#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 5.41 -0.20 1.61 0.15 -1.26 -5.02 113.70 114.39 2di7 s SER 2 Ca 0.00 2.78 -0.30 0.00 0.70 0.00 0.00 55.95 59.13 2di7 s SER 2 Cb 0.00 -2.64 0.15 0.00 -1.71 0.00 0.00 66.02 61.82 2di7 s SER 2 CO 0.00 -1.48 1.13 -0.55 1.20 0.00 0.00 173.24 173.54 2di7 s SER 3 N -0.88 -0.25 0.00 5.45 0.15 -1.26 -5.11 113.70 111.80 2di7 s SER 3 Ca 0.69 0.27 0.00 0.00 0.70 0.00 0.00 55.95 57.61 2di7 s SER 3 Cb -0.41 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.11 2di7 s SER 3 CO 0.49 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.31 2di7 n GLY 4 N 0.64 -2.36 2.86 9.45 0.00 -1.26 -5.11 105.19 109.42 2di7 n GLY 4 Ca -0.07 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 2di7 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di7 s SER 5 N 0.00 0.22 0.41 1.61 0.01 -1.26 -5.16 113.70 109.53 2di7 s SER 5 Ca 0.00 0.25 0.07 0.00 1.31 0.00 0.00 55.95 57.59 2di7 s SER 5 Cb 0.00 0.15 -0.06 0.00 0.21 0.00 0.00 66.02 66.31 2di7 s SER 5 CO 0.00 -0.18 0.11 -0.44 0.41 0.00 0.00 173.24 173.14 2di7 s SER 6 N 1.51 4.18 0.00 2.44 0.01 -1.26 -5.10 113.70 115.48 2di7 s SER 6 Ca -0.05 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.00 2di7 s SER 6 Cb -0.12 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.67 2di7 s SER 6 CO -0.05 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 173.70 2di7 n GLY 7 N -1.12 -0.94 2.68 3.44 0.00 -1.26 -5.11 105.19 102.88 2di7 n GLY 7 Ca -0.03 0.66 -0.28 0.00 0.00 0.00 0.00 46.02 46.37 2di7 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2di7 s GLU 8 N 0.00 1.64 0.18 1.61 2.02 -1.26 -5.10 118.70 117.80 2di7 s GLU 8 Ca 0.00 -2.60 -0.31 0.00 0.02 0.00 0.00 54.97 52.08 2di7 s GLU 8 Cb 0.00 -2.47 -0.10 0.00 0.10 0.00 0.00 34.13 31.66 2di7 s GLU 8 CO 0.00 -1.29 1.50 0.99 0.02 0.00 0.00 175.26 176.48 2di7 s THR 9 N -0.49 2.75 -0.76 3.63 2.01 -1.26 -4.94 115.64 116.57 2di7 s THR 9 Ca 0.26 0.56 -0.23 0.00 0.31 0.00 0.00 61.69 62.59 2di7 s THR 9 Cb -0.07 -3.36 0.06 0.00 0.01 0.00 0.00 72.50 69.15 2di7 s THR 9 CO -0.14 0.06 1.14 -0.83 -0.69 0.00 0.00 174.62 174.16 2di7 s GLY 10 N 0.89 1.28 0.00 4.40 0.00 -1.26 -4.22 107.32 108.41 2di7 s GLY 10 Ca 0.66 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.51 2di7 s GLY 10 CO 0.35 2.31 0.00 0.61 0.00 0.00 0.00 173.10 176.37 2di7 n GLY 11 N 5.55 0.07 3.84 0.20 0.00 -1.26 -5.14 105.19 108.45 2di7 n GLY 11 Ca 0.06 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 2di7 n GLY 11 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2di7 s GLU 12 N 0.00 2.57 0.91 1.61 -1.05 -1.26 -5.06 118.70 116.43 2di7 s GLU 12 Ca 0.00 0.60 -0.13 0.00 -0.15 0.00 0.00 54.97 55.29 2di7 s GLU 12 Cb 0.00 -1.98 0.14 0.00 -0.44 0.00 0.00 34.13 31.86 2di7 s GLU 12 CO 0.00 -1.27 1.18 1.03 0.95 0.00 0.00 175.26 177.15 2di7 s ARG 13 N -5.23 1.10 -0.28 -4.83 3.00 -1.26 -4.94 118.95 106.51 2di7 s ARG 13 Ca 0.59 0.10 0.01 0.00 0.00 0.00 0.00 55.73 56.43 2di7 s ARG 13 Cb -0.13 -1.85 0.06 0.00 0.00 0.00 0.00 34.95 33.03 2di7 s ARG 13 CO 0.53 -2.19 -0.05 -0.65 0.00 0.00 0.00 175.30 172.95 2di7 s GLN 14 N -5.47 2.28 0.13 3.54 -0.21 -1.26 -5.05 119.66 113.62 2di7 s GLN 14 Ca 0.65 -1.35 -0.31 0.00 0.02 0.00 0.00 55.36 54.38 2di7 s GLN 14 Cb -0.12 -3.04 -0.10 0.00 1.00 0.00 0.00 33.01 30.75 2di7 s GLN 14 CO 0.52 -0.62 1.78 -1.17 -2.12 0.00 0.00 175.29 173.68 2di7 s LEU 15 N 1.16 4.39 -0.20 2.90 2.96 -1.26 -2.94 118.68 125.68 2di7 s LEU 15 Ca -0.06 2.72 -0.02 0.00 -0.22 0.00 0.00 54.13 56.55 2di7 s LEU 15 Cb -0.20 -3.57 -0.00 0.00 0.50 0.00 0.00 46.19 42.92 2di7 s LEU 15 CO -0.03 -0.97 -0.09 -0.55 -1.32 0.00 0.00 176.35 173.39 2di7 s SER 16 N 2.41 4.04 -0.02 3.68 0.15 0.80 -4.85 113.70 119.92 2di7 s SER 16 Ca 0.79 -0.43 -0.26 0.00 0.70 0.00 0.00 55.95 56.75 2di7 s SER 16 Cb -0.45 -1.67 -0.20 0.00 -1.71 0.00 0.00 66.02 61.98 2di7 s SER 16 CO 0.35 0.01 1.27 1.55 1.20 0.00 0.00 173.24 177.62 2di7 h PRO 17 N 7.86 0.02 -0.77 5.44 0.13 -1.86 -2.90 132.00 139.91 2di7 h PRO 17 Ca -0.40 -0.01 0.16 0.00 -0.87 0.00 0.00 66.00 64.88 2di7 h PRO 17 Cb 1.16 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.19 2di7 h PRO 17 CO 0.60 0.50 0.29 1.05 -0.23 0.00 0.00 178.00 180.21 2di7 h GLU 18 N -0.47 0.39 -0.40 0.86 4.11 -1.68 -0.71 114.58 116.68 2di7 h GLU 18 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.40 2di7 h GLU 18 Cb 0.50 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2di7 h GLU 18 CO 0.00 0.26 0.21 0.87 0.07 0.00 0.00 179.01 180.41 2di7 h LYS 19 N 0.40 0.56 -5.46 1.06 1.79 -1.80 -3.45 116.57 109.67 2di7 h LYS 19 Ca 0.44 -0.07 -0.53 0.00 -2.18 0.00 0.00 60.65 58.30 2di7 h LYS 19 Cb 0.71 -0.11 0.18 0.00 -1.58 0.00 0.00 32.23 31.43 2di7 h LYS 19 CO -0.45 0.47 -1.21 0.43 -1.08 0.00 0.00 179.45 177.62 2di7 n SER 20 N -4.72 -3.85 -4.21 0.86 7.64 -0.27 -4.87 113.62 104.20 2di7 n SER 20 Ca 0.00 0.49 -0.32 0.00 1.01 0.00 0.00 58.87 60.06 2di7 n SER 20 Cb 0.09 -0.75 -0.17 0.00 -1.01 0.00 0.00 64.21 62.37 2di7 n SER 20 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2di7 s GLU 21 N -1.13 3.02 -0.34 1.43 2.02 -1.23 -4.85 118.70 117.62 2di7 s GLU 21 Ca 0.48 -0.87 -0.02 0.00 0.02 0.00 0.00 54.97 54.59 2di7 s GLU 21 Cb -0.38 -2.28 0.08 0.00 0.10 0.00 0.00 34.13 31.64 2di7 s GLU 21 CO 0.64 0.17 0.08 0.42 0.02 0.00 0.00 175.26 176.59 2di7 s ILE 22 N 0.36 3.03 0.30 -1.63 1.01 -1.26 -3.72 121.20 119.29 2di7 s ILE 22 Ca -0.18 -1.73 0.06 0.00 0.00 0.00 0.00 60.65 58.80 2di7 s ILE 22 Cb -0.18 -2.91 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 2di7 s ILE 22 CO 0.08 -0.37 0.41 -1.66 0.00 0.00 0.00 174.94 173.40 2di7 s TRP 23 N 1.18 3.19 0.00 3.97 -2.14 -1.26 -5.06 118.94 118.81 2di7 s TRP 23 Ca 0.01 -0.17 0.00 0.00 2.66 0.00 0.00 56.10 58.61 2di7 s TRP 23 Cb -0.21 -1.82 0.00 0.00 -3.10 0.00 0.00 33.47 28.34 2di7 s TRP 23 CO -0.03 0.17 0.00 0.41 -2.66 0.00 0.00 176.95 174.84 2di7 n GLY 24 N -1.52 4.09 0.00 3.67 0.00 -1.26 -4.11 105.19 106.05 2di7 n GLY 24 Ca -0.03 -1.10 0.06 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.60 0.49 -0.15 1.61 -0.04 -1.26 -3.40 135.00 130.64 2di7 n PRO 25 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2di7 n PRO 25 Cb 0.00 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 2di7 n PRO 25 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2di7 h GLY 26 N 2.56 0.73 -3.32 0.55 0.00 -1.95 -2.91 103.07 98.73 2di7 h GLY 26 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 46.83 2di7 h GLY 26 CO 0.00 0.38 -0.03 1.04 0.00 0.00 0.00 176.54 177.94 2di7 n LEU 27 N -4.59 5.49 -4.55 3.11 4.77 -1.22 -4.84 117.00 115.17 2di7 n LEU 27 Ca 0.01 -2.73 -0.26 0.00 -0.03 0.00 0.00 56.01 53.00 2di7 n LEU 27 Cb 0.16 -1.19 -0.11 0.00 -2.33 0.00 0.00 43.42 39.95 2di7 n LEU 27 CO 0.38 1.21 -0.33 -0.54 -1.33 0.00 0.00 177.39 176.78 2di7 s LYS 28 N -0.04 1.83 0.01 3.23 -0.14 -1.10 -5.07 119.74 118.46 2di7 s LYS 28 Ca 0.20 -2.00 -0.25 0.00 -1.36 0.00 0.00 55.97 52.56 2di7 s LYS 28 Cb 0.11 -1.52 -0.17 0.00 -1.68 0.00 0.00 37.83 34.57 2di7 s LYS 28 CO -0.01 0.01 1.25 0.00 -0.76 0.00 0.00 175.35 175.84 2di7 h ALA 29 N 1.95 -0.34 -2.74 5.17 0.00 -1.88 -3.38 119.26 118.04 2di7 h ALA 29 Ca -0.43 -0.18 -0.76 0.00 0.00 0.00 0.00 54.91 53.54 2di7 h ALA 29 Cb 1.24 0.13 -0.28 0.00 0.00 0.00 0.00 17.79 18.89 2di7 h ALA 29 CO 0.75 -0.52 -0.09 -0.51 0.00 0.00 0.00 179.25 178.88 2di7 s ASP 30 N -5.16 6.28 0.96 0.00 1.11 -1.26 -5.05 116.67 113.56 2di7 s ASP 30 Ca -0.14 -2.48 -0.13 0.00 0.18 0.00 0.00 52.55 49.97 2di7 s ASP 30 Cb 0.02 -2.13 0.20 0.00 1.07 0.00 0.00 42.92 42.08 2di7 s ASP 30 CO 0.56 -0.60 1.19 1.33 1.18 0.00 0.00 175.17 178.84 2di7 n VAL 31 N 4.21 0.00 -1.94 -1.27 0.24 -1.26 -5.02 118.33 113.29 2di7 n VAL 31 Ca 0.06 -0.98 -0.38 0.00 -2.04 0.00 0.00 64.34 61.00 2di7 n VAL 31 Cb 0.43 -1.46 0.03 0.00 -1.47 0.00 0.00 33.84 31.37 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 -3.58 2.42 -0.04 3.34 -7.23 -1.26 -4.98 120.40 109.06 2di7 s VAL 32 Ca 0.69 0.31 -0.11 0.00 -1.81 0.00 0.00 61.98 61.06 2di7 s VAL 32 Cb -0.02 -3.15 -0.06 0.00 0.56 0.00 0.00 36.38 33.70 2di7 s VAL 32 CO 0.48 -0.01 0.49 -0.07 -0.31 0.00 0.00 175.10 175.68 2di7 h LEU 33 N 1.54 -0.34 0.00 1.32 3.38 -2.01 -3.44 115.31 115.76 2di7 h LEU 33 Ca -0.50 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2di7 h LEU 33 Cb 1.29 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.12 2di7 h LEU 33 CO 0.58 0.07 0.00 -0.81 0.09 0.00 0.00 178.44 178.37 2di7 n PRO 34 N -4.83 0.00 -4.51 1.13 -0.04 -1.26 -4.93 135.00 120.56 2di7 n PRO 34 Ca -0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.17 2di7 n PRO 34 Cb 0.16 -0.23 -0.11 0.00 -0.04 0.00 0.00 33.50 33.28 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 2.69 0.11 0.55 0.00 -1.26 -4.69 121.76 116.19 2di7 s ALA 35 Ca 0.00 -2.09 0.08 0.00 0.00 0.00 0.00 51.96 49.95 2di7 s ALA 35 Cb 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2di7 s ALA 35 CO 0.00 -0.11 -0.19 0.50 0.00 0.00 0.00 175.76 175.96 2di7 s ARG 36 N -3.74 1.10 -0.13 0.00 3.52 -1.26 -4.75 118.95 113.70 2di7 s ARG 36 Ca 0.33 -1.20 -0.06 0.00 -0.13 0.00 0.00 55.73 54.67 2di7 s ARG 36 Cb 0.06 -1.24 0.05 0.00 -1.56 0.00 0.00 34.95 32.27 2di7 s ARG 36 CO 0.15 0.27 0.29 1.52 -0.81 0.00 0.00 175.30 176.73 2di7 s TYR 37 N -1.49 -0.42 0.25 5.12 1.13 -1.26 -4.34 117.35 116.34 2di7 s TYR 37 Ca 0.08 0.96 0.03 0.00 -1.41 0.00 0.00 57.07 56.72 2di7 s TYR 37 Cb -0.08 0.10 -0.01 0.00 -1.10 0.00 0.00 41.96 40.86 2di7 s TYR 37 CO 0.04 -0.29 0.10 1.97 -2.51 0.00 0.00 175.55 174.87 2di7 n PHE 38 N 4.45 0.04 -4.98 -3.49 -1.74 -1.26 -4.90 117.46 105.58 2di7 n PHE 38 Ca -0.21 -1.65 -0.30 0.00 -0.56 0.00 0.00 57.45 54.72 2di7 n PHE 38 Cb 0.53 0.01 -0.15 0.00 1.52 0.00 0.00 39.48 41.39 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 -2.54 2.29 -0.30 2.97 2.02 -1.26 -3.02 117.35 117.52 2di7 s TYR 39 Ca 0.14 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.42 2di7 s TYR 39 Cb 0.01 -1.39 0.06 0.00 -0.40 0.00 0.00 41.96 40.23 2di7 s TYR 39 CO 0.10 0.09 -0.01 0.42 -1.57 0.00 0.00 175.55 174.58 2di7 s ILE 40 N -0.76 2.80 -0.13 2.71 1.01 -1.17 -4.17 121.20 121.49 2di7 s ILE 40 Ca 0.11 -1.54 -0.07 0.00 0.00 0.00 0.00 60.65 59.15 2di7 s ILE 40 Cb -0.10 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 2di7 s ILE 40 CO 0.01 -0.16 0.12 -1.58 0.00 0.00 0.00 174.94 173.33 2di7 s GLN 41 N 1.19 3.55 0.30 2.79 2.00 -1.24 -3.38 119.66 124.86 2di7 s GLN 41 Ca -0.04 -0.19 -0.07 0.00 -2.00 0.00 0.00 55.36 53.06 2di7 s GLN 41 Cb -0.20 -3.18 -0.06 0.00 0.80 0.00 0.00 33.01 30.37 2di7 s GLN 41 CO -0.03 0.66 0.59 0.00 -0.50 0.00 0.00 175.29 176.01 2di7 s ALA 42 N -0.69 3.57 0.01 1.58 0.00 -1.26 -3.48 121.76 121.48 2di7 s ALA 42 Ca 0.13 -0.45 -0.09 0.00 0.00 0.00 0.00 51.96 51.55 2di7 s ALA 42 Cb -0.12 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.62 2di7 s ALA 42 CO 0.03 0.25 0.18 0.08 0.00 0.00 0.00 175.76 176.30 2di7 s VAL 43 N -2.08 0.08 0.66 0.00 1.01 -1.25 -3.03 120.40 115.79 2di7 s VAL 43 Ca 0.46 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 2di7 s VAL 43 Cb -0.11 -0.57 0.16 0.00 0.00 0.00 0.00 36.38 35.87 2di7 s VAL 43 CO 0.28 -0.38 0.74 -0.67 0.00 0.00 0.00 175.10 175.08 2di7 n ASP 44 N 1.26 -0.74 0.25 3.32 2.03 -1.07 -0.14 116.55 121.45 2di7 n ASP 44 Ca -0.22 -1.11 0.13 0.00 0.52 0.00 0.00 54.79 54.11 2di7 n ASP 44 Cb 0.56 -0.61 0.55 0.00 -0.72 0.00 0.00 41.12 40.90 2di7 n ASP 44 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2di7 h THR 45 N -1.83 0.33 0.00 5.18 1.35 -1.84 -3.31 112.91 112.79 2di7 h THR 45 Ca -0.26 -0.85 -0.12 0.00 -0.55 0.00 0.00 66.41 64.63 2di7 h THR 45 Cb 0.74 1.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.79 2di7 h THR 45 CO 0.17 0.13 -0.99 -1.20 -0.25 0.00 0.00 175.52 173.38 2di7 n SER 46 N -3.28 1.85 0.00 5.36 7.64 -1.26 -4.97 113.62 118.96 2di7 n SER 46 Ca 0.00 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.39 2di7 n SER 46 Cb 0.37 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 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 1.51 0.00 3.25 0.23 0.00 -1.24 -5.11 105.19 103.83 2di7 n GLY 47 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 0.00 4.93 0.17 1.61 0.01 -1.26 -4.87 114.94 115.53 2di7 s ASN 48 Ca 0.00 -0.98 -0.34 0.00 -0.71 0.00 0.00 52.86 50.83 2di7 s ASN 48 Cb 0.00 -1.79 -0.15 0.00 0.41 0.00 0.00 41.25 39.72 2di7 s ASN 48 CO 0.00 -0.23 1.40 0.29 -1.51 0.00 0.00 177.10 177.06 2di7 n LYS 49 N 4.75 1.72 -0.05 -0.60 4.01 -1.26 -2.60 118.16 124.13 2di7 n LYS 49 Ca -0.14 0.62 -0.13 0.00 -0.51 0.00 0.00 58.31 58.15 2di7 n LYS 49 Cb 0.46 -2.28 -0.07 0.00 -0.51 0.00 0.00 35.03 32.63 2di7 n LYS 49 CO 0.00 0.00 0.00 0.74 -1.11 0.00 0.00 177.40 177.03 2di7 h PHE 50 N 4.70 0.32 -3.07 2.13 -1.00 -1.90 -3.47 116.94 114.65 2di7 h PHE 50 Ca -0.45 -0.08 -0.30 0.00 2.81 0.00 0.00 57.97 59.95 2di7 h PHE 50 Cb 1.29 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 40.74 2di7 h PHE 50 CO 0.59 0.61 -0.36 0.25 -1.61 0.00 0.00 178.31 177.79 2di7 n THR 51 N -4.67 -0.55 -4.57 -1.55 -2.24 -1.26 -4.93 114.28 94.50 2di7 n THR 51 Ca -0.06 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.45 2di7 n THR 51 Cb 0.29 -1.96 -0.08 0.00 -2.10 0.00 0.00 70.33 66.47 2di7 n THR 51 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2di7 s SER 52 N -2.09 3.09 -0.53 3.42 0.01 0.16 -4.30 113.70 113.46 2di7 s SER 52 Ca 0.00 -1.65 -0.16 0.00 1.31 0.00 0.00 55.95 55.45 2di7 s SER 52 Cb 0.00 0.45 0.11 0.00 0.21 0.00 0.00 66.02 66.79 2di7 s SER 52 CO 0.00 -0.88 0.51 -0.55 0.41 0.00 0.00 173.24 172.73 2di7 s SER 53 N -3.66 6.18 0.04 2.44 0.15 -1.23 -3.72 113.70 113.90 2di7 s SER 53 Ca 0.21 -1.61 -0.20 0.00 0.70 0.00 0.00 55.95 55.05 2di7 s SER 53 Cb 0.03 -2.22 -0.14 0.00 -1.71 0.00 0.00 66.02 61.98 2di7 s SER 53 CO 0.12 -0.85 1.35 1.55 1.20 0.00 0.00 173.24 176.62 2di7 h PRO 54 N 8.90 0.38 0.00 5.44 0.13 -1.98 -3.49 132.00 141.38 2di7 h PRO 54 Ca -0.29 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2di7 h PRO 54 Cb 1.10 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2di7 h PRO 54 CO 1.01 0.76 0.00 0.41 -0.23 0.00 0.00 178.00 179.95 2di7 n GLY 55 N 0.18 -1.33 0.09 1.56 0.00 -1.26 -5.04 105.19 99.40 2di7 n GLY 55 Ca -0.06 -0.94 -0.16 0.00 0.00 0.00 0.00 46.02 44.86 2di7 n GLY 55 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2di7 h GLU 56 N 0.00 0.12 -3.18 1.61 4.11 -2.03 -3.42 114.58 111.80 2di7 h GLU 56 Ca 0.00 -0.19 -0.63 0.00 0.07 0.00 0.00 59.36 58.62 2di7 h GLU 56 Cb 0.00 0.07 -0.41 0.00 0.50 0.00 0.00 28.75 28.91 2di7 h GLU 56 CO 0.00 1.05 -0.68 0.15 0.07 0.00 0.00 179.01 179.61 2di7 s LYS 57 N -2.47 1.72 -0.01 1.06 -0.14 -1.26 -4.85 119.74 113.79 2di7 s LYS 57 Ca -0.17 -2.43 0.01 0.00 -1.36 0.00 0.00 55.97 52.03 2di7 s LYS 57 Cb -0.01 -2.89 -0.02 0.00 -1.68 0.00 0.00 37.83 33.22 2di7 s LYS 57 CO 0.74 -1.15 0.02 1.33 -0.76 0.00 0.00 175.35 175.53 2di7 n VAL 58 N 3.17 0.04 -4.03 3.17 0.24 -1.26 -5.00 118.33 114.66 2di7 n VAL 58 Ca 0.08 -0.05 -0.26 0.00 -2.04 0.00 0.00 64.34 62.08 2di7 n VAL 58 Cb 0.34 -0.16 -0.17 0.00 -1.47 0.00 0.00 33.84 32.38 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 -2.07 1.41 0.06 6.34 0.08 -1.26 -4.68 117.98 117.86 2di7 s PHE 59 Ca -0.01 -0.65 0.09 0.00 0.12 0.00 0.00 56.93 56.49 2di7 s PHE 59 Cb 0.01 -1.16 -0.03 0.00 -0.57 0.00 0.00 43.02 41.27 2di7 s PHE 59 CO 0.06 -0.45 -0.26 -1.14 -0.10 0.00 0.00 175.22 173.33 2di7 s GLN 60 N 1.50 1.73 -0.11 0.44 2.00 -1.23 -4.96 119.66 119.03 2di7 s GLN 60 Ca 0.01 -1.16 0.02 0.00 -2.00 0.00 0.00 55.36 52.23 2di7 s GLN 60 Cb -0.13 -1.98 0.01 0.00 0.80 0.00 0.00 33.01 31.71 2di7 s GLN 60 CO -0.06 0.50 -0.18 0.08 -0.50 0.00 0.00 175.29 175.14 2di7 s VAL 61 N -0.88 1.66 0.06 1.34 1.01 -1.26 -3.16 120.40 119.17 2di7 s VAL 61 Ca 0.13 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.43 2di7 s VAL 61 Cb -0.10 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2di7 s VAL 61 CO 0.03 0.47 -0.18 -0.75 0.00 0.00 0.00 175.10 174.67 2di7 s LYS 62 N 0.84 2.00 -0.03 2.72 2.47 0.94 -4.89 119.74 123.79 2di7 s LYS 62 Ca -0.09 -1.03 0.04 0.00 -1.56 0.00 0.00 55.97 53.34 2di7 s LYS 62 Cb -0.15 -2.16 -0.01 0.00 -1.46 0.00 0.00 37.83 34.05 2di7 s LYS 62 CO 0.00 0.53 -0.17 0.08 0.16 0.00 0.00 175.35 175.95 2di7 s VAL 63 N -0.96 1.38 -0.05 4.02 1.01 -1.26 -0.66 120.40 123.88 2di7 s VAL 63 Ca 0.15 -0.70 -0.08 0.00 0.00 0.00 0.00 61.98 61.34 2di7 s VAL 63 Cb -0.10 -1.18 0.02 0.00 0.00 0.00 0.00 36.38 35.12 2di7 s VAL 63 CO 0.06 0.40 0.21 -0.44 0.00 0.00 0.00 175.10 175.33 2di7 s SER 64 N -0.08 -0.15 0.16 3.32 0.01 -1.12 -4.93 113.70 110.91 2di7 s SER 64 Ca -0.01 0.22 -0.21 0.00 1.31 0.00 0.00 55.95 57.26 2di7 s SER 64 Cb -0.10 0.37 -0.08 0.00 0.21 0.00 0.00 66.02 66.42 2di7 s SER 64 CO 0.01 -0.20 0.68 0.00 0.41 0.00 0.00 173.24 174.14 2di7 s ALA 65 N -0.48 3.48 -0.02 1.44 0.00 -1.26 -2.30 121.76 122.62 2di7 s ALA 65 Ca -0.06 0.16 -0.26 0.00 0.00 0.00 0.00 51.96 51.81 2di7 s ALA 65 Cb -0.04 -2.78 -0.20 0.00 0.00 0.00 0.00 23.12 20.10 2di7 s ALA 65 CO 0.01 0.35 1.24 -1.00 0.00 0.00 0.00 175.76 176.36 2di7 h PRO 66 N 3.97 -0.04 0.00 0.00 0.13 -1.93 -3.39 132.00 130.73 2di7 h PRO 66 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2di7 h PRO 66 Cb 1.20 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2di7 h PRO 66 CO 0.65 0.43 -0.18 0.93 -0.23 0.00 0.00 178.00 179.60 2di7 h GLU 67 N -0.53 0.00 -6.70 0.86 5.08 -1.95 -3.47 114.58 107.88 2di7 h GLU 67 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2di7 h GLU 67 Cb 0.49 0.00 0.13 0.00 0.50 0.00 0.00 28.75 29.87 2di7 h GLU 67 CO 0.01 0.00 0.27 -1.91 -1.00 0.00 0.00 179.01 176.38 2di7 n GLU 68 N -4.50 1.54 0.00 2.33 2.13 -1.26 -4.95 120.64 115.93 2di7 n GLU 68 Ca -0.03 0.55 -0.00 0.00 0.66 0.00 0.00 57.16 58.34 2di7 n GLU 68 Cb 0.09 -2.15 -0.00 0.00 0.27 0.00 0.00 31.44 29.66 2di7 n GLU 68 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2di7 h GLN 69 N 1.74 -0.01 -6.20 5.31 4.20 -1.90 -3.41 115.11 114.84 2di7 h GLN 69 Ca -0.45 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 57.71 2di7 h GLN 69 Cb 1.32 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 29.02 2di7 h GLN 69 CO 0.58 -0.01 -0.63 -0.59 -0.67 0.00 0.00 178.83 177.51 2di7 s PHE 70 N -2.22 2.73 0.00 2.96 -0.12 -1.26 -4.77 117.98 115.31 2di7 s PHE 70 Ca -0.00 -0.22 0.02 0.00 -0.05 0.00 0.00 56.93 56.68 2di7 s PHE 70 Cb 0.00 -1.23 -0.01 0.00 -0.63 0.00 0.00 43.02 41.15 2di7 s PHE 70 CO 0.00 0.60 -0.06 -0.08 -0.05 0.00 0.00 175.22 175.63 2di7 s THR 71 N -2.31 0.46 -1.03 -4.49 -1.32 -1.26 -4.94 115.64 100.75 2di7 s THR 71 Ca 0.32 -0.40 -0.14 0.00 -1.21 0.00 0.00 61.69 60.26 2di7 s THR 71 Cb -0.06 -0.42 0.19 0.00 -1.51 0.00 0.00 72.50 70.70 2di7 s THR 71 CO 0.20 0.03 1.15 -0.13 -2.21 0.00 0.00 174.62 173.66 2di7 s ARG 72 N -0.40 3.88 -0.03 7.08 3.00 -1.26 -4.99 118.95 126.22 2di7 s ARG 72 Ca -0.00 -2.45 0.04 0.00 0.00 0.00 0.00 55.73 53.32 2di7 s ARG 72 Cb -0.04 -4.79 -0.01 0.00 0.00 0.00 0.00 34.95 30.12 2di7 s ARG 72 CO -0.00 -1.57 -0.16 0.08 0.00 0.00 0.00 175.30 173.65 2di7 s VAL 73 N 1.03 1.31 -0.58 3.52 1.01 -1.26 -4.30 120.40 121.12 2di7 s VAL 73 Ca 0.32 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.68 2di7 s VAL 73 Cb -0.06 -1.12 0.14 0.00 0.00 0.00 0.00 36.38 35.35 2di7 s VAL 73 CO -0.06 0.38 0.35 -0.83 0.00 0.00 0.00 175.10 174.93 2di7 s GLY 74 N -0.07 2.59 0.40 4.51 0.00 -1.18 -4.97 107.32 108.60 2di7 s GLY 74 Ca -0.01 -3.46 -0.24 0.00 0.00 0.00 0.00 44.72 41.02 2di7 s GLY 74 CO 0.01 1.06 1.07 0.14 0.00 0.00 0.00 173.10 175.38 2di7 s VAL 75 N -0.70 3.64 -0.23 1.40 1.01 -1.26 -3.89 120.40 120.37 2di7 s VAL 75 Ca 0.20 1.28 -0.03 0.00 0.00 0.00 0.00 61.98 63.43 2di7 s VAL 75 Cb -0.18 -3.67 0.12 0.00 0.00 0.00 0.00 36.38 32.65 2di7 s VAL 75 CO -0.06 0.03 0.34 -1.58 0.00 0.00 0.00 175.10 173.83 2di7 s GLN 76 N -2.44 0.31 0.10 2.72 0.74 -0.08 -4.98 119.66 116.03 2di7 s GLN 76 Ca 0.57 0.48 -0.25 0.00 0.05 0.00 0.00 55.36 56.22 2di7 s GLN 76 Cb -0.23 -0.61 -0.07 0.00 1.10 0.00 0.00 33.01 33.21 2di7 s GLN 76 CO 0.29 -0.62 0.76 0.14 -0.55 0.00 0.00 175.29 175.31 2di7 s VAL 77 N 2.50 4.58 0.20 1.34 -7.23 -1.26 -3.11 120.40 117.41 2di7 s VAL 77 Ca 0.11 1.65 0.06 0.00 -1.81 0.00 0.00 61.98 61.99 2di7 s VAL 77 Cb -0.15 -4.12 -0.05 0.00 0.56 0.00 0.00 36.38 32.62 2di7 s VAL 77 CO -0.15 0.44 -0.11 -0.76 -0.31 0.00 0.00 175.10 174.21 2di7 s LEU 78 N -0.54 2.51 -0.39 1.32 1.43 -1.11 -5.05 118.68 116.85 2di7 s LEU 78 Ca 0.37 -1.05 -0.15 0.00 -1.03 0.00 0.00 54.13 52.27 2di7 s LEU 78 Cb -0.22 -0.55 0.01 0.00 0.03 0.00 0.00 46.19 45.46 2di7 s LEU 78 CO 0.24 -0.26 0.32 1.51 0.23 0.00 0.00 176.35 178.39 2di7 s ASP 79 N -3.29 6.12 -0.24 2.29 -4.77 -1.26 -3.56 116.67 111.96 2di7 s ASP 79 Ca 0.22 -0.69 -0.15 0.00 -3.30 0.00 0.00 52.55 48.63 2di7 s ASP 79 Cb 0.01 -2.17 -0.10 0.00 -1.09 0.00 0.00 42.92 39.57 2di7 s ASP 79 CO 0.06 -0.41 -0.35 0.54 0.70 0.00 0.00 175.17 175.70 2di7 n ARG 80 N 5.25 0.56 -4.48 2.11 1.74 -1.26 -5.06 116.66 115.52 2di7 n ARG 80 Ca -0.11 0.24 -0.23 0.00 -0.77 0.00 0.00 57.85 56.99 2di7 n ARG 80 Cb 0.48 -1.46 -0.10 0.00 -1.02 0.00 0.00 32.46 30.36 2di7 n ARG 80 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2di7 s LYS 81 N -2.63 1.73 -0.29 5.56 1.02 -1.22 -5.03 119.74 118.89 2di7 s LYS 81 Ca -0.35 -1.99 -0.01 0.00 0.02 0.00 0.00 55.97 53.64 2di7 s LYS 81 Cb 0.11 -0.88 0.21 0.00 -0.52 0.00 0.00 37.83 36.75 2di7 s LYS 81 CO 0.46 -0.24 1.96 -0.25 -0.92 0.00 0.00 175.35 176.36 2di7 n ASP 82 N -0.83 6.09 0.00 2.83 9.92 -1.26 -4.04 116.55 129.26 2di7 n ASP 82 Ca -0.04 -2.99 0.00 0.00 -0.53 0.00 0.00 54.79 51.23 2di7 n ASP 82 Cb 0.66 -1.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.12 2di7 n ASP 82 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2di7 n GLY 83 N 0.36 0.27 3.51 0.44 0.00 -1.24 -0.66 105.19 107.86 2di7 n GLY 83 Ca 0.28 -0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2di7 n GLY 83 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2di7 s SER 84 N -0.99 3.82 0.26 1.61 0.15 -1.26 -4.31 113.70 112.98 2di7 s SER 84 Ca 0.00 -0.95 0.05 0.00 0.70 0.00 0.00 55.95 55.75 2di7 s SER 84 Cb 0.00 -0.43 -0.06 0.00 -1.71 0.00 0.00 66.02 63.83 2di7 s SER 84 CO 0.00 0.02 -0.02 -0.36 1.20 0.00 0.00 173.24 174.08 2di7 s PHE 85 N -2.47 1.78 -0.07 3.44 0.08 -1.22 -3.42 117.98 116.10 2di7 s PHE 85 Ca 0.30 -0.84 0.01 0.00 0.12 0.00 0.00 56.93 56.53 2di7 s PHE 85 Cb -0.05 -1.05 0.02 0.00 -0.57 0.00 0.00 43.02 41.37 2di7 s PHE 85 CO 0.16 0.10 -0.09 -1.50 -0.10 0.00 0.00 175.22 173.78 2di7 s ILE 86 N -3.24 0.95 -0.16 0.64 2.07 -1.23 -3.03 121.20 117.21 2di7 s ILE 86 Ca 0.30 -0.35 -0.05 0.00 -1.41 0.00 0.00 60.65 59.14 2di7 s ILE 86 Cb 0.05 -0.91 -0.04 0.00 0.13 0.00 0.00 42.46 41.70 2di7 s ILE 86 CO 0.11 0.32 0.02 -0.69 -1.91 0.00 0.00 174.94 172.79 2di7 s VAL 87 N 0.92 4.43 -0.05 4.00 1.01 -1.17 -2.76 120.40 126.78 2di7 s VAL 87 Ca -0.10 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2di7 s VAL 87 Cb -0.15 -2.96 0.02 0.00 0.00 0.00 0.00 36.38 33.29 2di7 s VAL 87 CO 0.01 0.49 -0.08 0.00 0.00 0.00 0.00 175.10 175.53 2di7 s ARG 88 N 0.17 1.15 -0.05 2.72 1.70 -1.18 -4.03 118.95 119.42 2di7 s ARG 88 Ca 0.02 -0.23 -0.10 0.00 -0.47 0.00 0.00 55.73 54.95 2di7 s ARG 88 Cb -0.13 -1.04 0.02 0.00 -0.57 0.00 0.00 34.95 33.23 2di7 s ARG 88 CO 0.01 -0.02 0.24 1.52 -1.08 0.00 0.00 175.30 175.97 2di7 s TYR 89 N 0.75 -0.18 -0.12 5.89 -0.85 -1.26 -0.90 117.35 120.68 2di7 s TYR 89 Ca -0.12 0.40 0.02 0.00 -0.52 0.00 0.00 57.07 56.84 2di7 s TYR 89 Cb -0.15 0.06 -0.01 0.00 0.38 0.00 0.00 41.96 42.25 2di7 s TYR 89 CO 0.02 -0.23 -0.18 -0.98 -1.52 0.00 0.00 175.55 172.65 2di7 s ARG 90 N -0.57 3.23 -0.16 -3.49 1.70 -1.25 -4.44 118.95 113.96 2di7 s ARG 90 Ca -0.07 -0.77 -0.06 0.00 -0.47 0.00 0.00 55.73 54.35 2di7 s ARG 90 Cb -0.04 -2.49 -0.07 0.00 -0.57 0.00 0.00 34.95 31.78 2di7 s ARG 90 CO 0.02 0.18 -0.19 -0.12 -1.08 0.00 0.00 175.30 174.10 2di7 n MET 91 N 3.58 0.34 -3.67 3.89 1.56 -1.26 -3.12 117.12 118.45 2di7 n MET 91 Ca -0.19 0.14 -0.24 0.00 -0.27 0.00 0.00 57.70 57.14 2di7 n MET 91 Cb 0.53 -1.10 0.06 0.00 2.15 0.00 0.00 33.22 34.86 2di7 n MET 91 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 2di7 n TYR 92 N -3.58 -2.45 -3.67 1.12 4.01 -1.26 -4.83 117.16 106.49 2di7 n TYR 92 Ca -0.30 0.95 -0.10 0.00 -0.16 0.00 0.00 57.90 58.28 2di7 n TYR 92 Cb 0.73 -4.67 -0.11 0.00 -0.31 0.00 0.00 39.34 34.98 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 -3.38 -0.96 -0.22 -0.72 0.00 -1.26 -5.11 121.76 110.11 2di7 s ALA 93 Ca 0.40 1.35 -0.33 0.00 0.00 0.00 0.00 51.96 53.38 2di7 s ALA 93 Cb -0.19 -1.12 -0.10 0.00 0.00 0.00 0.00 23.12 21.71 2di7 s ALA 93 CO 0.77 -0.58 2.09 0.45 0.00 0.00 0.00 175.76 178.48 2di7 n SER 94 N 5.06 2.89 -4.26 0.00 2.88 -1.26 -4.95 113.62 113.98 2di7 n SER 94 Ca -0.12 0.56 -0.26 0.00 -1.33 0.00 0.00 58.87 57.72 2di7 n SER 94 Cb 0.51 -1.38 -0.14 0.00 -0.75 0.00 0.00 64.21 62.45 2di7 n SER 94 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2di7 s TYR 95 N 6.42 1.84 -0.25 0.66 -0.85 -1.26 -5.05 117.35 118.87 2di7 s TYR 95 Ca 1.01 -0.38 -0.13 0.00 -0.52 0.00 0.00 57.07 57.05 2di7 s TYR 95 Cb -0.67 -1.09 -0.16 0.00 0.38 0.00 0.00 41.96 40.42 2di7 s TYR 95 CO 0.47 0.10 -0.13 1.63 -1.52 0.00 0.00 175.55 176.10 2di7 n LYS 96 N 1.79 0.60 -4.41 -3.49 4.01 -1.26 -4.96 118.16 110.45 2di7 n LYS 96 Ca -0.17 0.33 -0.23 0.00 -0.51 0.00 0.00 58.31 57.73 2di7 n LYS 96 Cb 0.53 -1.58 -0.16 0.00 -0.51 0.00 0.00 35.03 33.31 2di7 n LYS 96 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2di7 s ASN 97 N -7.16 1.45 0.27 4.39 3.84 -1.26 -5.01 114.94 111.46 2di7 s ASN 97 Ca -0.34 -0.23 0.10 0.00 0.21 0.00 0.00 52.86 52.59 2di7 s ASN 97 Cb 0.11 -0.68 -0.05 0.00 -0.55 0.00 0.00 41.25 40.08 2di7 s ASN 97 CO 0.55 -0.00 -0.15 -0.76 -2.79 0.00 0.00 177.10 173.95 2di7 s LEU 98 N 0.78 2.59 -0.04 3.21 1.43 -1.26 -4.24 118.68 121.14 2di7 s LEU 98 Ca -0.13 -1.07 0.04 0.00 -1.03 0.00 0.00 54.13 51.93 2di7 s LEU 98 Cb -0.15 -0.90 -0.00 0.00 0.03 0.00 0.00 46.19 45.17 2di7 s LEU 98 CO 0.02 -0.11 -0.15 -0.75 0.23 0.00 0.00 176.35 175.59 2di7 s LYS 99 N -3.59 1.61 0.03 1.70 2.20 -0.97 -4.07 119.74 116.65 2di7 s LYS 99 Ca 0.28 -0.54 -0.01 0.00 -0.36 0.00 0.00 55.97 55.35 2di7 s LYS 99 Cb -0.01 -1.41 -0.04 0.00 -1.51 0.00 0.00 37.83 34.85 2di7 s LYS 99 CO 0.12 0.20 0.19 0.08 -0.36 0.00 0.00 175.35 175.59 2di7 s VAL 100 N 0.10 5.37 -0.06 4.02 1.01 -1.20 -2.79 120.40 126.87 2di7 s VAL 100 Ca -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 2di7 s VAL 100 Cb -0.11 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.73 2di7 s VAL 100 CO 0.02 0.21 0.12 -1.61 0.00 0.00 0.00 175.10 173.84 2di7 s GLU 101 N -2.29 0.03 -0.27 2.72 2.02 0.17 -2.31 118.70 118.77 2di7 s GLU 101 Ca 0.32 0.38 -0.02 0.00 0.02 0.00 0.00 54.97 55.67 2di7 s GLU 101 Cb -0.13 -0.25 0.09 0.00 0.10 0.00 0.00 34.13 33.94 2di7 s GLU 101 CO 0.24 -0.22 0.09 0.42 0.02 0.00 0.00 175.26 175.82 2di7 s ILE 102 N 1.53 0.51 0.25 -1.63 1.09 -1.26 -0.04 121.20 121.64 2di7 s ILE 102 Ca -0.05 -1.00 0.11 0.00 -1.10 0.00 0.00 60.65 58.61 2di7 s ILE 102 Cb -0.12 -1.30 -0.05 0.00 -1.06 0.00 0.00 42.46 39.93 2di7 s ILE 102 CO -0.05 -0.57 -0.12 -0.54 -0.10 0.00 0.00 174.94 173.56 2di7 s LYS 103 N 1.82 1.94 -0.19 2.79 1.02 -1.19 -2.46 119.74 123.46 2di7 s LYS 103 Ca 0.07 -1.55 -0.05 0.00 0.02 0.00 0.00 55.97 54.46 2di7 s LYS 103 Cb -0.17 -1.97 0.07 0.00 -0.52 0.00 0.00 37.83 35.24 2di7 s LYS 103 CO -0.24 0.36 0.09 0.12 -0.92 0.00 0.00 175.35 174.76 2di7 s PHE 104 N -2.25 0.35 -0.71 3.18 5.36 0.18 -3.48 117.98 120.60 2di7 s PHE 104 Ca 0.29 -0.48 -0.01 0.00 -0.96 0.00 0.00 56.93 55.78 2di7 s PHE 104 Cb -0.06 -0.78 0.01 0.00 -0.34 0.00 0.00 43.02 41.84 2di7 s PHE 104 CO 0.16 -0.57 0.03 1.04 -1.46 0.00 0.00 175.22 174.42 2di7 n GLN 105 N 5.24 -2.53 -0.88 10.12 1.13 -1.26 -0.33 117.38 128.86 2di7 n GLN 105 Ca -0.07 0.39 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2di7 n GLN 105 Cb 0.48 -4.96 0.00 0.00 0.11 0.00 0.00 30.24 25.87 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 -0.72 1.21 3.15 1.08 0.00 -1.26 -5.09 105.19 103.57 2di7 n GLY 106 Ca -0.09 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.14 0.27 0.63 1.61 -0.21 0.56 -5.15 119.66 115.23 2di7 s GLN 107 Ca 0.00 0.89 -0.18 0.00 0.02 0.00 0.00 55.36 56.10 2di7 s GLN 107 Cb 0.00 0.13 -0.02 0.00 1.00 0.00 0.00 33.01 34.12 2di7 s GLN 107 CO 0.00 -0.31 1.22 -1.01 -2.12 0.00 0.00 175.29 173.07 2di7 s HIS 108 N 2.55 2.29 -0.16 0.91 3.76 -1.26 0.47 115.29 123.84 2di7 s HIS 108 Ca 0.01 1.52 0.07 0.00 -0.15 0.00 0.00 55.06 56.51 2di7 s HIS 108 Cb -0.12 -3.51 -0.15 0.00 1.11 0.00 0.00 32.58 29.91 2di7 s HIS 108 CO -0.12 -2.39 -0.07 0.28 -0.85 0.00 0.00 174.74 171.60 2di7 n VAL 109 N -1.86 1.02 -4.28 -0.90 0.31 -1.03 -3.92 118.33 107.67 2di7 n VAL 109 Ca 0.14 -0.49 -0.12 0.00 -0.01 0.00 0.00 64.34 63.85 2di7 n VAL 109 Cb 0.50 -0.91 -0.03 0.00 -0.91 0.00 0.00 33.84 32.49 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 -2.81 0.18 0.07 3.52 0.00 -1.26 -3.85 120.51 116.36 2di7 n ALA 110 Ca -0.28 -0.88 0.04 0.00 0.00 0.00 0.00 53.44 52.32 2di7 n ALA 110 Cb 0.90 0.50 0.21 0.00 0.00 0.00 0.00 19.45 21.05 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 -0.47 0.05 -0.77 0.00 4.76 -1.26 -4.79 118.16 115.69 2di7 n LYS 111 Ca -0.07 0.49 -0.25 0.00 -2.87 0.00 0.00 58.31 55.61 2di7 n LYS 111 Cb 0.25 -1.78 -0.01 0.00 -1.84 0.00 0.00 35.03 31.65 2di7 n LYS 111 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2di7 n SER 112 N -1.73 -1.40 -4.77 4.39 2.88 -1.26 -4.60 113.62 107.12 2di7 n SER 112 Ca -0.01 0.52 -0.35 0.00 -1.33 0.00 0.00 58.87 57.71 2di7 n SER 112 Cb 0.13 -0.52 0.01 0.00 -0.75 0.00 0.00 64.21 63.08 2di7 n SER 112 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2di7 s PRO 113 N -0.58 3.31 -0.30 -1.46 0.04 -1.26 -4.98 135.00 129.76 2di7 s PRO 113 Ca 0.35 1.59 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 2di7 s PRO 113 Cb -0.41 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.10 2di7 s PRO 113 CO 0.35 -0.88 0.18 0.71 0.04 0.00 0.00 177.00 177.40 2di7 s TYR 114 N -1.83 3.19 -0.32 0.56 2.02 -0.98 -4.99 117.35 115.00 2di7 s TYR 114 Ca 0.72 -0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 57.06 2di7 s TYR 114 Cb -0.23 -2.38 -0.01 0.00 -0.40 0.00 0.00 41.96 38.93 2di7 s TYR 114 CO 0.28 -0.33 0.19 0.42 -1.57 0.00 0.00 175.55 174.54 2di7 s ILE 115 N 1.69 4.93 -0.24 2.71 -1.09 -1.26 -3.24 121.20 124.69 2di7 s ILE 115 Ca 0.06 -0.29 0.02 0.00 -2.23 0.00 0.00 60.65 58.20 2di7 s ILE 115 Cb -0.17 -3.51 0.06 0.00 -1.58 0.00 0.00 42.46 37.26 2di7 s ILE 115 CO 0.08 0.05 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.00 2di7 s LEU 116 N 1.67 2.94 0.00 2.97 1.02 -1.26 -5.10 118.68 120.92 2di7 s LEU 116 Ca 0.05 -1.27 0.06 0.00 0.02 0.00 0.00 54.13 53.00 2di7 s LEU 116 Cb -0.17 -1.34 -0.02 0.00 0.02 0.00 0.00 46.19 44.67 2di7 s LEU 116 CO 0.08 -0.21 0.30 2.29 0.02 0.00 0.00 176.35 178.83 2di7 n LYS 117 N 4.57 0.43 0.00 1.70 2.85 -1.26 -4.29 118.16 122.16 2di7 n LYS 117 Ca -0.13 -3.18 0.00 0.00 -1.05 0.00 0.00 58.31 53.95 2di7 n LYS 117 Cb 0.43 2.66 0.00 0.00 -0.65 0.00 0.00 35.03 37.47 2di7 n LYS 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2di7 n GLY 118 N -0.61 1.93 2.56 2.58 0.00 -1.26 -5.05 105.19 105.34 2di7 n GLY 118 Ca 0.07 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 2di7 n GLY 118 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2di7 n SER 119 N 0.00 4.11 0.00 1.61 3.41 -1.26 -5.05 113.62 116.44 2di7 n SER 119 Ca 0.00 -3.55 0.00 0.00 -0.26 0.00 0.00 58.87 55.06 2di7 n SER 119 Cb 0.00 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2di7 n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2di7 n GLY 120 N -0.37 3.33 3.74 5.00 0.00 -1.26 -5.06 105.19 110.57 2di7 n GLY 120 Ca 0.33 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.27 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 -4.36 4.40 -0.14 1.61 0.04 -1.26 -5.03 135.00 130.26 2di7 s PRO 121 Ca 0.00 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.93 2di7 s PRO 121 Cb 0.00 -3.19 0.04 0.00 0.04 0.00 0.00 34.50 31.39 2di7 s PRO 121 CO 0.00 -0.22 0.43 -1.54 0.04 0.00 0.00 177.00 175.71 2di7 s SER 122 N 0.23 -0.43 -0.01 6.66 1.04 -1.26 -5.17 113.70 114.76 2di7 s SER 122 Ca 0.55 0.79 -0.18 0.00 0.48 0.00 0.00 55.95 57.59 2di7 s SER 122 Cb -0.36 0.82 0.03 0.00 0.10 0.00 0.00 66.02 66.61 2di7 s SER 122 CO 0.39 -0.19 0.39 -0.55 0.98 0.00 0.00 173.24 174.26 2di7 s SER 123 N 0.03 -0.28 0.00 7.02 0.15 -1.26 -5.23 113.70 114.13 2di7 s SER 123 Ca -0.02 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2di7 s SER 123 Cb -0.03 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 2di7 s SER 123 CO 0.01 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.55