#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2di7 n SER 2 N 0.00 0.37 -4.92 1.61 2.88 -1.26 -5.10 113.62 107.21 2di7 n SER 2 Ca 0.00 0.26 -0.30 0.00 -1.33 0.00 0.00 58.87 57.50 2di7 n SER 2 Cb 0.00 0.04 -0.04 0.00 -0.75 0.00 0.00 64.21 63.46 2di7 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2di7 s SER 3 N -5.40 6.39 -0.30 -3.46 0.15 -1.26 -5.10 113.70 104.73 2di7 s SER 3 Ca 0.00 0.35 -0.23 0.00 0.70 0.00 0.00 55.95 56.77 2di7 s SER 3 Cb 0.00 -1.99 0.18 0.00 -1.71 0.00 0.00 66.02 62.50 2di7 s SER 3 CO 0.00 0.11 1.34 -0.83 1.20 0.00 0.00 173.24 175.06 2di7 s GLY 4 N -2.63 0.34 -0.19 9.45 0.00 -1.26 -5.07 107.32 107.96 2di7 s GLY 4 Ca 0.37 3.48 -0.19 0.00 0.00 0.00 0.00 44.72 48.38 2di7 s GLY 4 CO 0.27 2.12 0.15 0.23 0.00 0.00 0.00 173.10 175.88 2di7 h SER 5 N 3.78 0.00 -5.99 1.64 0.87 -2.04 -3.49 113.55 108.32 2di7 h SER 5 Ca -0.27 -0.41 -0.42 0.00 -1.23 0.00 0.00 61.79 59.46 2di7 h SER 5 Cb 1.19 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 63.23 2di7 h SER 5 CO 0.18 1.28 -0.72 -1.20 -0.53 0.00 0.00 176.83 175.84 2di7 n SER 6 N -4.49 -5.08 -2.47 6.23 7.64 -1.26 -3.34 113.62 110.84 2di7 n SER 6 Ca -0.25 -0.64 -0.05 0.00 1.01 0.00 0.00 58.87 58.95 2di7 n SER 6 Cb 0.56 -4.62 0.02 0.00 -1.01 0.00 0.00 64.21 59.16 2di7 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di7 n GLY 7 N -1.79 -0.57 0.26 0.23 0.00 -1.26 -4.92 105.19 97.13 2di7 n GLY 7 Ca -0.03 0.21 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 2di7 n GLY 7 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2di7 h GLU 8 N -0.19 -0.05 -6.53 1.61 4.11 -1.96 -3.34 114.58 108.23 2di7 h GLU 8 Ca -0.18 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.70 2di7 h GLU 8 Cb 1.09 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.28 2di7 h GLU 8 CO 0.22 -0.03 1.00 0.95 0.07 0.00 0.00 179.01 181.22 2di7 s THR 9 N -6.18 3.95 0.00 -1.06 -4.23 -1.26 -4.79 115.64 102.06 2di7 s THR 9 Ca -0.14 0.80 0.00 0.00 -1.18 0.00 0.00 61.69 61.16 2di7 s THR 9 Cb 0.18 -4.76 0.00 0.00 1.34 0.00 0.00 72.50 69.26 2di7 s THR 9 CO 0.72 -1.45 0.00 0.61 -0.54 0.00 0.00 174.62 173.97 2di7 n GLY 10 N 5.13 1.50 0.00 3.99 0.00 -1.26 -5.16 105.19 109.40 2di7 n GLY 10 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2di7 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2di7 n GLY 11 N 0.28 -1.54 3.31 -0.02 0.00 -1.26 -5.15 105.19 100.82 2di7 n GLY 11 Ca 0.00 0.65 -0.30 0.00 0.00 0.00 0.00 46.02 46.37 2di7 n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2di7 n GLU 12 N 0.00 -2.23 -0.97 1.61 1.02 -1.26 -4.88 120.64 113.92 2di7 n GLU 12 Ca 0.00 -0.63 -0.36 0.00 -0.02 0.00 0.00 57.16 56.14 2di7 n GLU 12 Cb 0.00 -1.84 0.05 0.00 -0.02 0.00 0.00 31.44 29.63 2di7 n GLU 12 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2di7 n ARG 13 N -3.25 -0.07 -3.65 3.49 1.85 -1.26 -4.97 116.66 108.80 2di7 n ARG 13 Ca 0.02 -0.02 -0.29 0.00 -1.00 0.00 0.00 57.85 56.56 2di7 n ARG 13 Cb 0.58 -1.08 -0.13 0.00 -1.05 0.00 0.00 32.46 30.77 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 -2.16 0.88 0.00 2.89 -0.21 -1.26 -5.11 119.66 114.70 2di7 s GLN 14 Ca 0.41 -1.49 -0.30 0.00 0.02 0.00 0.00 55.36 53.99 2di7 s GLN 14 Cb -0.10 -1.92 -0.06 0.00 1.00 0.00 0.00 33.01 31.92 2di7 s GLN 14 CO 0.77 -1.12 1.55 -1.17 -2.12 0.00 0.00 175.29 173.20 2di7 s LEU 15 N 0.98 4.33 -0.17 2.90 2.96 -1.26 -2.09 118.68 126.33 2di7 s LEU 15 Ca 0.15 2.26 -0.01 0.00 -0.22 0.00 0.00 54.13 56.31 2di7 s LEU 15 Cb -0.22 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 42.91 2di7 s LEU 15 CO -0.09 -0.83 -0.11 -0.55 -1.32 0.00 0.00 176.35 173.45 2di7 s SER 16 N 2.45 4.01 0.42 3.68 0.15 -0.04 -4.87 113.70 119.50 2di7 s SER 16 Ca 0.70 -0.39 0.21 0.00 0.70 0.00 0.00 55.95 57.17 2di7 s SER 16 Cb -0.34 -1.64 0.92 0.00 -1.71 0.00 0.00 66.02 63.24 2di7 s SER 16 CO 0.29 0.07 1.84 1.55 1.20 0.00 0.00 173.24 178.20 2di7 h PRO 17 N 7.40 0.00 0.00 5.44 0.13 -1.87 -2.40 132.00 140.71 2di7 h PRO 17 Ca -0.34 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.61 2di7 h PRO 17 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2di7 h PRO 17 CO 0.59 0.28 -0.85 1.49 -0.23 0.00 0.00 178.00 179.28 2di7 h GLU 18 N 0.00 0.03 0.15 0.86 4.57 -1.75 -3.29 114.58 115.15 2di7 h GLU 18 Ca -0.00 -0.03 -0.28 0.00 -1.18 0.00 0.00 59.36 57.87 2di7 h GLU 18 Cb 0.70 0.01 0.03 0.00 -0.16 0.00 0.00 28.75 29.33 2di7 h GLU 18 CO 0.04 0.86 -1.18 0.87 -1.18 0.00 0.00 179.01 178.41 2di7 h LYS 19 N 0.01 0.54 -6.02 1.92 1.79 -1.78 -3.47 116.57 109.56 2di7 h LYS 19 Ca -0.01 -0.78 -0.63 0.00 -2.18 0.00 0.00 60.65 57.05 2di7 h LYS 19 Cb 1.49 0.27 0.15 0.00 -1.58 0.00 0.00 32.23 32.56 2di7 h LYS 19 CO 0.11 1.35 -0.81 0.43 -1.08 0.00 0.00 179.45 179.45 2di7 n SER 20 N -3.87 -2.36 -4.20 0.86 7.64 -0.92 -4.83 113.62 105.94 2di7 n SER 20 Ca -0.14 0.89 -0.34 0.00 1.01 0.00 0.00 58.87 60.29 2di7 n SER 20 Cb 0.96 -0.92 -0.15 0.00 -1.01 0.00 0.00 64.21 63.10 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 -1.04 3.14 -0.57 1.43 2.02 -1.24 -4.86 118.70 117.58 2di7 s GLU 21 Ca 0.61 -0.75 -0.13 0.00 0.02 0.00 0.00 54.97 54.71 2di7 s GLU 21 Cb -0.70 -2.78 0.14 0.00 0.10 0.00 0.00 34.13 30.89 2di7 s GLU 21 CO 0.61 -0.22 0.49 0.42 0.02 0.00 0.00 175.26 176.58 2di7 s ILE 22 N 1.37 4.89 0.35 -1.63 1.01 -1.26 -3.68 121.20 122.25 2di7 s ILE 22 Ca 0.05 -1.81 0.07 0.00 0.00 0.00 0.00 60.65 58.96 2di7 s ILE 22 Cb -0.14 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 38.18 2di7 s ILE 22 CO -0.08 -0.87 0.45 -1.66 0.00 0.00 0.00 174.94 172.78 2di7 s TRP 23 N 1.22 3.02 0.00 3.97 -2.14 -1.25 -5.00 118.94 118.75 2di7 s TRP 23 Ca 0.07 -0.27 0.00 0.00 2.66 0.00 0.00 56.10 58.56 2di7 s TRP 23 Cb -0.25 -2.03 0.00 0.00 -3.10 0.00 0.00 33.47 28.09 2di7 s TRP 23 CO -0.00 -0.05 0.00 0.41 -2.66 0.00 0.00 176.95 174.65 2di7 n GLY 24 N -1.62 4.79 0.24 3.67 0.00 -1.26 -2.81 105.19 108.18 2di7 n GLY 24 Ca 0.01 -1.12 0.16 0.00 0.00 0.00 0.00 46.02 45.07 2di7 n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di7 h PRO 25 N 0.00 0.00 -1.53 1.61 0.13 -1.95 -3.23 132.00 127.02 2di7 h PRO 25 Ca 0.00 0.00 0.46 0.00 -0.87 0.00 0.00 66.00 65.59 2di7 h PRO 25 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 2di7 h PRO 25 CO 0.00 0.00 1.05 0.78 -0.23 0.00 0.00 178.00 179.60 2di7 h GLY 26 N 2.02 0.62 0.22 1.56 0.00 -1.73 0.22 103.07 105.97 2di7 h GLY 26 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 2di7 h GLY 26 CO 0.00 -0.18 -0.01 1.41 0.00 0.00 0.00 176.54 177.76 2di7 h LEU 27 N 0.05 -0.02 -8.15 3.11 3.38 -1.86 -3.47 115.31 108.35 2di7 h LEU 27 Ca 0.81 -0.71 -0.56 0.00 0.09 0.00 0.00 57.88 57.51 2di7 h LEU 27 Cb 2.92 0.01 0.14 0.00 0.09 0.00 0.00 40.66 43.82 2di7 h LEU 27 CO -0.20 0.73 -0.86 0.29 0.09 0.00 0.00 178.44 178.49 2di7 n LYS 28 N -4.74 0.00 -0.13 1.13 5.02 0.76 -4.86 118.16 115.34 2di7 n LYS 28 Ca -0.09 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.08 2di7 n LYS 28 Cb 0.36 -0.91 -0.02 0.00 -0.02 0.00 0.00 35.03 34.45 2di7 n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2di7 h ALA 29 N 0.29 0.57 -1.04 7.82 0.00 -1.90 -3.36 119.26 121.65 2di7 h ALA 29 Ca -0.33 -0.38 -0.69 0.00 0.00 0.00 0.00 54.91 53.51 2di7 h ALA 29 Cb 1.31 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 2di7 h ALA 29 CO 0.42 0.54 2.01 0.16 0.00 0.00 0.00 179.25 182.37 2di7 s ASP 30 N -6.58 6.87 0.51 0.00 1.47 -1.26 -4.97 116.67 112.71 2di7 s ASP 30 Ca -0.12 -2.51 0.04 0.00 1.18 0.00 0.00 52.55 51.13 2di7 s ASP 30 Cb 0.11 -2.54 0.03 0.00 -0.34 0.00 0.00 42.92 40.17 2di7 s ASP 30 CO 0.85 -1.10 0.71 0.68 0.68 0.00 0.00 175.17 176.98 2di7 s VAL 31 N 3.73 2.76 1.12 2.11 -7.23 -1.26 -5.06 120.40 116.58 2di7 s VAL 31 Ca 0.51 -0.79 -0.15 0.00 -1.81 0.00 0.00 61.98 59.75 2di7 s VAL 31 Cb 0.02 -2.97 0.19 0.00 0.56 0.00 0.00 36.38 34.19 2di7 s VAL 31 CO 0.06 0.00 0.63 1.33 -0.31 0.00 0.00 175.10 176.80 2di7 n VAL 32 N -2.17 0.00 0.18 1.32 0.24 -1.26 -4.92 118.33 111.72 2di7 n VAL 32 Ca 0.08 -0.34 -0.17 0.00 -2.04 0.00 0.00 64.34 61.88 2di7 n VAL 32 Cb 0.59 -0.83 -0.10 0.00 -1.47 0.00 0.00 33.84 32.04 2di7 n VAL 32 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2di7 h LEU 33 N -2.32 -1.47 0.00 1.34 3.38 -2.03 -3.38 115.31 110.82 2di7 h LEU 33 Ca -0.56 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2di7 h LEU 33 Cb 1.33 0.53 0.00 0.00 0.09 0.00 0.00 40.66 42.61 2di7 h LEU 33 CO 0.43 -0.59 0.00 -0.81 0.09 0.00 0.00 178.44 177.56 2di7 n PRO 34 N -5.51 0.00 -3.71 1.13 -0.04 -1.26 -5.01 135.00 120.59 2di7 n PRO 34 Ca -0.10 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.25 2di7 n PRO 34 Cb 0.43 -0.23 -0.10 0.00 -0.04 0.00 0.00 33.50 33.55 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 -2.98 -1.07 -0.20 0.55 0.00 -1.26 -5.01 121.76 111.78 2di7 s ALA 35 Ca 0.00 1.41 -0.08 0.00 0.00 0.00 0.00 51.96 53.29 2di7 s ALA 35 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 2di7 s ALA 35 CO 0.00 -0.24 0.07 0.50 0.00 0.00 0.00 175.76 176.09 2di7 s ARG 36 N 0.87 3.91 0.37 0.00 6.06 -1.26 -4.85 118.95 124.05 2di7 s ARG 36 Ca -0.05 -0.37 0.06 0.00 -2.50 0.00 0.00 55.73 52.87 2di7 s ARG 36 Cb -0.06 -3.27 0.06 0.00 0.06 0.00 0.00 34.95 31.74 2di7 s ARG 36 CO -0.07 0.15 0.50 2.48 -2.50 0.00 0.00 175.30 175.86 2di7 n TYR 37 N 3.93 -2.50 -4.18 5.12 0.18 -1.26 -4.27 117.16 114.18 2di7 n TYR 37 Ca -0.16 -1.34 -0.13 0.00 1.88 0.00 0.00 57.90 58.15 2di7 n TYR 37 Cb 0.52 -0.35 -0.05 0.00 -0.38 0.00 0.00 39.34 39.08 2di7 n TYR 37 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 2di7 n PHE 38 N -1.79 -0.55 -4.47 -3.48 -1.74 -1.26 -3.30 117.46 100.87 2di7 n PHE 38 Ca 0.10 -1.86 -0.23 0.00 -0.56 0.00 0.00 57.45 54.90 2di7 n PHE 38 Cb 0.38 0.20 -0.10 0.00 1.52 0.00 0.00 39.48 41.48 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 -2.92 2.12 -0.06 2.97 1.51 -1.13 -3.25 117.35 116.59 2di7 s TYR 39 Ca 0.26 -0.65 0.01 0.00 -1.01 0.00 0.00 57.07 55.68 2di7 s TYR 39 Cb 0.01 -1.24 0.02 0.00 -0.11 0.00 0.00 41.96 40.65 2di7 s TYR 39 CO 0.19 0.37 -0.06 0.42 -1.11 0.00 0.00 175.55 175.36 2di7 s ILE 40 N -2.89 0.69 0.01 2.71 1.01 -0.86 -3.97 121.20 117.91 2di7 s ILE 40 Ca 0.31 -0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.86 2di7 s ILE 40 Cb 0.04 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 2di7 s ILE 40 CO 0.14 0.27 -0.21 -1.58 0.00 0.00 0.00 174.94 173.56 2di7 s GLN 41 N 1.13 2.09 -0.11 2.79 2.00 -1.24 -2.71 119.66 123.60 2di7 s GLN 41 Ca -0.07 -0.95 -0.17 0.00 -2.00 0.00 0.00 55.36 52.17 2di7 s GLN 41 Cb -0.14 -2.13 -0.05 0.00 0.80 0.00 0.00 33.01 31.49 2di7 s GLN 41 CO -0.01 0.55 0.42 0.00 -0.50 0.00 0.00 175.29 175.76 2di7 s ALA 42 N -0.79 3.54 0.14 1.58 0.00 -1.26 -3.73 121.76 121.24 2di7 s ALA 42 Ca 0.12 -0.25 0.07 0.00 0.00 0.00 0.00 51.96 51.90 2di7 s ALA 42 Cb -0.10 -2.55 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 2di7 s ALA 42 CO 0.02 0.10 -0.15 0.08 0.00 0.00 0.00 175.76 175.81 2di7 s VAL 43 N 0.30 1.48 0.90 0.00 1.01 -1.26 -1.77 120.40 121.06 2di7 s VAL 43 Ca 0.23 -1.79 -0.13 0.00 0.00 0.00 0.00 61.98 60.30 2di7 s VAL 43 Cb -0.15 -1.64 0.18 0.00 0.00 0.00 0.00 36.38 34.77 2di7 s VAL 43 CO 0.09 -0.39 1.24 -0.62 0.00 0.00 0.00 175.10 175.43 2di7 s ASP 44 N -2.54 3.48 0.21 3.32 2.15 -0.56 -0.86 116.67 121.87 2di7 s ASP 44 Ca 0.11 0.19 0.20 0.00 0.43 0.00 0.00 52.55 53.48 2di7 s ASP 44 Cb -0.05 -0.33 0.90 0.00 -0.30 0.00 0.00 42.92 43.13 2di7 s ASP 44 CO 0.04 -2.49 1.61 0.35 -0.17 0.00 0.00 175.17 174.51 2di7 n THR 45 N -3.54 0.99 -0.13 1.71 -2.24 -0.89 -3.13 114.28 107.05 2di7 n THR 45 Ca 0.15 0.37 -0.28 0.00 -2.27 0.00 0.00 64.05 62.01 2di7 n THR 45 Cb 0.60 -1.29 -0.10 0.00 -2.10 0.00 0.00 70.33 67.44 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 -2.08 1.94 0.00 3.42 7.64 -1.26 -4.99 113.62 118.29 2di7 n SER 46 Ca 0.01 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.25 2di7 n SER 46 Cb 0.16 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 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 1.29 0.00 3.83 0.23 0.00 -1.18 -5.12 105.19 104.24 2di7 n GLY 47 Ca -0.49 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 5.80 0.07 1.61 0.01 -1.26 -4.85 114.94 116.32 2di7 s ASN 48 Ca 0.00 0.07 -0.27 0.00 -0.71 0.00 0.00 52.86 51.94 2di7 s ASN 48 Cb 0.00 -1.64 -0.06 0.00 0.41 0.00 0.00 41.25 39.97 2di7 s ASN 48 CO 0.00 0.15 0.85 -0.54 -1.51 0.00 0.00 177.10 176.05 2di7 s LYS 49 N -2.55 4.58 -0.09 -0.60 1.02 -1.26 -1.49 119.74 119.34 2di7 s LYS 49 Ca 0.31 1.23 -0.27 0.00 0.02 0.00 0.00 55.97 57.26 2di7 s LYS 49 Cb -0.12 -3.37 -0.25 0.00 -0.52 0.00 0.00 37.83 33.57 2di7 s LYS 49 CO 0.24 0.24 0.92 0.74 -0.92 0.00 0.00 175.35 176.57 2di7 h PHE 50 N 5.67 0.12 -4.47 3.18 -1.00 -1.72 -3.47 116.94 115.25 2di7 h PHE 50 Ca -0.43 -0.07 -0.26 0.00 2.81 0.00 0.00 57.97 60.01 2di7 h PHE 50 Cb 1.21 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.73 2di7 h PHE 50 CO 0.65 0.95 -0.36 0.25 -1.61 0.00 0.00 178.31 178.18 2di7 n THR 51 N -4.57 -0.68 -4.50 -1.55 -2.24 -1.26 -4.92 114.28 94.57 2di7 n THR 51 Ca -0.10 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 2di7 n THR 51 Cb 0.49 -1.63 -0.09 0.00 -2.10 0.00 0.00 70.33 67.01 2di7 n THR 51 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2di7 s SER 52 N -2.25 2.64 -0.52 3.42 1.04 -1.26 -4.16 113.70 112.61 2di7 s SER 52 Ca 0.13 -1.60 -0.14 0.00 0.48 0.00 0.00 55.95 54.82 2di7 s SER 52 Cb -0.07 0.37 0.12 0.00 0.10 0.00 0.00 66.02 66.54 2di7 s SER 52 CO 0.16 -0.85 0.45 -0.94 0.98 0.00 0.00 173.24 173.04 2di7 s SER 53 N -3.57 6.05 0.41 7.02 1.04 -1.24 -4.16 113.70 119.26 2di7 s SER 53 Ca 0.27 -1.80 0.20 0.00 0.48 0.00 0.00 55.95 55.09 2di7 s SER 53 Cb 0.04 -2.15 0.86 0.00 0.10 0.00 0.00 66.02 64.87 2di7 s SER 53 CO 0.14 -0.80 1.83 1.55 0.98 0.00 0.00 173.24 176.94 2di7 h PRO 54 N 8.76 0.00 0.00 4.02 0.13 -2.00 -3.49 132.00 139.43 2di7 h PRO 54 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2di7 h PRO 54 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2di7 h PRO 54 CO 0.98 0.31 0.00 0.41 -0.23 0.00 0.00 178.00 179.47 2di7 n GLY 55 N -0.09 -1.32 0.00 1.56 0.00 -1.26 -5.02 105.19 99.07 2di7 n GLY 55 Ca -0.01 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -3.83 1.61 -0.58 -1.26 -4.72 120.64 111.86 2di7 n GLU 56 Ca 0.00 0.34 -0.30 0.00 -0.42 0.00 0.00 57.16 56.78 2di7 n GLU 56 Cb 0.00 -1.11 -0.14 0.00 -0.57 0.00 0.00 31.44 29.62 2di7 n GLU 56 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2di7 s LYS 57 N -1.59 1.25 -0.23 3.49 -0.14 -1.26 -4.74 119.74 116.52 2di7 s LYS 57 Ca 0.00 -1.76 0.04 0.00 -1.36 0.00 0.00 55.97 52.89 2di7 s LYS 57 Cb 0.00 -2.58 -0.17 0.00 -1.68 0.00 0.00 37.83 33.40 2di7 s LYS 57 CO 0.00 -1.04 -0.16 1.33 -0.76 0.00 0.00 175.35 174.72 2di7 n VAL 58 N 4.08 1.34 -3.74 3.17 0.24 -1.26 -4.96 118.33 117.19 2di7 n VAL 58 Ca 0.04 -0.56 -0.37 0.00 -2.04 0.00 0.00 64.34 61.41 2di7 n VAL 58 Cb 0.38 -1.19 -0.07 0.00 -1.47 0.00 0.00 33.84 31.50 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 -2.47 3.57 0.27 6.34 0.08 -1.26 -4.60 117.98 119.90 2di7 s PHE 59 Ca -0.28 0.58 0.11 0.00 0.12 0.00 0.00 56.93 57.46 2di7 s PHE 59 Cb 0.08 -2.09 -0.05 0.00 -0.57 0.00 0.00 43.02 40.38 2di7 s PHE 59 CO 0.58 0.57 -0.15 -1.14 -0.10 0.00 0.00 175.22 174.98 2di7 s GLN 60 N -0.57 1.85 0.01 0.44 0.74 -1.15 -4.90 119.66 116.08 2di7 s GLN 60 Ca 0.15 -1.64 0.00 0.00 0.05 0.00 0.00 55.36 53.93 2di7 s GLN 60 Cb -0.13 -1.90 -0.01 0.00 1.10 0.00 0.00 33.01 32.08 2di7 s GLN 60 CO 0.04 0.35 -0.02 0.08 -0.55 0.00 0.00 175.29 175.19 2di7 s VAL 61 N -2.37 0.10 -0.07 1.34 1.01 -1.26 -3.05 120.40 116.09 2di7 s VAL 61 Ca 0.30 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.95 2di7 s VAL 61 Cb -0.06 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.19 2di7 s VAL 61 CO 0.16 -0.16 -0.12 -0.75 0.00 0.00 0.00 175.10 174.23 2di7 s LYS 62 N -0.53 1.72 -0.10 2.72 2.20 0.04 -4.99 119.74 120.81 2di7 s LYS 62 Ca -0.05 -0.41 0.04 0.00 -0.36 0.00 0.00 55.97 55.19 2di7 s LYS 62 Cb -0.04 -1.46 0.00 0.00 -1.51 0.00 0.00 37.83 34.82 2di7 s LYS 62 CO -0.00 -0.01 -0.23 0.08 -0.36 0.00 0.00 175.35 174.82 2di7 s VAL 63 N 0.81 2.00 -0.12 4.02 1.01 -1.26 -1.62 120.40 125.23 2di7 s VAL 63 Ca -0.12 -0.99 -0.21 0.00 0.00 0.00 0.00 61.98 60.67 2di7 s VAL 63 Cb -0.15 -1.73 0.05 0.00 0.00 0.00 0.00 36.38 34.55 2di7 s VAL 63 CO 0.02 0.55 0.52 -0.94 0.00 0.00 0.00 175.10 175.24 2di7 s SER 64 N 0.34 -0.50 -0.10 3.32 1.04 -1.17 -4.84 113.70 111.80 2di7 s SER 64 Ca -0.18 0.77 -0.02 0.00 0.48 0.00 0.00 55.95 56.99 2di7 s SER 64 Cb -0.18 0.78 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 2di7 s SER 64 CO 0.08 -0.34 0.00 0.00 0.98 0.00 0.00 173.24 173.96 2di7 s ALA 65 N -0.43 3.28 0.01 5.32 0.00 -1.26 -1.38 121.76 127.30 2di7 s ALA 65 Ca -0.06 -0.80 -0.23 0.00 0.00 0.00 0.00 51.96 50.88 2di7 s ALA 65 Cb -0.03 -1.51 -0.17 0.00 0.00 0.00 0.00 23.12 21.41 2di7 s ALA 65 CO 0.04 0.54 1.31 -1.00 0.00 0.00 0.00 175.76 176.65 2di7 h PRO 66 N 5.35 0.21 0.00 0.00 0.13 -1.95 -3.35 132.00 132.38 2di7 h PRO 66 Ca -0.49 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2di7 h PRO 66 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2di7 h PRO 66 CO 0.56 0.63 0.00 -1.91 -0.23 0.00 0.00 178.00 177.05 2di7 n GLU 67 N -4.68 0.00 -2.71 0.86 2.13 -1.26 -4.44 120.64 110.53 2di7 n GLU 67 Ca -0.07 0.82 -0.40 0.00 0.66 0.00 0.00 57.16 58.17 2di7 n GLU 67 Cb 0.31 -1.41 -0.06 0.00 0.27 0.00 0.00 31.44 30.56 2di7 n GLU 67 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2di7 s GLU 68 N -2.64 4.81 0.07 5.31 0.41 -1.26 -4.97 118.70 120.43 2di7 s GLU 68 Ca 0.00 1.53 -0.18 0.00 -0.41 0.00 0.00 54.97 55.91 2di7 s GLU 68 Cb 0.00 -3.25 -0.12 0.00 -1.78 0.00 0.00 34.13 28.99 2di7 s GLU 68 CO 0.00 0.46 1.39 -0.56 -0.49 0.00 0.00 175.26 176.06 2di7 h GLN 69 N 4.06 0.50 -5.35 1.61 3.07 -1.82 -3.43 115.11 113.76 2di7 h GLN 69 Ca -0.45 -0.26 -0.63 0.00 0.09 0.00 0.00 58.65 57.40 2di7 h GLN 69 Cb 1.20 0.01 -0.17 0.00 0.08 0.00 0.00 27.48 28.60 2di7 h GLN 69 CO 0.68 0.83 -0.58 -0.59 0.09 0.00 0.00 178.83 179.26 2di7 s PHE 70 N -4.37 3.21 -0.03 0.06 -0.12 -1.26 -4.98 117.98 110.49 2di7 s PHE 70 Ca -0.13 0.02 0.03 0.00 -0.05 0.00 0.00 56.93 56.80 2di7 s PHE 70 Cb 0.07 -2.03 0.00 0.00 -0.63 0.00 0.00 43.02 40.43 2di7 s PHE 70 CO 0.78 0.16 -0.11 0.99 -0.05 0.00 0.00 175.22 177.00 2di7 s THR 71 N 0.22 0.96 -0.30 -4.49 2.01 -1.26 -5.01 115.64 107.76 2di7 s THR 71 Ca 0.03 -0.45 -0.02 0.00 0.31 0.00 0.00 61.69 61.55 2di7 s THR 71 Cb -0.13 -0.84 0.05 0.00 0.01 0.00 0.00 72.50 71.59 2di7 s THR 71 CO 0.01 0.29 0.01 0.00 -0.69 0.00 0.00 174.62 174.24 2di7 s ARG 72 N 0.18 2.49 -0.05 4.92 1.70 -1.26 -5.04 118.95 121.89 2di7 s ARG 72 Ca -0.04 -1.23 -0.00 0.00 -0.47 0.00 0.00 55.73 53.99 2di7 s ARG 72 Cb -0.10 -3.21 0.03 0.00 -0.57 0.00 0.00 34.95 31.10 2di7 s ARG 72 CO 0.01 -0.61 -0.00 0.08 -1.08 0.00 0.00 175.30 173.70 2di7 s VAL 73 N 1.28 0.30 -1.21 4.99 1.01 -1.26 -4.84 120.40 120.67 2di7 s VAL 73 Ca -0.04 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 2di7 s VAL 73 Cb -0.20 -0.41 0.21 0.00 0.00 0.00 0.00 36.38 35.98 2di7 s VAL 73 CO -0.01 0.21 1.61 0.61 0.00 0.00 0.00 175.10 177.52 2di7 n GLY 74 N 4.59 4.40 3.78 4.51 0.00 -1.24 -4.95 105.19 116.28 2di7 n GLY 74 Ca -0.17 -2.23 -0.37 0.00 0.00 0.00 0.00 46.02 43.25 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 -0.03 3.35 -0.16 1.61 1.01 -1.26 -3.64 120.40 121.28 2di7 s VAL 75 Ca 0.38 1.04 -0.08 0.00 0.00 0.00 0.00 61.98 63.31 2di7 s VAL 75 Cb 0.03 -3.54 0.06 0.00 0.00 0.00 0.00 36.38 32.94 2di7 s VAL 75 CO 0.01 0.01 0.38 -1.58 0.00 0.00 0.00 175.10 173.92 2di7 s GLN 76 N -2.57 0.35 -0.47 2.72 0.74 -0.77 -4.98 119.66 114.68 2di7 s GLN 76 Ca 0.60 0.77 -0.09 0.00 0.05 0.00 0.00 55.36 56.70 2di7 s GLN 76 Cb -0.26 -0.01 0.12 0.00 1.10 0.00 0.00 33.01 33.96 2di7 s GLN 76 CO 0.32 -0.17 0.34 0.08 -0.55 0.00 0.00 175.29 175.31 2di7 s VAL 77 N 1.51 4.16 -0.03 1.34 1.01 -1.26 -2.44 120.40 124.69 2di7 s VAL 77 Ca -0.09 -1.81 0.03 0.00 0.00 0.00 0.00 61.98 60.11 2di7 s VAL 77 Cb -0.09 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2di7 s VAL 77 CO -0.12 -0.77 -0.10 -0.22 0.00 0.00 0.00 175.10 173.89 2di7 s LEU 78 N 1.34 3.02 -0.42 3.92 1.98 -1.07 -4.86 118.68 122.59 2di7 s LEU 78 Ca 0.06 -0.14 -0.23 0.00 -2.89 0.00 0.00 54.13 50.94 2di7 s LEU 78 Cb -0.26 -1.68 0.02 0.00 0.66 0.00 0.00 46.19 44.92 2di7 s LEU 78 CO -0.01 0.32 0.77 -0.62 -1.89 0.00 0.00 176.35 174.92 2di7 s ASP 79 N -1.04 6.45 -0.17 3.68 2.15 -1.26 -1.50 116.67 124.97 2di7 s ASP 79 Ca 0.14 0.04 -0.16 0.00 0.43 0.00 0.00 52.55 52.99 2di7 s ASP 79 Cb -0.11 -2.38 -0.06 0.00 -0.30 0.00 0.00 42.92 40.07 2di7 s ASP 79 CO 0.03 -0.83 -0.31 0.54 -0.17 0.00 0.00 175.17 174.43 2di7 n ARG 80 N 6.56 0.51 -0.64 4.34 1.74 -1.19 -5.01 116.66 122.98 2di7 n ARG 80 Ca 0.02 0.28 -0.14 0.00 -0.77 0.00 0.00 57.85 57.23 2di7 n ARG 80 Cb 0.48 -1.49 0.11 0.00 -1.02 0.00 0.00 32.46 30.55 2di7 n ARG 80 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2di7 n LYS 81 N -4.49 -1.58 -0.07 5.56 4.81 -1.21 -4.98 118.16 116.20 2di7 n LYS 81 Ca -0.13 -0.90 -0.14 0.00 -0.87 0.00 0.00 58.31 56.27 2di7 n LYS 81 Cb 0.47 -0.75 -0.06 0.00 0.02 0.00 0.00 35.03 34.71 2di7 n LYS 81 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2di7 h ASP 82 N -1.52 0.68 -1.01 3.14 3.32 -1.94 -3.37 116.42 115.73 2di7 h ASP 82 Ca -0.20 -0.53 -0.38 0.00 0.02 0.00 0.00 57.03 55.93 2di7 h ASP 82 Cb 0.60 -0.20 -0.40 0.00 0.22 0.00 0.00 39.33 39.55 2di7 h ASP 82 CO 0.14 1.08 -1.12 0.61 -1.72 0.00 0.00 179.24 178.23 2di7 n GLY 83 N 0.35 2.26 3.37 2.75 0.00 -1.26 -3.63 105.19 109.03 2di7 n GLY 83 Ca -0.05 -1.50 -0.13 0.00 0.00 0.00 0.00 46.02 44.33 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 -3.26 -0.50 -0.01 1.61 0.01 -1.26 -4.40 113.70 105.89 2di7 s SER 84 Ca 0.30 0.96 0.05 0.00 1.31 0.00 0.00 55.95 58.57 2di7 s SER 84 Cb 0.44 0.96 -0.03 0.00 0.21 0.00 0.00 66.02 67.60 2di7 s SER 84 CO -0.00 -0.17 -0.15 -0.36 0.41 0.00 0.00 173.24 172.97 2di7 s PHE 85 N 0.35 2.66 -0.08 2.43 0.40 -1.10 -3.14 117.98 119.50 2di7 s PHE 85 Ca -0.01 -0.19 -0.00 0.00 -0.60 0.00 0.00 56.93 56.13 2di7 s PHE 85 Cb -0.04 -1.56 -0.03 0.00 0.51 0.00 0.00 43.02 41.91 2di7 s PHE 85 CO -0.01 0.23 -0.05 -1.50 0.70 0.00 0.00 175.22 174.60 2di7 s ILE 86 N -0.84 3.88 -0.34 0.64 1.10 -0.56 -2.02 121.20 123.05 2di7 s ILE 86 Ca 0.14 -0.41 -0.08 0.00 -0.51 0.00 0.00 60.65 59.79 2di7 s ILE 86 Cb -0.11 -2.61 0.03 0.00 0.15 0.00 0.00 42.46 39.92 2di7 s ILE 86 CO 0.03 0.59 0.13 -0.69 -2.11 0.00 0.00 174.94 172.89 2di7 s VAL 87 N -0.66 4.03 -0.04 4.00 1.01 -1.20 -2.58 120.40 124.96 2di7 s VAL 87 Ca 0.10 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.17 2di7 s VAL 87 Cb -0.12 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 2di7 s VAL 87 CO 0.02 -0.14 -0.24 0.00 0.00 0.00 0.00 175.10 174.74 2di7 s ARG 88 N 1.46 2.26 0.08 2.72 1.70 -1.02 -4.26 118.95 121.89 2di7 s ARG 88 Ca 0.00 -0.86 0.02 0.00 -0.47 0.00 0.00 55.73 54.42 2di7 s ARG 88 Cb -0.19 -2.01 -0.04 0.00 -0.57 0.00 0.00 34.95 32.15 2di7 s ARG 88 CO 0.04 0.42 -0.07 1.52 -1.08 0.00 0.00 175.30 176.12 2di7 s TYR 89 N -0.29 0.85 -0.09 5.89 -0.85 -1.26 -1.85 117.35 119.75 2di7 s TYR 89 Ca 0.01 -0.76 0.01 0.00 -0.52 0.00 0.00 57.07 55.81 2di7 s TYR 89 Cb -0.12 -0.49 -0.02 0.00 0.38 0.00 0.00 41.96 41.71 2di7 s TYR 89 CO 0.02 -0.11 -0.11 1.03 -1.52 0.00 0.00 175.55 174.86 2di7 s ARG 90 N -3.06 3.01 -0.23 -3.49 0.52 -1.24 -4.93 118.95 109.53 2di7 s ARG 90 Ca 0.05 -0.65 -0.09 0.00 -0.52 0.00 0.00 55.73 54.52 2di7 s ARG 90 Cb -0.00 -2.57 0.09 0.00 0.52 0.00 0.00 34.95 32.99 2di7 s ARG 90 CO -0.03 0.43 0.50 1.41 0.02 0.00 0.00 175.30 177.64 2di7 s MET 91 N -0.22 0.44 -0.69 3.54 1.75 -1.26 -3.61 119.30 119.25 2di7 s MET 91 Ca 0.01 1.11 0.00 0.00 -1.25 0.00 0.00 55.69 55.57 2di7 s MET 91 Cb -0.13 0.38 0.39 0.00 2.84 0.00 0.00 34.83 38.30 2di7 s MET 91 CO 0.03 -0.21 1.76 0.66 -0.65 0.00 0.00 175.02 176.60 2di7 n TYR 92 N 5.07 3.11 -3.73 4.11 4.02 -1.26 -4.94 117.16 123.55 2di7 n TYR 92 Ca -0.13 -2.61 -0.12 0.00 -0.01 0.00 0.00 57.90 55.03 2di7 n TYR 92 Cb 0.51 -0.91 -0.11 0.00 -0.02 0.00 0.00 39.34 38.81 2di7 n TYR 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2di7 s ALA 93 N -3.88 -0.82 -0.44 -0.72 0.00 -1.26 -5.11 121.76 109.53 2di7 s ALA 93 Ca 0.53 1.16 -0.28 0.00 0.00 0.00 0.00 51.96 53.37 2di7 s ALA 93 Cb 0.44 -0.70 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 2di7 s ALA 93 CO -0.28 -0.21 1.73 -1.12 0.00 0.00 0.00 175.76 175.88 2di7 s SER 94 N 0.92 5.81 -0.04 0.00 0.01 -1.26 -4.98 113.70 114.16 2di7 s SER 94 Ca -0.06 0.89 -0.04 0.00 1.31 0.00 0.00 55.95 58.05 2di7 s SER 94 Cb -0.07 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 2di7 s SER 94 CO -0.07 -1.85 0.16 -0.72 0.41 0.00 0.00 173.24 171.17 2di7 s TYR 95 N 7.21 3.54 -0.22 2.43 -0.85 -1.26 -5.03 117.35 123.17 2di7 s TYR 95 Ca 0.71 0.39 -0.16 0.00 -0.52 0.00 0.00 57.07 57.49 2di7 s TYR 95 Cb -0.17 -1.85 -0.11 0.00 0.38 0.00 0.00 41.96 40.21 2di7 s TYR 95 CO 0.29 0.66 -0.22 1.63 -1.52 0.00 0.00 175.55 176.40 2di7 n LYS 96 N 1.22 0.55 -4.36 -3.49 4.76 -1.26 -5.01 118.16 110.57 2di7 n LYS 96 Ca -0.13 0.35 -0.23 0.00 -2.87 0.00 0.00 58.31 55.43 2di7 n LYS 96 Cb 0.53 -1.55 -0.13 0.00 -1.84 0.00 0.00 35.03 32.04 2di7 n LYS 96 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2di7 s ASN 97 N -6.74 2.28 0.10 4.39 2.47 -1.26 -4.43 114.94 111.77 2di7 s ASN 97 Ca -0.31 -0.61 -0.11 0.00 0.42 0.00 0.00 52.86 52.24 2di7 s ASN 97 Cb 0.09 -0.14 0.01 0.00 -1.45 0.00 0.00 41.25 39.76 2di7 s ASN 97 CO 0.46 0.06 0.27 -0.76 -3.72 0.00 0.00 177.10 173.41 2di7 s LEU 98 N -1.62 1.04 -0.17 3.21 1.43 -1.25 -4.60 118.68 116.72 2di7 s LEU 98 Ca 0.05 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2di7 s LEU 98 Cb -0.09 1.34 0.01 0.00 0.03 0.00 0.00 46.19 47.48 2di7 s LEU 98 CO 0.03 -0.78 -0.20 -0.75 0.23 0.00 0.00 176.35 174.88 2di7 s LYS 99 N -3.84 3.03 -0.00 1.70 2.20 -0.48 -4.12 119.74 118.22 2di7 s LYS 99 Ca 0.04 -0.83 -0.15 0.00 -0.36 0.00 0.00 55.97 54.68 2di7 s LYS 99 Cb 0.04 -2.54 -0.06 0.00 -1.51 0.00 0.00 37.83 33.76 2di7 s LYS 99 CO -0.11 -0.13 0.41 0.08 -0.36 0.00 0.00 175.35 175.24 2di7 s VAL 100 N 1.11 5.03 -0.01 4.02 1.01 -1.13 -3.01 120.40 127.41 2di7 s VAL 100 Ca 0.00 0.84 -0.00 0.00 0.00 0.00 0.00 61.98 62.82 2di7 s VAL 100 Cb -0.14 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2di7 s VAL 100 CO -0.08 0.58 0.02 -1.61 0.00 0.00 0.00 175.10 174.00 2di7 s GLU 101 N -1.07 -0.00 -0.23 2.72 2.02 -0.64 -1.24 118.70 120.26 2di7 s GLU 101 Ca 0.24 0.06 -0.03 0.00 0.02 0.00 0.00 54.97 55.26 2di7 s GLU 101 Cb -0.17 -0.06 0.11 0.00 0.10 0.00 0.00 34.13 34.11 2di7 s GLU 101 CO 0.13 -0.05 0.26 0.42 0.02 0.00 0.00 175.26 176.04 2di7 s ILE 102 N 0.30 -0.37 0.43 -1.63 1.09 -1.26 -0.78 121.20 118.97 2di7 s ILE 102 Ca -0.02 -0.20 0.05 0.00 -1.10 0.00 0.00 60.65 59.38 2di7 s ILE 102 Cb -0.04 -0.76 -0.06 0.00 -1.06 0.00 0.00 42.46 40.54 2di7 s ILE 102 CO -0.01 -0.26 0.01 -0.54 -0.10 0.00 0.00 174.94 174.05 2di7 s LYS 103 N 2.36 2.01 -0.14 2.79 3.01 -1.17 -2.63 119.74 125.97 2di7 s LYS 103 Ca 0.08 -2.18 -0.05 0.00 -1.01 0.00 0.00 55.97 52.81 2di7 s LYS 103 Cb -0.15 -1.54 0.07 0.00 -1.01 0.00 0.00 37.83 35.20 2di7 s LYS 103 CO -0.17 -0.16 0.27 0.12 0.51 0.00 0.00 175.35 175.93 2di7 s PHE 104 N -2.81 -0.45 -1.60 3.18 5.36 0.18 -2.93 117.98 118.91 2di7 s PHE 104 Ca 0.27 0.99 -0.08 0.00 -0.96 0.00 0.00 56.93 57.14 2di7 s PHE 104 Cb 0.07 -0.02 0.08 0.00 -0.34 0.00 0.00 43.02 42.81 2di7 s PHE 104 CO 0.14 -0.38 0.39 0.00 -1.46 0.00 0.00 175.22 173.91 2di7 n GLN 105 N 5.35 -2.05 -2.02 10.12 10.64 -1.26 0.10 117.38 138.26 2di7 n GLN 105 Ca -0.06 0.25 -0.09 0.00 -1.83 0.00 0.00 57.00 55.26 2di7 n GLN 105 Cb 0.50 -4.38 -0.01 0.00 -0.86 0.00 0.00 30.24 25.49 2di7 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2di7 n GLY 106 N -1.90 0.18 2.76 2.61 0.00 -1.26 -5.01 105.19 102.57 2di7 n GLY 106 Ca -0.16 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.16 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 -4.17 0.06 0.39 1.61 -0.21 0.29 -5.13 119.66 112.48 2di7 s GLN 107 Ca 0.00 0.34 -0.26 0.00 0.02 0.00 0.00 55.36 55.46 2di7 s GLN 107 Cb 0.00 -0.80 -0.11 0.00 1.00 0.00 0.00 33.01 33.10 2di7 s GLN 107 CO 0.00 -0.46 1.26 0.72 -2.12 0.00 0.00 175.29 174.69 2di7 n HIS 108 N 5.31 2.12 -0.05 0.91 8.25 -1.26 0.49 115.22 130.99 2di7 n HIS 108 Ca -0.05 0.53 -0.00 0.00 -0.26 0.00 0.00 57.72 57.94 2di7 n HIS 108 Cb 0.50 -2.38 -0.15 0.00 1.12 0.00 0.00 29.99 29.08 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 0.00 0.65 -4.24 1.59 0.31 -1.08 -4.29 118.33 111.27 2di7 n VAL 109 Ca 0.06 -0.61 -0.12 0.00 -0.01 0.00 0.00 64.34 63.66 2di7 n VAL 109 Cb 0.38 -0.25 -0.03 0.00 -0.91 0.00 0.00 33.84 33.03 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 -2.43 0.26 0.00 3.52 0.00 -1.26 -4.21 120.51 116.40 2di7 n ALA 110 Ca -0.17 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2di7 n ALA 110 Cb 0.81 0.65 0.01 0.00 0.00 0.00 0.00 19.45 20.92 2di7 n ALA 110 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2di7 n LYS 111 N -0.44 0.00 -0.89 0.00 3.00 -1.26 -4.80 118.16 113.77 2di7 n LYS 111 Ca -0.03 0.49 -0.29 0.00 -0.00 0.00 0.00 58.31 58.48 2di7 n LYS 111 Cb 0.29 -1.52 0.01 0.00 0.00 0.00 0.00 35.03 33.81 2di7 n LYS 111 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2di7 n SER 112 N -1.50 -3.17 -4.77 3.14 2.88 -1.26 -4.62 113.62 104.33 2di7 n SER 112 Ca -0.00 0.40 -0.39 0.00 -1.33 0.00 0.00 58.87 57.55 2di7 n SER 112 Cb 0.01 -0.62 -0.02 0.00 -0.75 0.00 0.00 64.21 62.84 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 -0.93 4.17 -0.25 -1.46 0.04 -1.26 -5.00 135.00 130.30 2di7 s PRO 113 Ca 0.39 1.94 -0.17 0.00 0.04 0.00 0.00 61.00 63.20 2di7 s PRO 113 Cb -0.31 -2.82 -0.03 0.00 0.04 0.00 0.00 34.50 31.38 2di7 s PRO 113 CO 0.52 -0.25 0.48 0.71 0.04 0.00 0.00 177.00 178.50 2di7 s TYR 114 N -1.32 3.28 -0.44 0.56 2.02 -0.37 -5.02 117.35 116.07 2di7 s TYR 114 Ca 0.54 0.61 -0.08 0.00 -0.37 0.00 0.00 57.07 57.76 2di7 s TYR 114 Cb -0.33 -2.67 0.10 0.00 -0.40 0.00 0.00 41.96 38.65 2di7 s TYR 114 CO 0.43 -0.24 0.29 0.42 -1.57 0.00 0.00 175.55 174.88 2di7 s ILE 115 N 2.13 4.08 -0.19 2.71 -1.09 -1.26 -2.86 121.20 124.72 2di7 s ILE 115 Ca 0.20 -1.66 -0.01 0.00 -2.23 0.00 0.00 60.65 56.95 2di7 s ILE 115 Cb -0.16 -3.62 0.05 0.00 -1.58 0.00 0.00 42.46 37.16 2di7 s ILE 115 CO 0.09 -0.65 -0.04 -0.76 -1.23 0.00 0.00 174.94 172.35 2di7 s LEU 116 N 1.36 1.82 0.38 2.97 1.02 -1.26 -5.12 118.68 119.86 2di7 s LEU 116 Ca 0.05 -0.84 0.08 0.00 0.02 0.00 0.00 54.13 53.44 2di7 s LEU 116 Cb -0.24 -0.94 -0.04 0.00 0.02 0.00 0.00 46.19 44.99 2di7 s LEU 116 CO -0.00 -0.22 0.23 -1.59 0.02 0.00 0.00 176.35 174.79 2di7 s LYS 117 N 1.60 2.39 -0.17 1.70 0.00 -1.26 -3.95 119.74 120.05 2di7 s LYS 117 Ca -0.01 -1.62 0.04 0.00 0.00 0.00 0.00 55.97 54.37 2di7 s LYS 117 Cb -0.17 -2.19 0.12 0.00 0.00 0.00 0.00 37.83 35.60 2di7 s LYS 117 CO -0.07 -0.04 0.91 0.41 0.00 0.00 0.00 175.35 176.55 2di7 n GLY 118 N -1.30 -0.14 3.52 0.59 0.00 -1.26 -4.95 105.19 101.65 2di7 n GLY 118 Ca -0.01 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.50 1.19 0.00 1.61 3.41 -1.26 -4.50 113.62 113.57 2di7 n SER 119 Ca -0.11 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 2di7 n SER 119 Cb 0.64 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 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 6.27 0.31 0.00 5.00 0.00 -1.26 -4.51 105.19 111.00 2di7 n GLY 120 Ca 0.53 -1.81 0.08 0.00 0.00 0.00 0.00 46.02 44.82 2di7 n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2di7 n PRO 121 N 0.51 0.49 -0.28 1.61 -0.04 -1.26 -4.00 135.00 132.02 2di7 n PRO 121 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2di7 n PRO 121 Cb 0.00 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.06 2di7 n PRO 121 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2di7 n SER 122 N -1.00 -0.30 -4.61 3.54 7.64 -1.26 -4.38 113.62 113.25 2di7 n SER 122 Ca 0.12 1.35 -0.51 0.00 1.01 0.00 0.00 58.87 60.84 2di7 n SER 122 Cb 0.05 -0.40 -0.05 0.00 -1.01 0.00 0.00 64.21 62.80 2di7 n SER 122 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2di7 n SER 123 N -5.26 1.94 0.00 6.43 7.64 -1.26 -5.19 113.62 117.92 2di7 n SER 123 Ca 0.12 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.11 2di7 n SER 123 Cb 0.38 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 2di7 n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64