#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2di7 s SER 2 N 0.00 6.66 0.03 1.61 0.15 -1.26 -5.04 113.70 115.85 2di7 s SER 2 Ca 0.00 0.81 -0.05 0.00 0.70 0.00 0.00 55.95 57.41 2di7 s SER 2 Cb 0.00 -2.37 -0.01 0.00 -1.71 0.00 0.00 66.02 61.93 2di7 s SER 2 CO 0.00 -0.42 0.09 -0.94 1.20 0.00 0.00 173.24 173.18 2di7 s SER 3 N 1.43 0.15 -0.26 5.45 1.04 -1.26 -5.14 113.70 115.11 2di7 s SER 3 Ca 0.29 -0.46 -0.02 0.00 0.48 0.00 0.00 55.95 56.23 2di7 s SER 3 Cb -0.15 0.21 0.12 0.00 0.10 0.00 0.00 66.02 66.29 2di7 s SER 3 CO 0.08 -0.46 0.24 -0.83 0.98 0.00 0.00 173.24 173.25 2di7 s GLY 4 N -1.92 0.01 0.24 7.32 0.00 -1.26 -5.13 107.32 106.59 2di7 s GLY 4 Ca -0.08 -0.26 -0.31 0.00 0.00 0.00 0.00 44.72 44.08 2di7 s GLY 4 CO -0.03 2.39 1.24 -1.26 0.00 0.00 0.00 173.10 175.44 2di7 n SER 5 N 5.30 2.07 -0.12 1.64 2.88 -1.26 -4.92 113.62 119.21 2di7 n SER 5 Ca -0.04 1.16 -0.22 0.00 -1.33 0.00 0.00 58.87 58.44 2di7 n SER 5 Cb 0.47 -1.35 -0.10 0.00 -0.75 0.00 0.00 64.21 62.48 2di7 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2di7 n SER 6 N 1.77 1.98 0.00 -3.46 3.41 -1.26 -5.09 113.62 110.97 2di7 n SER 6 Ca 0.11 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2di7 n SER 6 Cb 0.30 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2di7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2di7 n GLY 7 N 1.92 2.17 3.63 5.00 0.00 -1.26 -5.15 105.19 111.49 2di7 n GLY 7 Ca -0.46 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 2di7 n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2di7 s GLU 8 N -0.50 2.64 0.08 1.61 2.12 -1.26 -5.13 118.70 118.26 2di7 s GLU 8 Ca 0.00 -0.68 0.08 0.00 0.36 0.00 0.00 54.97 54.73 2di7 s GLU 8 Cb 0.00 -2.56 -0.03 0.00 0.26 0.00 0.00 34.13 31.80 2di7 s GLU 8 CO 0.00 0.61 -0.21 -0.08 -0.54 0.00 0.00 175.26 175.05 2di7 s THR 9 N -1.02 1.69 0.00 -1.70 -1.32 -1.26 -5.07 115.64 106.96 2di7 s THR 9 Ca 0.18 -1.39 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 2di7 s THR 9 Cb -0.11 -1.50 0.00 0.00 -1.51 0.00 0.00 72.50 69.37 2di7 s THR 9 CO 0.08 0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 2di7 n GLY 10 N 1.43 -1.01 2.79 6.08 0.00 -1.26 -4.85 105.19 108.37 2di7 n GLY 10 Ca -0.18 -1.31 -0.16 0.00 0.00 0.00 0.00 46.02 44.36 2di7 n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2di7 s GLY 11 N 0.00 -0.08 1.03 -0.02 0.00 -1.26 -5.15 107.32 101.84 2di7 s GLY 11 Ca 0.00 0.41 -0.13 0.00 0.00 0.00 0.00 44.72 45.00 2di7 s GLY 11 CO 0.00 2.24 1.09 -0.54 0.00 0.00 0.00 173.10 175.88 2di7 s GLU 12 N 2.37 0.14 0.57 2.90 0.41 -1.26 -4.94 118.70 118.90 2di7 s GLU 12 Ca 0.08 0.49 -0.18 0.00 -0.41 0.00 0.00 54.97 54.95 2di7 s GLU 12 Cb -0.15 -1.71 -0.11 0.00 -1.78 0.00 0.00 34.13 30.38 2di7 s GLU 12 CO -0.13 -2.92 0.18 2.89 -0.49 0.00 0.00 175.26 174.80 2di7 n ARG 13 N -4.30 0.24 -4.00 1.61 1.85 -1.26 -4.95 116.66 105.85 2di7 n ARG 13 Ca 0.05 0.10 -0.32 0.00 -1.00 0.00 0.00 57.85 56.68 2di7 n ARG 13 Cb 0.57 -1.37 -0.15 0.00 -1.05 0.00 0.00 32.46 30.46 2di7 n ARG 13 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2di7 s GLN 14 N -1.67 1.80 0.10 2.89 -0.21 -1.26 -5.09 119.66 116.22 2di7 s GLN 14 Ca 0.62 -1.69 -0.31 0.00 0.02 0.00 0.00 55.36 54.00 2di7 s GLN 14 Cb -0.45 -3.17 -0.09 0.00 1.00 0.00 0.00 33.01 30.31 2di7 s GLN 14 CO 0.61 -0.84 1.60 -1.17 -2.12 0.00 0.00 175.29 173.37 2di7 s LEU 15 N 1.00 4.36 -0.11 2.90 2.96 -1.26 -3.06 118.68 125.48 2di7 s LEU 15 Ca 0.04 2.49 0.03 0.00 -0.22 0.00 0.00 54.13 56.48 2di7 s LEU 15 Cb -0.20 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 42.91 2di7 s LEU 15 CO -0.06 -0.85 -0.20 -0.44 -1.32 0.00 0.00 176.35 173.48 2di7 s SER 16 N 1.94 3.40 -0.02 3.68 0.01 -1.01 -4.91 113.70 116.80 2di7 s SER 16 Ca 0.72 -0.47 -0.26 0.00 1.31 0.00 0.00 55.95 57.25 2di7 s SER 16 Cb -0.40 -1.42 -0.20 0.00 0.21 0.00 0.00 66.02 64.21 2di7 s SER 16 CO 0.32 0.17 1.25 1.55 0.41 0.00 0.00 173.24 176.94 2di7 h PRO 17 N 6.63 -0.02 -0.52 12.44 0.13 -1.86 -2.86 132.00 145.93 2di7 h PRO 17 Ca -0.23 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.06 2di7 h PRO 17 Cb 1.22 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 2di7 h PRO 17 CO 0.50 0.45 0.55 1.05 -0.23 0.00 0.00 178.00 180.32 2di7 h GLU 18 N -0.51 0.00 0.12 0.86 9.09 -1.69 0.40 114.58 122.86 2di7 h GLU 18 Ca -0.00 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.24 2di7 h GLU 18 Cb 0.49 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.61 2di7 h GLU 18 CO 0.00 0.00 -0.72 0.87 0.05 0.00 0.00 179.01 179.21 2di7 h LYS 19 N 0.00 0.27 -6.32 1.06 1.79 -1.79 -3.47 116.57 108.12 2di7 h LYS 19 Ca 0.25 -0.46 -0.60 0.00 -2.18 0.00 0.00 60.65 57.66 2di7 h LYS 19 Cb 1.35 0.17 0.16 0.00 -1.58 0.00 0.00 32.23 32.33 2di7 h LYS 19 CO -0.00 1.22 -0.53 0.43 -1.08 0.00 0.00 179.45 179.48 2di7 n SER 20 N -4.18 -1.43 -4.45 0.86 7.64 0.13 -4.74 113.62 107.45 2di7 n SER 20 Ca -0.13 0.82 -0.33 0.00 1.01 0.00 0.00 58.87 60.23 2di7 n SER 20 Cb 0.78 -1.08 -0.13 0.00 -1.01 0.00 0.00 64.21 62.77 2di7 n SER 20 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2di7 s GLU 21 N -1.62 3.34 -0.37 1.43 -1.05 -0.75 -4.77 118.70 114.91 2di7 s GLU 21 Ca 0.64 -0.61 -0.05 0.00 -0.15 0.00 0.00 54.97 54.80 2di7 s GLU 21 Cb -0.54 -2.70 0.07 0.00 -0.44 0.00 0.00 34.13 30.52 2di7 s GLU 21 CO 0.58 0.31 0.14 0.42 0.95 0.00 0.00 175.26 177.67 2di7 s ILE 22 N 0.12 3.49 0.33 1.83 1.01 -1.26 -2.23 121.20 124.49 2di7 s ILE 22 Ca -0.04 -1.57 0.10 0.00 0.00 0.00 0.00 60.65 59.14 2di7 s ILE 22 Cb -0.14 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.11 2di7 s ILE 22 CO 0.04 -0.40 -0.11 -1.66 0.00 0.00 0.00 174.94 172.81 2di7 s TRP 23 N 1.28 2.34 0.00 3.97 -2.14 -1.17 -5.03 118.94 118.19 2di7 s TRP 23 Ca 0.02 -0.49 0.00 0.00 2.66 0.00 0.00 56.10 58.28 2di7 s TRP 23 Cb -0.21 -1.29 0.00 0.00 -3.10 0.00 0.00 33.47 28.86 2di7 s TRP 23 CO -0.01 0.58 0.00 0.41 -2.66 0.00 0.00 176.95 175.27 2di7 n GLY 24 N -0.75 3.45 0.00 3.67 0.00 -1.26 -1.64 105.19 108.66 2di7 n GLY 24 Ca -0.05 -1.69 0.07 0.00 0.00 0.00 0.00 46.02 44.36 2di7 n GLY 24 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2di7 n PRO 25 N -2.00 0.25 0.00 1.61 -0.04 -1.26 -3.10 135.00 130.45 2di7 n PRO 25 Ca 0.00 0.13 0.05 0.00 -0.04 0.00 0.00 63.50 63.64 2di7 n PRO 25 Cb 0.00 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.25 2di7 n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2di7 n GLY 26 N -0.04 -0.43 0.51 0.55 0.00 -1.26 -1.33 105.19 103.18 2di7 n GLY 26 Ca 0.08 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.10 2di7 n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2di7 n LEU 27 N -1.10 2.93 -4.96 0.99 4.77 -1.18 -5.00 117.00 113.44 2di7 n LEU 27 Ca 0.07 -2.41 -0.27 0.00 -0.03 0.00 0.00 56.01 53.37 2di7 n LEU 27 Cb 0.05 -0.29 0.15 0.00 -2.33 0.00 0.00 43.42 40.99 2di7 n LEU 27 CO 0.07 0.67 0.72 -0.54 -1.33 0.00 0.00 177.39 176.97 2di7 s LYS 28 N -1.72 1.17 -0.13 3.23 1.02 -0.45 -5.07 119.74 117.80 2di7 s LYS 28 Ca 0.25 -0.74 -0.11 0.00 0.02 0.00 0.00 55.97 55.38 2di7 s LYS 28 Cb 0.18 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 2di7 s LYS 28 CO 0.09 -1.93 -0.22 0.00 -0.92 0.00 0.00 175.35 172.38 2di7 n ALA 29 N -3.31 0.55 -3.41 5.17 0.00 -1.26 -4.81 120.51 113.43 2di7 n ALA 29 Ca 0.15 -0.55 -0.44 0.00 0.00 0.00 0.00 53.44 52.60 2di7 n ALA 29 Cb 0.60 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 20.02 2di7 n ALA 29 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2di7 s ASP 30 N -5.41 6.28 1.07 0.00 2.15 -1.26 -5.00 116.67 114.50 2di7 s ASP 30 Ca -0.18 -2.42 -0.12 0.00 0.43 0.00 0.00 52.55 50.26 2di7 s ASP 30 Cb 0.02 -2.13 0.17 0.00 -0.30 0.00 0.00 42.92 40.68 2di7 s ASP 30 CO 0.27 -0.62 0.80 1.33 -0.17 0.00 0.00 175.17 176.78 2di7 n VAL 31 N 4.29 0.00 -1.84 1.11 0.24 -1.26 -5.02 118.33 115.86 2di7 n VAL 31 Ca 0.04 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.34 61.51 2di7 n VAL 31 Cb 0.43 -1.45 0.04 0.00 -1.47 0.00 0.00 33.84 31.40 2di7 n VAL 31 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2di7 s VAL 32 N -2.63 3.01 0.11 3.34 -7.23 -1.26 -4.91 120.40 110.82 2di7 s VAL 32 Ca 0.48 0.52 -0.22 0.00 -1.81 0.00 0.00 61.98 60.95 2di7 s VAL 32 Cb -0.03 -3.08 -0.05 0.00 0.56 0.00 0.00 36.38 33.78 2di7 s VAL 32 CO 0.35 -0.24 1.09 0.18 -0.31 0.00 0.00 175.10 176.17 2di7 n LEU 33 N -2.14 -0.74 0.00 1.32 4.77 -1.26 -3.55 117.00 115.40 2di7 n LEU 33 Ca 0.11 1.26 0.00 0.00 -0.03 0.00 0.00 56.01 57.35 2di7 n LEU 33 Cb 0.51 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2di7 n LEU 33 CO 0.46 -1.02 0.00 -0.81 -1.33 0.00 0.00 177.39 174.69 2di7 n PRO 34 N -4.85 0.00 -3.54 3.23 -0.04 -1.26 -5.07 135.00 123.47 2di7 n PRO 34 Ca 0.01 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.40 2di7 n PRO 34 Cb 0.18 -0.23 -0.02 0.00 -0.04 0.00 0.00 33.50 33.39 2di7 n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2di7 s ALA 35 N -2.97 -1.89 0.20 0.55 0.00 -1.23 -4.94 121.76 111.48 2di7 s ALA 35 Ca 0.00 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.12 2di7 s ALA 35 Cb 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 2di7 s ALA 35 CO 0.00 -0.68 -0.03 1.03 0.00 0.00 0.00 175.76 176.08 2di7 s ARG 36 N -2.93 1.22 0.15 0.00 1.81 -1.26 -4.83 118.95 113.10 2di7 s ARG 36 Ca 0.07 -1.59 0.06 0.00 -1.72 0.00 0.00 55.73 52.54 2di7 s ARG 36 Cb -0.01 -0.55 -0.04 0.00 -0.45 0.00 0.00 34.95 33.90 2di7 s ARG 36 CO -0.07 -0.06 -0.12 1.52 -0.68 0.00 0.00 175.30 175.89 2di7 s TYR 37 N -3.44 1.41 0.39 -0.53 -0.85 -1.26 -4.72 117.35 108.35 2di7 s TYR 37 Ca 0.24 -0.65 0.03 0.00 -0.52 0.00 0.00 57.07 56.17 2di7 s TYR 37 Cb 0.05 -0.70 0.03 0.00 0.38 0.00 0.00 41.96 41.71 2di7 s TYR 37 CO 0.06 0.17 0.21 1.97 -1.52 0.00 0.00 175.55 176.44 2di7 n PHE 38 N -0.04 -0.32 -4.39 -3.49 -1.74 -1.25 -4.43 117.46 101.80 2di7 n PHE 38 Ca -0.11 -1.75 -0.25 0.00 -0.56 0.00 0.00 57.45 54.78 2di7 n PHE 38 Cb 0.60 -0.30 -0.12 0.00 1.52 0.00 0.00 39.48 41.17 2di7 n PHE 38 CO 0.00 0.00 0.00 0.71 -0.56 0.00 0.00 176.76 176.91 2di7 s TYR 39 N -2.11 2.10 -0.24 2.97 1.51 -0.65 -2.93 117.35 118.01 2di7 s TYR 39 Ca 0.16 -0.40 -0.00 0.00 -1.01 0.00 0.00 57.07 55.82 2di7 s TYR 39 Cb -0.01 -1.05 0.07 0.00 -0.11 0.00 0.00 41.96 40.86 2di7 s TYR 39 CO 0.10 0.43 -0.01 0.42 -1.11 0.00 0.00 175.55 175.38 2di7 s ILE 40 N -1.79 1.27 -0.24 2.71 1.01 -1.17 -3.04 121.20 119.94 2di7 s ILE 40 Ca 0.18 -1.14 -0.13 0.00 0.00 0.00 0.00 60.65 59.56 2di7 s ILE 40 Cb -0.07 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 2di7 s ILE 40 CO 0.08 -0.21 0.29 -1.58 0.00 0.00 0.00 174.94 173.53 2di7 s GLN 41 N 1.50 4.08 0.47 2.79 2.00 -0.95 -3.97 119.66 125.59 2di7 s GLN 41 Ca -0.02 -0.05 -0.21 0.00 -2.00 0.00 0.00 55.36 53.08 2di7 s GLN 41 Cb -0.18 -3.57 -0.09 0.00 0.80 0.00 0.00 33.01 29.96 2di7 s GLN 41 CO -0.09 -0.07 1.02 0.00 -0.50 0.00 0.00 175.29 175.66 2di7 s ALA 42 N 1.43 2.91 0.02 1.58 0.00 -1.26 -1.82 121.76 124.62 2di7 s ALA 42 Ca 0.13 0.57 -0.04 0.00 0.00 0.00 0.00 51.96 52.62 2di7 s ALA 42 Cb -0.15 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2di7 s ALA 42 CO 0.07 -0.23 0.06 0.08 0.00 0.00 0.00 175.76 175.75 2di7 s VAL 43 N -2.00 0.11 0.94 0.00 1.01 -1.26 -3.30 120.40 115.90 2di7 s VAL 43 Ca 0.66 -0.91 -0.15 0.00 0.00 0.00 0.00 61.98 61.58 2di7 s VAL 43 Cb -0.15 -0.51 0.18 0.00 0.00 0.00 0.00 36.38 35.90 2di7 s VAL 43 CO 0.19 -0.50 1.29 -1.81 0.00 0.00 0.00 175.10 174.27 2di7 s ASP 44 N -1.64 3.29 0.05 3.32 1.11 -0.63 -2.39 116.67 119.78 2di7 s ASP 44 Ca -0.12 0.38 0.14 0.00 0.18 0.00 0.00 52.55 53.12 2di7 s ASP 44 Cb -0.06 -0.51 0.60 0.00 1.07 0.00 0.00 42.92 44.02 2di7 s ASP 44 CO -0.01 -2.64 1.44 0.35 1.18 0.00 0.00 175.17 175.50 2di7 n THR 45 N -3.72 1.11 -0.11 -1.27 -2.24 -1.17 -2.53 114.28 104.35 2di7 n THR 45 Ca 0.14 0.29 -0.14 0.00 -2.27 0.00 0.00 64.05 62.07 2di7 n THR 45 Cb 0.60 -1.11 -0.14 0.00 -2.10 0.00 0.00 70.33 67.57 2di7 n THR 45 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2di7 n SER 46 N -1.63 1.07 0.00 3.42 7.64 -1.26 -5.02 113.62 117.84 2di7 n SER 46 Ca 0.03 -0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2di7 n SER 46 Cb 0.15 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2di7 n SER 46 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di7 n GLY 47 N 2.00 0.94 3.54 0.23 0.00 -1.05 -5.15 105.19 105.70 2di7 n GLY 47 Ca -0.39 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 2di7 n GLY 47 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2di7 s ASN 48 N -1.67 4.09 0.20 1.61 0.01 -1.26 -4.86 114.94 113.06 2di7 s ASN 48 Ca 0.00 -0.60 -0.30 0.00 -0.71 0.00 0.00 52.86 51.25 2di7 s ASN 48 Cb 0.00 -0.63 -0.08 0.00 0.41 0.00 0.00 41.25 40.95 2di7 s ASN 48 CO 0.00 0.12 0.95 -0.54 -1.51 0.00 0.00 177.10 176.12 2di7 s LYS 49 N -2.65 4.81 -0.11 -0.60 1.02 -1.26 -1.60 119.74 119.34 2di7 s LYS 49 Ca 0.23 1.48 -0.23 0.00 0.02 0.00 0.00 55.97 57.47 2di7 s LYS 49 Cb -0.09 -3.31 -0.27 0.00 -0.52 0.00 0.00 37.83 33.64 2di7 s LYS 49 CO 0.13 0.43 0.69 0.74 -0.92 0.00 0.00 175.35 176.43 2di7 h PHE 50 N 4.56 0.26 -3.32 3.18 -1.00 -1.92 -3.48 116.94 115.22 2di7 h PHE 50 Ca -0.44 -0.19 -0.20 0.00 2.81 0.00 0.00 57.97 59.95 2di7 h PHE 50 Cb 1.20 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.72 2di7 h PHE 50 CO 0.62 1.28 -0.23 0.25 -1.61 0.00 0.00 178.31 178.62 2di7 n THR 51 N -4.29 -0.32 -4.47 -1.55 -2.24 -1.26 -4.90 114.28 95.23 2di7 n THR 51 Ca -0.17 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.38 2di7 n THR 51 Cb 0.70 -1.25 -0.10 0.00 -2.10 0.00 0.00 70.33 67.58 2di7 n THR 51 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2di7 s SER 52 N -1.96 2.50 -0.38 3.42 0.15 -1.26 -3.92 113.70 112.23 2di7 s SER 52 Ca 0.00 -1.45 -0.20 0.00 0.70 0.00 0.00 55.95 54.99 2di7 s SER 52 Cb 0.00 0.08 0.01 0.00 -1.71 0.00 0.00 66.02 64.40 2di7 s SER 52 CO 0.00 -0.69 0.64 -0.94 1.20 0.00 0.00 173.24 173.44 2di7 s SER 53 N -3.52 6.39 0.00 5.45 1.04 -1.15 -2.53 113.70 119.38 2di7 s SER 53 Ca 0.33 -0.02 -0.24 0.00 0.48 0.00 0.00 55.95 56.50 2di7 s SER 53 Cb 0.07 -2.32 -0.18 0.00 0.10 0.00 0.00 66.02 63.69 2di7 s SER 53 CO 0.15 -0.65 1.30 1.55 0.98 0.00 0.00 173.24 176.56 2di7 h PRO 54 N 8.60 0.13 0.00 4.02 0.13 -1.99 -3.50 132.00 139.40 2di7 h PRO 54 Ca -0.26 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2di7 h PRO 54 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2di7 h PRO 54 CO 0.85 0.58 0.00 0.41 -0.23 0.00 0.00 178.00 179.61 2di7 n GLY 55 N 0.21 -0.63 0.00 1.56 0.00 -1.26 -5.04 105.19 100.02 2di7 n GLY 55 Ca -0.08 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2di7 n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2di7 n GLU 56 N 0.00 0.00 -3.79 1.61 4.71 -1.26 -4.71 120.64 117.20 2di7 n GLU 56 Ca 0.00 0.36 -0.29 0.00 -0.01 0.00 0.00 57.16 57.22 2di7 n GLU 56 Cb 0.00 -1.30 -0.16 0.00 -1.01 0.00 0.00 31.44 28.97 2di7 n GLU 56 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 2di7 s LYS 57 N -2.25 0.91 -0.05 3.49 -0.14 -1.26 -4.96 119.74 115.49 2di7 s LYS 57 Ca 0.00 -0.80 0.01 0.00 -1.36 0.00 0.00 55.97 53.82 2di7 s LYS 57 Cb 0.00 -2.20 -0.04 0.00 -1.68 0.00 0.00 37.83 33.91 2di7 s LYS 57 CO 0.00 -0.75 -0.04 1.33 -0.76 0.00 0.00 175.35 175.13 2di7 n VAL 58 N 4.88 0.29 -3.61 3.17 0.24 -1.26 -4.96 118.33 117.08 2di7 n VAL 58 Ca -0.07 -0.12 -0.40 0.00 -2.04 0.00 0.00 64.34 61.71 2di7 n VAL 58 Cb 0.45 -0.72 -0.11 0.00 -1.47 0.00 0.00 33.84 31.99 2di7 n VAL 58 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2di7 s PHE 59 N -2.10 3.21 0.04 6.34 0.08 -1.26 -4.22 117.98 120.07 2di7 s PHE 59 Ca -0.06 -0.69 -0.01 0.00 0.12 0.00 0.00 56.93 56.29 2di7 s PHE 59 Cb 0.02 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.01 2di7 s PHE 59 CO 0.13 -0.53 0.18 -1.14 -0.10 0.00 0.00 175.22 173.75 2di7 s GLN 60 N 1.60 3.36 -0.01 0.44 2.00 -0.98 -4.90 119.66 121.17 2di7 s GLN 60 Ca 0.04 -0.43 0.02 0.00 -2.00 0.00 0.00 55.36 52.99 2di7 s GLN 60 Cb -0.18 -3.01 -0.00 0.00 0.80 0.00 0.00 33.01 30.61 2di7 s GLN 60 CO 0.07 0.63 -0.07 0.08 -0.50 0.00 0.00 175.29 175.50 2di7 s VAL 61 N -1.42 0.55 0.06 1.34 1.01 -1.26 -2.68 120.40 118.00 2di7 s VAL 61 Ca 0.31 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.07 2di7 s VAL 61 Cb -0.13 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 2di7 s VAL 61 CO 0.24 0.16 -0.16 -0.75 0.00 0.00 0.00 175.10 174.59 2di7 s LYS 62 N -0.04 0.97 -0.12 2.72 2.47 -0.86 -4.87 119.74 120.02 2di7 s LYS 62 Ca 0.01 -0.91 0.01 0.00 -1.56 0.00 0.00 55.97 53.52 2di7 s LYS 62 Cb -0.04 -1.04 0.02 0.00 -1.46 0.00 0.00 37.83 35.31 2di7 s LYS 62 CO -0.00 0.25 -0.13 0.08 0.16 0.00 0.00 175.35 175.71 2di7 s VAL 63 N -1.03 1.37 -0.08 4.02 1.01 -1.26 -1.99 120.40 122.44 2di7 s VAL 63 Ca 0.02 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2di7 s VAL 63 Cb -0.09 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 35.00 2di7 s VAL 63 CO 0.02 0.42 -0.15 -0.44 0.00 0.00 0.00 175.10 174.96 2di7 s SER 64 N 1.36 2.18 -0.33 3.32 0.01 -0.84 -4.78 113.70 114.61 2di7 s SER 64 Ca 0.01 -0.37 -0.18 0.00 1.31 0.00 0.00 55.95 56.71 2di7 s SER 64 Cb -0.13 -0.99 -0.01 0.00 0.21 0.00 0.00 66.02 65.10 2di7 s SER 64 CO -0.07 0.04 0.50 0.00 0.41 0.00 0.00 173.24 174.12 2di7 s ALA 65 N 0.75 3.50 0.21 1.44 0.00 -1.26 -0.23 121.76 126.17 2di7 s ALA 65 Ca -0.12 -0.95 0.24 0.00 0.00 0.00 0.00 51.96 51.13 2di7 s ALA 65 Cb -0.16 -2.97 1.02 0.00 0.00 0.00 0.00 23.12 21.01 2di7 s ALA 65 CO 0.03 -1.11 1.88 -1.00 0.00 0.00 0.00 175.76 175.55 2di7 h PRO 66 N 8.38 0.00 0.00 0.00 0.13 -1.95 -3.28 132.00 135.28 2di7 h PRO 66 Ca -0.28 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.76 2di7 h PRO 66 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2di7 h PRO 66 CO 0.75 0.22 -0.60 1.49 -0.23 0.00 0.00 178.00 179.64 2di7 h GLU 67 N 0.00 0.00 -6.82 0.86 4.81 -1.92 -3.46 114.58 108.04 2di7 h GLU 67 Ca -0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.70 2di7 h GLU 67 Cb 0.66 0.00 0.08 0.00 0.63 0.00 0.00 28.75 30.12 2di7 h GLU 67 CO 0.03 0.59 0.82 -2.00 -0.73 0.00 0.00 179.01 177.72 2di7 s GLU 68 N -2.17 4.17 0.12 1.92 2.56 -1.24 -4.92 118.70 119.14 2di7 s GLU 68 Ca -0.19 2.48 -0.25 0.00 0.00 0.00 0.00 54.97 57.01 2di7 s GLU 68 Cb 0.02 -3.04 -0.06 0.00 2.00 0.00 0.00 34.13 33.05 2di7 s GLU 68 CO 0.43 -0.53 1.65 0.37 -0.56 0.00 0.00 175.26 176.62 2di7 h GLN 69 N 4.43 -0.35 -6.28 4.30 5.75 -1.90 -3.44 115.11 117.62 2di7 h GLN 69 Ca -0.48 0.02 -0.49 0.00 -0.15 0.00 0.00 58.65 57.56 2di7 h GLN 69 Cb 1.22 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 2di7 h GLN 69 CO 0.75 -0.23 -0.29 -0.59 -2.65 0.00 0.00 178.83 175.81 2di7 s PHE 70 N -6.09 2.37 -0.34 3.99 -0.71 -1.26 -5.07 117.98 110.87 2di7 s PHE 70 Ca -0.15 -0.56 0.01 0.00 -1.04 0.00 0.00 56.93 55.19 2di7 s PHE 70 Cb 0.09 -2.19 0.11 0.00 -1.21 0.00 0.00 43.02 39.81 2di7 s PHE 70 CO 0.66 -0.41 0.10 0.99 -1.34 0.00 0.00 175.22 175.22 2di7 s THR 71 N -2.52 1.46 -0.56 -4.49 2.01 -1.26 -4.72 115.64 105.55 2di7 s THR 71 Ca 0.50 -1.91 0.02 0.00 0.31 0.00 0.00 61.69 60.61 2di7 s THR 71 Cb -0.05 -2.08 0.14 0.00 0.01 0.00 0.00 72.50 70.52 2di7 s THR 71 CO 0.30 -0.68 0.33 -0.13 -0.69 0.00 0.00 174.62 173.75 2di7 s ARG 72 N 1.17 2.19 0.10 4.92 0.52 -1.26 -5.04 118.95 121.54 2di7 s ARG 72 Ca 0.11 -2.65 0.06 0.00 -0.52 0.00 0.00 55.73 52.73 2di7 s ARG 72 Cb -0.19 -3.45 -0.03 0.00 0.52 0.00 0.00 34.95 31.80 2di7 s ARG 72 CO -0.16 -1.14 -0.15 0.08 0.02 0.00 0.00 175.30 173.95 2di7 s VAL 73 N -0.32 1.31 -0.79 3.52 1.01 -1.26 -4.96 120.40 118.91 2di7 s VAL 73 Ca 0.18 -1.50 0.02 0.00 0.00 0.00 0.00 61.98 60.67 2di7 s VAL 73 Cb -0.23 -1.34 0.21 0.00 0.00 0.00 0.00 36.38 35.03 2di7 s VAL 73 CO -0.02 -0.26 0.72 0.61 0.00 0.00 0.00 175.10 176.15 2di7 n GLY 74 N 0.96 4.29 3.73 4.51 0.00 -1.26 -5.00 105.19 112.42 2di7 n GLY 74 Ca -0.19 -2.64 -0.41 0.00 0.00 0.00 0.00 46.02 42.79 2di7 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2di7 s VAL 75 N -1.72 4.39 -0.07 1.61 1.01 -1.26 -4.07 120.40 120.29 2di7 s VAL 75 Ca 0.29 1.97 -0.03 0.00 0.00 0.00 0.00 61.98 64.22 2di7 s VAL 75 Cb -0.01 -4.26 0.04 0.00 0.00 0.00 0.00 36.38 32.15 2di7 s VAL 75 CO -0.11 0.30 0.13 -1.58 0.00 0.00 0.00 175.10 173.84 2di7 s GLN 76 N 0.01 0.04 -0.53 2.72 2.00 -1.01 -5.02 119.66 117.88 2di7 s GLN 76 Ca 0.48 0.42 -0.20 0.00 -2.00 0.00 0.00 55.36 54.06 2di7 s GLN 76 Cb -0.25 -0.25 0.06 0.00 0.80 0.00 0.00 33.01 33.38 2di7 s GLN 76 CO 0.31 -0.23 0.70 0.14 -0.50 0.00 0.00 175.29 175.71 2di7 s VAL 77 N 1.64 4.76 -0.17 1.34 -7.23 -1.26 -3.04 120.40 116.44 2di7 s VAL 77 Ca -0.04 -0.38 -0.08 0.00 -1.81 0.00 0.00 61.98 59.67 2di7 s VAL 77 Cb -0.12 -4.37 -0.04 0.00 0.56 0.00 0.00 36.38 32.41 2di7 s VAL 77 CO -0.05 -0.91 0.10 -0.76 -0.31 0.00 0.00 175.10 173.17 2di7 s LEU 78 N 2.92 4.07 -0.14 1.32 1.43 -0.84 -4.88 118.68 122.57 2di7 s LEU 78 Ca 0.18 0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.20 2di7 s LEU 78 Cb -0.18 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 2di7 s LEU 78 CO 0.13 0.23 1.32 -0.62 0.23 0.00 0.00 176.35 177.63 2di7 s ASP 79 N 0.07 6.91 -0.26 2.29 -1.08 -1.26 -1.29 116.67 122.05 2di7 s ASP 79 Ca 0.08 1.79 -0.02 0.00 -0.52 0.00 0.00 52.55 53.88 2di7 s ASP 79 Cb -0.12 -2.54 -0.16 0.00 -1.46 0.00 0.00 42.92 38.64 2di7 s ASP 79 CO -0.00 -0.77 -0.23 0.54 0.52 0.00 0.00 175.17 175.23 2di7 n ARG 80 N 6.55 0.64 -3.49 4.34 5.12 -1.18 -4.98 116.66 123.67 2di7 n ARG 80 Ca 0.14 0.18 -0.16 0.00 -1.93 0.00 0.00 57.85 56.08 2di7 n ARG 80 Cb 0.45 -1.52 -0.04 0.00 -1.16 0.00 0.00 32.46 30.18 2di7 n ARG 80 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2di7 n LYS 81 N -3.47 0.75 0.01 5.56 4.76 -1.25 -5.02 118.16 119.51 2di7 n LYS 81 Ca -0.47 -2.13 -0.07 0.00 -2.87 0.00 0.00 58.31 52.77 2di7 n LYS 81 Cb 0.97 1.12 -0.05 0.00 -1.84 0.00 0.00 35.03 35.24 2di7 n LYS 81 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2di7 h ASP 82 N 0.99 -0.78 -1.48 4.39 5.19 -1.88 -3.17 116.42 119.68 2di7 h ASP 82 Ca -0.20 0.09 -0.63 0.00 -0.62 0.00 0.00 57.03 55.67 2di7 h ASP 82 Cb 0.75 0.30 -0.38 0.00 0.18 0.00 0.00 39.33 40.18 2di7 h ASP 82 CO 0.32 -0.24 -0.25 0.61 -3.12 0.00 0.00 179.24 176.56 2di7 n GLY 83 N -1.21 5.96 3.08 2.75 0.00 -1.05 -2.91 105.19 111.80 2di7 n GLY 83 Ca -0.03 -2.66 -0.10 0.00 0.00 0.00 0.00 46.02 43.23 2di7 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di7 s SER 84 N -2.90 0.66 0.05 1.61 0.01 -1.20 -4.25 113.70 107.68 2di7 s SER 84 Ca 0.50 -0.79 -0.11 0.00 1.31 0.00 0.00 55.95 56.87 2di7 s SER 84 Cb 0.42 0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.77 2di7 s SER 84 CO -0.19 -0.41 0.23 -0.36 0.41 0.00 0.00 173.24 172.91 2di7 s PHE 85 N -2.73 0.02 -0.08 2.43 0.08 -1.25 -3.11 117.98 113.33 2di7 s PHE 85 Ca -0.01 -0.24 0.04 0.00 0.12 0.00 0.00 56.93 56.84 2di7 s PHE 85 Cb -0.01 0.01 0.00 0.00 -0.57 0.00 0.00 43.02 42.45 2di7 s PHE 85 CO -0.04 -0.47 -0.20 -1.50 -0.10 0.00 0.00 175.22 172.91 2di7 s ILE 86 N -2.73 1.74 -0.60 0.64 1.10 -0.41 -3.04 121.20 117.89 2di7 s ILE 86 Ca -0.04 -0.85 -0.13 0.00 -0.51 0.00 0.00 60.65 59.13 2di7 s ILE 86 Cb -0.00 -1.51 0.15 0.00 0.15 0.00 0.00 42.46 41.25 2di7 s ILE 86 CO -0.05 0.49 0.52 -0.69 -2.11 0.00 0.00 174.94 173.10 2di7 s VAL 87 N 0.30 4.91 -0.11 4.00 1.01 -1.15 -1.99 120.40 127.37 2di7 s VAL 87 Ca -0.13 -1.94 -0.05 0.00 0.00 0.00 0.00 61.98 59.85 2di7 s VAL 87 Cb -0.16 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 2di7 s VAL 87 CO 0.06 -0.88 0.08 0.00 0.00 0.00 0.00 175.10 174.36 2di7 s ARG 88 N 1.04 3.30 0.09 2.72 1.70 -1.17 -3.97 118.95 122.67 2di7 s ARG 88 Ca 0.09 -0.25 0.04 0.00 -0.47 0.00 0.00 55.73 55.14 2di7 s ARG 88 Cb -0.23 -3.04 -0.03 0.00 -0.57 0.00 0.00 34.95 31.07 2di7 s ARG 88 CO -0.02 0.72 -0.11 1.52 -1.08 0.00 0.00 175.30 176.33 2di7 s TYR 89 N -0.89 1.10 0.20 5.89 1.13 -1.26 -2.40 117.35 121.12 2di7 s TYR 89 Ca 0.14 -0.60 0.06 0.00 -1.41 0.00 0.00 57.07 55.26 2di7 s TYR 89 Cb -0.12 -0.60 -0.04 0.00 -1.10 0.00 0.00 41.96 40.10 2di7 s TYR 89 CO 0.03 0.02 0.17 0.50 -2.51 0.00 0.00 175.55 173.76 2di7 s ARG 90 N -2.51 2.93 0.08 -3.49 3.52 -1.26 -4.89 118.95 113.33 2di7 s ARG 90 Ca 0.03 -0.94 -0.22 0.00 -0.13 0.00 0.00 55.73 54.47 2di7 s ARG 90 Cb -0.05 -2.62 0.06 0.00 -1.56 0.00 0.00 34.95 30.78 2di7 s ARG 90 CO 0.01 0.45 0.54 1.41 -0.81 0.00 0.00 175.30 176.89 2di7 s MET 91 N -3.43 1.10 -0.03 5.12 -2.45 -1.26 -4.46 119.30 113.88 2di7 s MET 91 Ca 0.32 -0.31 -0.07 0.00 -1.25 0.00 0.00 55.69 54.38 2di7 s MET 91 Cb -0.09 0.50 -0.02 0.00 1.25 0.00 0.00 34.83 36.47 2di7 s MET 91 CO 0.24 -0.42 -0.13 0.66 1.05 0.00 0.00 175.02 176.42 2di7 n TYR 92 N 0.18 0.00 -3.98 4.11 4.01 -1.26 -5.09 117.16 115.14 2di7 n TYR 92 Ca -0.18 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.58 2di7 n TYR 92 Cb 0.62 -0.18 0.01 0.00 -0.31 0.00 0.00 39.34 39.47 2di7 n TYR 92 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2di7 s ALA 93 N -2.48 -2.30 -1.14 -0.72 0.00 -1.26 -5.02 121.76 108.85 2di7 s ALA 93 Ca -0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.76 2di7 s ALA 93 Cb 0.01 0.88 0.00 0.00 0.00 0.00 0.00 23.12 24.02 2di7 s ALA 93 CO 0.16 -1.14 0.97 0.43 0.00 0.00 0.00 175.76 176.19 2di7 n SER 94 N -1.11 -3.81 -3.92 0.00 7.64 -1.26 -5.01 113.62 106.15 2di7 n SER 94 Ca 0.03 -0.52 -0.29 0.00 1.01 0.00 0.00 58.87 59.10 2di7 n SER 94 Cb 0.59 -4.61 -0.16 0.00 -1.01 0.00 0.00 64.21 59.01 2di7 n SER 94 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 2di7 s TYR 95 N -3.31 1.85 -0.15 1.43 1.13 -1.26 -4.83 117.35 112.21 2di7 s TYR 95 Ca 0.24 -1.17 -0.10 0.00 -1.41 0.00 0.00 57.07 54.62 2di7 s TYR 95 Cb -0.11 -1.39 -0.07 0.00 -1.10 0.00 0.00 41.96 39.30 2di7 s TYR 95 CO 0.65 -0.64 -0.24 1.17 -2.51 0.00 0.00 175.55 173.99 2di7 n LYS 96 N 4.84 0.38 -4.37 -3.49 3.00 -1.26 -5.05 118.16 112.20 2di7 n LYS 96 Ca -0.13 0.16 -0.23 0.00 -0.00 0.00 0.00 58.31 58.11 2di7 n LYS 96 Cb 0.48 -1.14 -0.11 0.00 0.00 0.00 0.00 35.03 34.25 2di7 n LYS 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2di7 s ASN 97 N -6.40 2.99 -0.03 3.14 2.20 -1.26 -5.03 114.94 110.55 2di7 s ASN 97 Ca -0.23 -0.89 -0.02 0.00 -0.94 0.00 0.00 52.86 50.77 2di7 s ASN 97 Cb 0.07 -0.20 0.01 0.00 -2.00 0.00 0.00 41.25 39.13 2di7 s ASN 97 CO 0.31 0.01 0.07 -0.76 -2.94 0.00 0.00 177.10 173.79 2di7 s LEU 98 N -2.81 1.72 -0.34 3.54 1.43 -1.26 -4.51 118.68 116.45 2di7 s LEU 98 Ca 0.19 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.29 2di7 s LEU 98 Cb -0.06 0.22 -0.01 0.00 0.03 0.00 0.00 46.19 46.37 2di7 s LEU 98 CO 0.08 -0.03 0.29 -0.75 0.23 0.00 0.00 176.35 176.18 2di7 s LYS 99 N 0.07 3.50 0.14 1.70 2.20 0.68 -4.54 119.74 123.50 2di7 s LYS 99 Ca -0.00 -0.57 -0.18 0.00 -0.36 0.00 0.00 55.97 54.85 2di7 s LYS 99 Cb -0.01 -3.81 -0.07 0.00 -1.51 0.00 0.00 37.83 32.43 2di7 s LYS 99 CO -0.00 -0.49 0.62 0.08 -0.36 0.00 0.00 175.35 175.21 2di7 s VAL 100 N 1.83 4.70 -0.05 4.02 1.01 -1.20 -1.99 120.40 128.73 2di7 s VAL 100 Ca 0.08 1.16 -0.03 0.00 0.00 0.00 0.00 61.98 63.19 2di7 s VAL 100 Cb -0.17 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.37 2di7 s VAL 100 CO 0.11 0.36 0.11 -1.61 0.00 0.00 0.00 175.10 174.07 2di7 s GLU 101 N -1.61 0.10 -0.03 2.72 2.02 -0.84 -0.93 118.70 120.14 2di7 s GLU 101 Ca 0.36 0.21 -0.00 0.00 0.02 0.00 0.00 54.97 55.56 2di7 s GLU 101 Cb -0.18 -0.03 0.03 0.00 0.10 0.00 0.00 34.13 34.06 2di7 s GLU 101 CO 0.20 -0.07 0.05 0.42 0.02 0.00 0.00 175.26 175.88 2di7 s ILE 102 N 0.43 -0.06 0.06 -1.63 1.09 -1.26 -2.02 121.20 117.80 2di7 s ILE 102 Ca -0.03 0.22 -0.09 0.00 -1.10 0.00 0.00 60.65 59.66 2di7 s ILE 102 Cb -0.04 -0.10 0.00 0.00 -1.06 0.00 0.00 42.46 41.25 2di7 s ILE 102 CO -0.02 0.09 0.18 -0.54 -0.10 0.00 0.00 174.94 174.56 2di7 s LYS 103 N 1.14 0.74 -0.21 2.79 1.02 -1.09 -2.86 119.74 121.27 2di7 s LYS 103 Ca -0.08 -0.77 -0.03 0.00 0.02 0.00 0.00 55.97 55.11 2di7 s LYS 103 Cb -0.13 0.30 0.07 0.00 -0.52 0.00 0.00 37.83 37.55 2di7 s LYS 103 CO -0.03 -0.22 0.06 0.12 -0.92 0.00 0.00 175.35 174.36 2di7 s PHE 104 N -3.06 0.90 -1.94 3.18 5.36 0.12 -2.32 117.98 120.22 2di7 s PHE 104 Ca -0.01 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.10 2di7 s PHE 104 Cb 0.01 -1.03 0.00 0.00 -0.34 0.00 0.00 43.02 41.66 2di7 s PHE 104 CO -0.07 -0.64 0.00 1.04 -1.46 0.00 0.00 175.22 174.09 2di7 n GLN 105 N 5.08 -1.59 -0.47 10.12 1.13 -1.26 -1.57 117.38 128.82 2di7 n GLN 105 Ca -0.08 1.09 0.00 0.00 -1.94 0.00 0.00 57.00 56.07 2di7 n GLN 105 Cb 0.46 -5.62 0.00 0.00 0.11 0.00 0.00 30.24 25.19 2di7 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2di7 n GLY 106 N -0.71 1.14 2.74 1.08 0.00 -1.26 -5.08 105.19 103.10 2di7 n GLY 106 Ca -0.22 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 2di7 n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2di7 s GLN 107 N -1.27 0.51 0.32 1.61 -0.21 -0.61 -5.12 119.66 114.87 2di7 s GLN 107 Ca 0.00 0.02 -0.29 0.00 0.02 0.00 0.00 55.36 55.11 2di7 s GLN 107 Cb 0.00 -1.20 -0.12 0.00 1.00 0.00 0.00 33.01 32.69 2di7 s GLN 107 CO 0.00 -0.40 1.54 0.72 -2.12 0.00 0.00 175.29 175.04 2di7 n HIS 108 N 5.15 2.84 -0.11 0.91 8.25 -1.26 0.16 115.22 131.17 2di7 n HIS 108 Ca -0.07 0.33 -0.22 0.00 -0.26 0.00 0.00 57.72 57.51 2di7 n HIS 108 Cb 0.49 -2.56 -0.11 0.00 1.12 0.00 0.00 29.99 28.93 2di7 n HIS 108 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2di7 n VAL 109 N 1.54 1.53 -3.93 1.59 0.31 -1.14 -3.73 118.33 114.50 2di7 n VAL 109 Ca 0.06 -0.05 -0.15 0.00 -0.01 0.00 0.00 64.34 64.20 2di7 n VAL 109 Cb 0.37 -2.05 -0.01 0.00 -0.91 0.00 0.00 33.84 31.24 2di7 n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2di7 n ALA 110 N -3.54 0.36 -1.02 3.52 0.00 -1.26 -3.96 120.51 114.61 2di7 n ALA 110 Ca -0.33 -1.15 -0.31 0.00 0.00 0.00 0.00 53.44 51.65 2di7 n ALA 110 Cb 0.68 0.53 -0.02 0.00 0.00 0.00 0.00 19.45 20.63 2di7 n ALA 110 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2di7 n LYS 111 N -0.99 2.57 -3.95 0.00 4.76 -1.26 -4.89 118.16 114.40 2di7 n LYS 111 Ca -0.04 -1.80 -0.21 0.00 -2.87 0.00 0.00 58.31 53.38 2di7 n LYS 111 Cb 0.32 -2.67 -0.03 0.00 -1.84 0.00 0.00 35.03 30.82 2di7 n LYS 111 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2di7 s SER 112 N 3.18 5.95 1.00 4.39 0.01 -1.26 -4.37 113.70 122.61 2di7 s SER 112 Ca 0.51 -0.10 -0.12 0.00 1.31 0.00 0.00 55.95 57.54 2di7 s SER 112 Cb 0.13 -1.58 0.19 0.00 0.21 0.00 0.00 66.02 64.97 2di7 s SER 112 CO -0.03 -0.12 1.09 -2.16 0.41 0.00 0.00 173.24 172.43 2di7 s PRO 113 N -3.96 0.38 -0.18 12.44 0.04 -1.26 -4.98 135.00 137.49 2di7 s PRO 113 Ca 0.35 0.51 -0.03 0.00 0.04 0.00 0.00 61.00 61.87 2di7 s PRO 113 Cb -0.08 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 2di7 s PRO 113 CO 0.28 -2.76 -0.05 0.71 0.04 0.00 0.00 177.00 175.22 2di7 s TYR 114 N -2.96 2.97 -0.32 0.56 2.02 -0.10 -4.94 117.35 114.58 2di7 s TYR 114 Ca 0.65 -0.56 -0.03 0.00 -0.37 0.00 0.00 57.07 56.76 2di7 s TYR 114 Cb -0.19 -2.00 0.05 0.00 -0.40 0.00 0.00 41.96 39.42 2di7 s TYR 114 CO 0.58 -0.25 0.04 0.42 -1.57 0.00 0.00 175.55 174.77 2di7 s ILE 115 N 0.78 3.25 -0.11 2.71 -1.09 -1.26 -3.22 121.20 122.26 2di7 s ILE 115 Ca -0.02 -1.32 -0.01 0.00 -2.23 0.00 0.00 60.65 57.07 2di7 s ILE 115 Cb -0.15 -2.87 0.03 0.00 -1.58 0.00 0.00 42.46 37.89 2di7 s ILE 115 CO 0.02 -0.15 -0.06 -0.76 -1.23 0.00 0.00 174.94 172.76 2di7 s LEU 116 N 1.30 1.13 -0.00 2.97 1.02 -1.26 -4.96 118.68 118.86 2di7 s LEU 116 Ca -0.04 -0.32 0.00 0.00 0.02 0.00 0.00 54.13 53.80 2di7 s LEU 116 Cb -0.20 -0.77 0.01 0.00 0.02 0.00 0.00 46.19 45.25 2di7 s LEU 116 CO 0.00 -0.15 0.67 2.29 0.02 0.00 0.00 176.35 179.19 2di7 n LYS 117 N 4.98 0.75 -4.13 1.70 0.00 -1.26 -4.46 118.16 115.74 2di7 n LYS 117 Ca -0.11 -0.82 -0.27 0.00 -0.00 0.00 0.00 58.31 57.10 2di7 n LYS 117 Cb 0.50 -0.64 -0.07 0.00 -0.00 0.00 0.00 35.03 34.82 2di7 n LYS 117 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2di7 s GLY 118 N -0.38 1.78 -0.38 2.58 0.00 -1.26 -5.08 107.32 104.58 2di7 s GLY 118 Ca 0.01 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.51 2di7 s GLY 118 CO 0.00 -1.23 0.18 -0.56 0.00 0.00 0.00 173.10 171.49 2di7 s SER 119 N -2.84 3.68 0.00 1.64 0.01 -1.26 -4.65 113.70 110.27 2di7 s SER 119 Ca 0.29 -2.20 0.00 0.00 1.31 0.00 0.00 55.95 55.35 2di7 s SER 119 Cb -0.10 -0.87 0.00 0.00 0.21 0.00 0.00 66.02 65.26 2di7 s SER 119 CO 0.21 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.14 2di7 n GLY 120 N 4.09 1.08 3.62 3.44 0.00 -1.26 -5.07 105.19 111.10 2di7 n GLY 120 Ca 0.05 -2.20 -0.29 0.00 0.00 0.00 0.00 46.02 43.58 2di7 n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2di7 s PRO 121 N -1.28 -0.61 0.89 1.61 0.04 -1.26 -5.06 135.00 129.33 2di7 s PRO 121 Ca 0.00 0.16 -0.12 0.00 0.04 0.00 0.00 61.00 61.07 2di7 s PRO 121 Cb 0.00 -1.65 0.17 0.00 0.04 0.00 0.00 34.50 33.06 2di7 s PRO 121 CO 0.00 -3.35 1.23 -1.12 0.04 0.00 0.00 177.00 173.81 2di7 s SER 122 N -3.71 3.58 0.22 6.66 0.01 -1.26 -5.10 113.70 114.10 2di7 s SER 122 Ca 0.69 0.23 0.08 0.00 1.31 0.00 0.00 55.95 58.26 2di7 s SER 122 Cb -0.13 -0.41 -0.04 0.00 0.21 0.00 0.00 66.02 65.64 2di7 s SER 122 CO 0.57 -2.43 0.01 -0.55 0.41 0.00 0.00 173.24 171.25 2di7 s SER 123 N -4.81 4.72 0.00 2.44 0.15 -1.26 -5.26 113.70 109.67 2di7 s SER 123 Ca 0.71 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.85 2di7 s SER 123 Cb -0.05 -0.96 0.00 0.00 -1.71 0.00 0.00 66.02 63.30 2di7 s SER 123 CO 0.51 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.59