s THR 96 Ca 0.42 -1.81 -0.08 0.00 -1.18 0.00 0.00 61.69 59.04 2qd7 s THR 96 Cb -0.25 -1.56 -0.04 0.00 1.34 0.00 0.00 72.50 71.99 2qd7 s THR 96 CO 0.31 -0.66 0.09 -0.22 -0.54 0.00 0.00 174.62 173.61 2qd7 s LEU 97 N -2.75 4.03 -0.03 4.79 0.20 -1.26 -5.09 118.68 118.57 2qd7 s LEU 97 Ca 0.10 0.20 0.02 0.00 0.69 0.00 0.00 54.13 55.14 2qd7 s LEU 97 Cb -0.00 -2.02 0.01 0.00 -0.43 0.00 0.00 46.19 43.75 2qd7 s LEU 97 CO -0.01 0.23 -0.07 0.20 -0.29 0.00 0.00 176.35 176.41 2qd7 s ASN 98 N 0.06 1.09 0.00 3.68 -0.87 -1.26 -5.29 114.94 112.34 2qd7 s ASN 98 Ca 0.07 -0.16 0.00 0.00 -1.57 0.00 0.00 52.86 51.20 2qd7 s ASN 98 Cb -0.12 -0.38 0.00 0.00 -0.02 0.00 0.00 41.25 40.73 2qd7 s ASN 98 CO 0.00 0.02 0.00 2.22 -2.57 0.00 0.00 177.10 176.77