#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 5.81 0.02 1.61 0.01 -1.26 -5.07 113.70 114.83 2di7 s SER 2 Ca 0.00 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2di7 s SER 2 Cb 0.00 -2.07 -0.02 0.00 0.21 0.00 0.00 66.02 64.15 2di7 s SER 2 CO 0.00 -0.27 -0.03 -0.94 0.41 0.00 0.00 173.24 172.40 2di7 s SER 3 N 1.65 0.32 -0.46 2.44 1.04 -1.26 -5.10 113.70 112.33 2di7 s SER 3 Ca 0.05 -0.40 0.06 0.00 0.48 0.00 0.00 55.95 56.14 2di7 s SER 3 Cb -0.18 0.06 0.22 0.00 0.10 0.00 0.00 66.02 66.23 2di7 s SER 3 CO 0.08 -0.21 0.69 0.61 0.98 0.00 0.00 173.24 175.39 2di7 n GLY 4 N 1.91 0.87 2.78 7.32 0.00 -1.26 -4.93 105.19 111.89 2di7 n GLY 4 Ca -0.21 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.24 2di7 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2di7 n SER 5 N 2.01 -5.10 -4.80 1.61 2.88 -1.26 -5.00 113.62 103.97 2di7 n SER 5 Ca 0.17 -0.26 -0.37 0.00 -1.33 0.00 0.00 58.87 57.08 2di7 n SER 5 Cb 0.57 -3.90 -0.07 0.00 -0.75 0.00 0.00 64.21 60.07 2di7 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2di7 s SER 6 N -2.88 6.43 0.00 -3.46 0.15 -1.26 -5.05 113.70 107.63 2di7 s SER 6 Ca 0.27 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.43 2di7 s SER 6 Cb -0.12 -2.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 2di7 s SER 6 CO 0.34 0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.65 2di7 n GLY 7 N 2.70 2.81 3.69 9.45 0.00 -1.26 -5.12 105.19 117.47 2di7 n GLY 7 Ca -0.16 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2di7 n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2di7 s GLU 8 N -2.00 4.19 -0.36 1.61 -1.05 -1.26 -4.93 118.70 114.90 2di7 s GLU 8 Ca 0.00 2.38 -0.29 0.00 -0.15 0.00 0.00 54.97 56.91 2di7 s GLU 8 Cb 0.00 -3.61 0.00 0.00 -0.44 0.00 0.00 34.13 30.08 2di7 s GLU 8 CO 0.00 -0.76 1.43 0.99 0.95 0.00 0.00 175.26 177.88 2di7 s THR 9 N 2.69 3.91 0.00 1.83 2.01 -1.26 -4.82 115.64 120.00 2di7 s THR 9 Ca 0.75 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.72 2di7 s THR 9 Cb -0.41 -4.10 0.00 0.00 0.01 0.00 0.00 72.50 68.00 2di7 s THR 9 CO 0.33 -0.61 0.00 0.61 -0.69 0.00 0.00 174.62 174.26 2di7 n GLY 10 N 4.86 2.44 2.56 4.40 0.00 -1.26 -5.08 105.19 113.11 2di7 n GLY 10 Ca 0.17 0.11 -0.04 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 1.27 3.44 -0.02 0.00 -1.26 -5.15 105.19 103.46 2di7 n GLY 11 Ca 0.00 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.99 -0.55 -1.78 1.61 1.02 -1.26 -4.93 120.64 113.75 2di7 n GLU 12 Ca -0.12 -0.12 -0.34 0.00 -0.02 0.00 0.00 57.16 56.57 2di7 n GLU 12 Cb 0.81 -1.93 0.05 0.00 -0.02 0.00 0.00 31.44 30.35 2di7 n GLU 12 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2di7 s ARG 13 N -3.79 2.77 -0.32 3.49 1.70 -1.26 -5.02 118.95 116.52 2di7 s ARG 13 Ca 0.59 1.51 -0.05 0.00 -0.47 0.00 0.00 55.73 57.31 2di7 s ARG 13 Cb -0.20 -1.94 0.04 0.00 -0.57 0.00 0.00 34.95 32.28 2di7 s ARG 13 CO 0.66 -1.30 0.07 -0.65 -1.08 0.00 0.00 175.30 173.00 2di7 s GLN 14 N -3.90 2.56 0.12 3.89 -1.52 -1.26 -5.07 119.66 114.48 2di7 s GLN 14 Ca 0.70 -1.21 -0.31 0.00 -1.95 0.00 0.00 55.36 52.59 2di7 s GLN 14 Cb -0.23 -3.36 -0.10 0.00 -0.22 0.00 0.00 33.01 29.10 2di7 s GLN 14 CO 0.40 -0.65 1.75 -1.17 -0.25 0.00 0.00 175.29 175.36 2di7 s LEU 15 N 1.35 4.38 -0.19 2.90 2.96 -1.26 -2.03 118.68 126.80 2di7 s LEU 15 Ca -0.03 2.69 -0.01 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 0.01 -0.95 -0.12 -0.94 -1.32 0.00 0.00 176.35 173.03 2di7 s SER 16 N 2.31 3.78 -0.02 3.68 1.04 0.32 -4.86 113.70 119.95 2di7 s SER 16 Ca 0.77 -0.48 -0.25 0.00 0.48 0.00 0.00 55.95 56.46 2di7 s SER 16 Cb -0.45 -1.61 -0.20 0.00 0.10 0.00 0.00 66.02 63.87 2di7 s SER 16 CO 0.34 0.02 1.23 1.55 0.98 0.00 0.00 173.24 177.37 2di7 h PRO 17 N 7.80 -0.05 -0.75 4.02 0.13 -1.83 -2.78 132.00 138.54 2di7 h PRO 17 Ca -0.40 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.86 2di7 h PRO 17 Cb 1.16 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2di7 h PRO 17 CO 0.60 0.42 0.33 1.05 -0.23 0.00 0.00 178.00 180.17 2di7 h GLU 18 N -0.54 0.49 -0.70 0.86 4.11 -1.69 -0.85 114.58 116.26 2di7 h GLU 18 Ca -0.01 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.37 2di7 h GLU 18 Cb 0.49 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 2di7 h GLU 18 CO 0.01 0.32 0.34 0.87 0.07 0.00 0.00 179.01 180.62 2di7 h LYS 19 N 0.50 1.00 -6.03 1.06 1.79 -1.81 -3.45 116.57 109.63 2di7 h LYS 19 Ca 0.40 -0.14 -0.58 0.00 -2.18 0.00 0.00 60.65 58.14 2di7 h LYS 19 Cb 0.56 -0.18 0.20 0.00 -1.58 0.00 0.00 32.23 31.22 2di7 h LYS 19 CO -0.36 0.79 -1.31 0.43 -1.08 0.00 0.00 179.45 177.91 2di7 n SER 20 N -4.44 -4.19 -4.15 0.86 7.64 -0.33 -4.86 113.62 104.16 2di7 n SER 20 Ca 0.06 0.52 -0.30 0.00 1.01 0.00 0.00 58.87 60.16 2di7 n SER 20 Cb 0.12 -0.84 -0.17 0.00 -1.01 0.00 0.00 64.21 62.31 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 -1.37 2.65 -0.24 1.43 2.02 -1.25 -4.80 118.70 117.14 2di7 s GLU 21 Ca 0.53 -0.73 -0.02 0.00 0.02 0.00 0.00 54.97 54.76 2di7 s GLU 21 Cb -0.40 -2.09 0.02 0.00 0.10 0.00 0.00 34.13 31.75 2di7 s GLU 21 CO 0.70 0.07 -0.07 0.42 0.02 0.00 0.00 175.26 176.41 2di7 s ILE 22 N 0.61 2.93 0.38 -1.63 1.01 -1.26 -3.74 121.20 119.49 2di7 s ILE 22 Ca -0.14 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 59.67 2di7 s ILE 22 Cb -0.17 -2.43 -0.06 0.00 0.01 0.00 0.00 42.46 39.81 2di7 s ILE 22 CO 0.04 0.28 0.04 -1.66 0.00 0.00 0.00 174.94 173.64 2di7 s TRP 23 N 1.36 2.15 0.00 3.97 -2.14 -1.26 -5.04 118.94 117.99 2di7 s TRP 23 Ca 0.02 -0.87 0.00 0.00 2.66 0.00 0.00 56.10 57.91 2di7 s TRP 23 Cb -0.16 -1.48 0.00 0.00 -3.10 0.00 0.00 33.47 28.73 2di7 s TRP 23 CO -0.05 0.17 0.00 0.41 -2.66 0.00 0.00 176.95 174.82 2di7 n GLY 24 N -0.85 3.58 0.27 3.67 0.00 -1.26 -3.91 105.19 106.69 2di7 n GLY 24 Ca -0.05 -1.70 0.16 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.45 1.61 0.13 -2.00 -3.22 132.00 128.07 2di7 h PRO 25 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.26 2di7 h PRO 25 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2di7 h PRO 25 CO 0.00 0.05 1.00 0.78 -0.23 0.00 0.00 178.00 179.60 2di7 h GLY 26 N 1.90 0.00 -4.93 1.56 0.00 -1.90 0.33 103.07 100.02 2di7 h GLY 26 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 2di7 h GLY 26 CO 0.01 0.00 -0.92 1.04 0.00 0.00 0.00 176.54 176.67 2di7 n LEU 27 N -2.92 3.23 -4.78 3.11 4.77 -1.22 -5.06 117.00 114.14 2di7 n LEU 27 Ca 0.10 -4.78 -0.32 0.00 -0.03 0.00 0.00 56.01 50.98 2di7 n LEU 27 Cb 1.14 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 42.10 2di7 n LEU 27 CO 0.13 2.04 -0.20 -1.59 -1.33 0.00 0.00 177.39 176.44 2di7 s LYS 28 N -3.28 2.20 0.00 3.23 -2.85 0.12 -5.05 119.74 114.11 2di7 s LYS 28 Ca 0.41 -2.32 0.00 0.00 -1.00 0.00 0.00 55.97 53.06 2di7 s LYS 28 Cb 0.40 -1.64 0.00 0.00 -2.06 0.00 0.00 37.83 34.53 2di7 s LYS 28 CO -0.10 -0.39 0.45 0.00 0.10 0.00 0.00 175.35 175.41 2di7 n ALA 29 N -1.34 -0.16 -2.17 0.59 0.00 -1.26 -4.13 120.51 112.04 2di7 n ALA 29 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 2di7 n ALA 29 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 2di7 n ALA 29 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2di7 n ASP 30 N -1.30 6.21 -3.28 0.00 9.92 -1.26 -5.00 116.55 121.85 2di7 n ASP 30 Ca 0.00 -3.10 -0.10 0.00 -0.53 0.00 0.00 54.79 51.06 2di7 n ASP 30 Cb 0.00 -1.44 0.10 0.00 -0.64 0.00 0.00 41.12 39.14 2di7 n ASP 30 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 2di7 n VAL 31 N 2.80 0.00 -2.64 2.53 0.24 -1.26 -4.90 118.33 115.10 2di7 n VAL 31 Ca 0.49 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 62.40 2di7 n VAL 31 Cb 0.32 -0.33 -0.05 0.00 -1.47 0.00 0.00 33.84 32.31 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 -1.46 3.86 0.01 3.34 -7.23 -1.26 -4.98 120.40 112.68 2di7 s VAL 32 Ca 0.22 1.77 -0.25 0.00 -1.81 0.00 0.00 61.98 61.91 2di7 s VAL 32 Cb -0.04 -4.09 -0.18 0.00 0.56 0.00 0.00 36.38 32.64 2di7 s VAL 32 CO 0.19 0.35 1.35 0.25 -0.31 0.00 0.00 175.10 176.93 2di7 h LEU 33 N 3.72 -0.16 0.00 1.32 6.46 -2.04 -3.41 115.31 121.20 2di7 h LEU 33 Ca -0.46 -0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.05 2di7 h LEU 33 Cb 1.20 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 2di7 h LEU 33 CO 0.67 0.18 0.00 -0.81 -0.62 0.00 0.00 178.44 177.85 2di7 n PRO 34 N -5.03 0.00 -4.11 5.25 -0.04 -1.26 -5.01 135.00 124.80 2di7 n PRO 34 Ca -0.09 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.25 2di7 n PRO 34 Cb 0.21 -0.23 -0.11 0.00 -0.04 0.00 0.00 33.50 33.34 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 0.77 0.11 0.55 0.00 -1.26 -4.99 121.76 113.97 2di7 s ALA 35 Ca 0.00 -1.01 0.11 0.00 0.00 0.00 0.00 51.96 51.06 2di7 s ALA 35 Cb 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 2di7 s ALA 35 CO 0.00 -0.09 -0.27 -0.98 0.00 0.00 0.00 175.76 174.42 2di7 s ARG 36 N -2.46 1.48 -0.10 0.00 1.04 -1.26 -4.80 118.95 112.85 2di7 s ARG 36 Ca -0.01 -1.30 -0.05 0.00 -1.04 0.00 0.00 55.73 53.33 2di7 s ARG 36 Cb -0.04 -1.92 0.05 0.00 -2.04 0.00 0.00 34.95 31.00 2di7 s ARG 36 CO -0.01 0.46 0.22 1.52 -0.04 0.00 0.00 175.30 177.45 2di7 s TYR 37 N -1.01 -0.29 0.44 5.89 1.13 -1.26 -4.62 117.35 117.63 2di7 s TYR 37 Ca 0.14 0.71 0.06 0.00 -1.41 0.00 0.00 57.07 56.56 2di7 s TYR 37 Cb -0.10 0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.72 2di7 s TYR 37 CO 0.05 -0.22 0.08 -0.59 -2.51 0.00 0.00 175.55 172.36 2di7 s PHE 38 N 1.30 2.32 0.04 -3.49 -0.71 -1.26 -4.80 117.98 111.38 2di7 s PHE 38 Ca -0.09 -0.73 0.05 0.00 -1.04 0.00 0.00 56.93 55.12 2di7 s PHE 38 Cb -0.11 -1.79 -0.03 0.00 -1.21 0.00 0.00 43.02 39.87 2di7 s PHE 38 CO -0.08 0.27 -0.10 0.71 -1.34 0.00 0.00 175.22 174.68 2di7 s TYR 39 N -2.73 2.79 -0.36 3.49 2.02 -1.25 -3.26 117.35 118.04 2di7 s TYR 39 Ca 0.29 -0.11 -0.02 0.00 -0.37 0.00 0.00 57.07 56.86 2di7 s TYR 39 Cb 0.06 -1.54 0.09 0.00 -0.40 0.00 0.00 41.96 40.17 2di7 s TYR 39 CO 0.16 0.36 0.12 0.42 -1.57 0.00 0.00 175.55 175.03 2di7 s ILE 40 N -1.04 3.05 0.17 2.71 1.01 -1.13 -4.16 121.20 121.81 2di7 s ILE 40 Ca 0.18 -1.88 -0.15 0.00 0.00 0.00 0.00 60.65 58.80 2di7 s ILE 40 Cb -0.11 -3.00 -0.07 0.00 0.01 0.00 0.00 42.46 39.29 2di7 s ILE 40 CO 0.09 -0.49 0.60 -1.58 0.00 0.00 0.00 174.94 173.56 2di7 s GLN 41 N 1.14 4.04 -0.12 2.79 2.00 -1.25 -3.29 119.66 124.98 2di7 s GLN 41 Ca 0.04 0.58 -0.07 0.00 -2.00 0.00 0.00 55.36 53.91 2di7 s GLN 41 Cb -0.21 -2.90 -0.04 0.00 0.80 0.00 0.00 33.01 30.66 2di7 s GLN 41 CO -0.04 0.44 0.12 0.00 -0.50 0.00 0.00 175.29 175.32 2di7 s ALA 42 N -1.50 3.79 0.10 1.58 0.00 -1.26 -3.85 121.76 120.61 2di7 s ALA 42 Ca 0.40 -0.66 0.07 0.00 0.00 0.00 0.00 51.96 51.76 2di7 s ALA 42 Cb -0.15 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.00 2di7 s ALA 42 CO 0.20 0.57 -0.17 0.08 0.00 0.00 0.00 175.76 176.43 2di7 s VAL 43 N -0.87 1.44 0.60 0.00 1.01 -1.26 -2.43 120.40 118.89 2di7 s VAL 43 Ca 0.14 -1.50 -0.01 0.00 0.00 0.00 0.00 61.98 60.62 2di7 s VAL 43 Cb -0.12 -1.38 0.05 0.00 0.00 0.00 0.00 36.38 34.93 2di7 s VAL 43 CO 0.03 -0.18 0.85 -0.62 0.00 0.00 0.00 175.10 175.18 2di7 s ASP 44 N -1.95 5.08 0.16 3.32 2.15 -0.40 -0.52 116.67 124.51 2di7 s ASP 44 Ca 0.04 0.06 0.12 0.00 0.43 0.00 0.00 52.55 53.21 2di7 s ASP 44 Cb -0.09 -0.85 0.63 0.00 -0.30 0.00 0.00 42.92 42.31 2di7 s ASP 44 CO 0.03 -1.31 1.38 0.35 -0.17 0.00 0.00 175.17 175.45 2di7 n THR 45 N -2.52 1.42 -0.81 1.71 -2.24 -0.86 -0.57 114.28 110.40 2di7 n THR 45 Ca 0.09 0.56 0.08 0.00 -2.27 0.00 0.00 64.05 62.50 2di7 n THR 45 Cb 0.60 -1.53 0.26 0.00 -2.10 0.00 0.00 70.33 67.56 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 -1.88 3.96 -3.04 3.42 7.64 -1.26 -4.95 113.62 117.50 2di7 n SER 46 Ca -0.00 -2.79 -0.19 0.00 1.01 0.00 0.00 58.87 56.90 2di7 n SER 46 Cb 0.05 -0.50 0.07 0.00 -1.01 0.00 0.00 64.21 62.81 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 -0.11 -0.27 3.56 0.23 0.00 0.26 -5.00 105.19 103.85 2di7 n GLY 47 Ca 0.20 0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.33 4.96 -0.12 1.61 0.01 -1.25 -4.83 114.94 111.99 2di7 s ASN 48 Ca 0.44 -0.04 -0.29 0.00 -0.71 0.00 0.00 52.86 52.26 2di7 s ASN 48 Cb -0.20 -1.70 -0.04 0.00 0.41 0.00 0.00 41.25 39.73 2di7 s ASN 48 CO 0.60 0.22 1.49 -0.54 -1.51 0.00 0.00 177.10 177.37 2di7 s LYS 49 N 0.04 4.16 0.06 -0.60 1.02 -1.26 -1.27 119.74 121.89 2di7 s LYS 49 Ca 0.01 1.92 -0.24 0.00 0.02 0.00 0.00 55.97 57.68 2di7 s LYS 49 Cb -0.13 -3.90 -0.16 0.00 -0.52 0.00 0.00 37.83 33.11 2di7 s LYS 49 CO 0.02 -0.84 1.63 0.74 -0.92 0.00 0.00 175.35 175.98 2di7 h PHE 50 N 9.13 -0.01 -4.10 3.18 -1.00 -1.85 -3.46 116.94 118.83 2di7 h PHE 50 Ca -0.34 -0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.23 2di7 h PHE 50 Cb 1.14 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.69 2di7 h PHE 50 CO 0.86 0.11 -0.28 0.25 -1.61 0.00 0.00 178.31 177.63 2di7 n THR 51 N -5.04 -0.53 -4.51 -1.55 -2.24 -1.26 -4.91 114.28 94.24 2di7 n THR 51 Ca -0.07 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.45 2di7 n THR 51 Cb 0.08 -1.50 -0.08 0.00 -2.10 0.00 0.00 70.33 66.73 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 -2.07 2.76 -0.48 3.42 1.04 -1.26 -4.61 113.70 112.50 2di7 s SER 52 Ca 0.03 -1.65 -0.15 0.00 0.48 0.00 0.00 55.95 54.66 2di7 s SER 52 Cb -0.01 0.46 0.08 0.00 0.10 0.00 0.00 66.02 66.65 2di7 s SER 52 CO 0.03 -0.90 0.40 -0.94 0.98 0.00 0.00 173.24 172.81 2di7 s SER 53 N -3.60 6.11 0.00 7.02 1.04 -1.26 -4.45 113.70 118.56 2di7 s SER 53 Ca 0.25 -1.43 -0.24 0.00 0.48 0.00 0.00 55.95 55.00 2di7 s SER 53 Cb 0.03 -2.17 -0.18 0.00 0.10 0.00 0.00 66.02 63.80 2di7 s SER 53 CO 0.14 -0.68 1.30 1.55 0.98 0.00 0.00 173.24 176.53 2di7 h PRO 54 N 8.75 0.13 0.00 4.02 0.13 -2.00 -3.49 132.00 139.55 2di7 h PRO 54 Ca -0.28 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 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 0.90 0.58 0.00 0.41 -0.23 0.00 0.00 178.00 179.66 2di7 n GLY 55 N 0.21 -0.09 0.06 1.56 0.00 -1.26 -5.03 105.19 100.64 2di7 n GLY 55 Ca -0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.05 -3.35 1.61 4.11 -2.01 -3.40 114.58 111.50 2di7 h GLU 56 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.86 2di7 h GLU 56 Cb 0.00 0.01 -0.40 0.00 0.50 0.00 0.00 28.75 28.86 2di7 h GLU 56 CO 0.00 0.08 -0.76 0.15 0.07 0.00 0.00 179.01 178.54 2di7 s LYS 57 N -5.73 0.65 0.00 1.06 -0.14 -1.26 -4.93 119.74 109.39 2di7 s LYS 57 Ca -0.14 -1.05 0.00 0.00 -1.36 0.00 0.00 55.97 53.42 2di7 s LYS 57 Cb 0.05 -1.84 0.00 0.00 -1.68 0.00 0.00 37.83 34.36 2di7 s LYS 57 CO 0.66 -1.01 0.00 1.33 -0.76 0.00 0.00 175.35 175.56 2di7 n VAL 58 N 4.80 0.00 -4.52 3.17 0.24 -1.26 -5.02 118.33 115.74 2di7 n VAL 58 Ca -0.01 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.95 2di7 n VAL 58 Cb 0.41 -0.85 -0.14 0.00 -1.47 0.00 0.00 33.84 31.79 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 -1.91 2.84 0.11 6.34 0.08 -1.26 -4.70 117.98 119.47 2di7 s PHE 59 Ca 0.00 -0.81 0.09 0.00 0.12 0.00 0.00 56.93 56.32 2di7 s PHE 59 Cb 0.00 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 2di7 s PHE 59 CO 0.00 -0.35 -0.19 -1.14 -0.10 0.00 0.00 175.22 173.44 2di7 s GLN 60 N 0.70 1.81 0.04 0.44 0.74 -1.25 -4.94 119.66 117.20 2di7 s GLN 60 Ca -0.06 -1.16 0.06 0.00 0.05 0.00 0.00 55.36 54.26 2di7 s GLN 60 Cb -0.15 -2.11 -0.02 0.00 1.10 0.00 0.00 33.01 31.82 2di7 s GLN 60 CO 0.02 0.49 -0.18 0.08 -0.55 0.00 0.00 175.29 175.15 2di7 s VAL 61 N -1.10 1.44 0.03 1.34 1.01 -1.26 -3.36 120.40 118.50 2di7 s VAL 61 Ca 0.17 -1.12 0.08 0.00 0.00 0.00 0.00 61.98 61.11 2di7 s VAL 61 Cb -0.11 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 2di7 s VAL 61 CO 0.09 0.12 -0.23 -0.75 0.00 0.00 0.00 175.10 174.34 2di7 s LYS 62 N -1.16 1.61 -0.23 2.72 2.47 -0.20 -4.94 119.74 120.00 2di7 s LYS 62 Ca 0.05 -0.95 0.01 0.00 -1.56 0.00 0.00 55.97 53.52 2di7 s LYS 62 Cb -0.08 -1.70 0.05 0.00 -1.46 0.00 0.00 37.83 34.65 2di7 s LYS 62 CO 0.02 0.44 -0.08 0.08 0.16 0.00 0.00 175.35 175.97 2di7 s VAL 63 N -0.73 1.67 0.01 4.02 1.01 -1.26 -2.06 120.40 123.06 2di7 s VAL 63 Ca 0.09 -1.23 0.06 0.00 0.00 0.00 0.00 61.98 60.91 2di7 s VAL 63 Cb -0.09 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 2di7 s VAL 63 CO 0.01 -0.01 -0.19 -0.44 0.00 0.00 0.00 175.10 174.47 2di7 s SER 64 N 1.35 2.25 0.00 3.32 0.01 -0.69 -4.77 113.70 115.17 2di7 s SER 64 Ca -0.05 -0.42 0.08 0.00 1.31 0.00 0.00 55.95 56.88 2di7 s SER 64 Cb -0.18 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.81 2di7 s SER 64 CO -0.07 0.19 -0.26 0.00 0.41 0.00 0.00 173.24 173.51 2di7 s ALA 65 N -0.61 2.17 0.16 1.44 0.00 -1.26 0.10 121.76 123.75 2di7 s ALA 65 Ca 0.07 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 50.78 2di7 s ALA 65 Cb -0.08 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.53 2di7 s ALA 65 CO 0.00 0.52 1.50 -1.00 0.00 0.00 0.00 175.76 176.79 2di7 h PRO 66 N 5.24 0.87 0.00 0.00 0.13 -1.94 -3.34 132.00 132.96 2di7 h PRO 66 Ca -0.44 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.23 2di7 h PRO 66 Cb 1.13 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2di7 h PRO 66 CO 0.46 1.10 0.00 -1.91 -0.23 0.00 0.00 178.00 177.42 2di7 n GLU 67 N -4.05 0.00 -3.88 0.86 2.13 -1.26 -4.45 120.64 109.99 2di7 n GLU 67 Ca -0.02 0.92 -0.36 0.00 0.66 0.00 0.00 57.16 58.36 2di7 n GLU 67 Cb 0.54 -1.44 -0.06 0.00 0.27 0.00 0.00 31.44 30.76 2di7 n GLU 67 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 2di7 s GLU 68 N -2.75 3.45 0.05 5.31 1.03 -1.25 -5.03 118.70 119.49 2di7 s GLU 68 Ca 0.00 -0.17 -0.18 0.00 0.03 0.00 0.00 54.97 54.65 2di7 s GLU 68 Cb 0.00 -3.17 -0.08 0.00 -0.80 0.00 0.00 34.13 30.08 2di7 s GLU 68 CO 0.00 0.75 1.28 1.96 -1.33 0.00 0.00 175.26 177.93 2di7 h GLN 69 N 4.69 -0.44 -7.62 -4.83 4.20 -1.81 -3.42 115.11 105.88 2di7 h GLN 69 Ca -0.53 0.03 -0.46 0.00 0.06 0.00 0.00 58.65 57.74 2di7 h GLN 69 Cb 1.22 0.10 0.12 0.00 0.30 0.00 0.00 27.48 29.22 2di7 h GLN 69 CO 0.61 -0.29 0.39 -0.06 -0.67 0.00 0.00 178.83 178.80 2di7 s PHE 70 N -4.43 2.63 -0.28 2.96 0.40 -1.26 -4.85 117.98 113.15 2di7 s PHE 70 Ca -0.09 0.71 -0.20 0.00 -0.60 0.00 0.00 56.93 56.75 2di7 s PHE 70 Cb 0.03 -3.56 0.10 0.00 0.51 0.00 0.00 43.02 40.09 2di7 s PHE 70 CO 0.31 -2.05 0.82 0.99 0.70 0.00 0.00 175.22 175.98 2di7 s THR 71 N -3.55 0.00 -0.39 0.64 2.01 -1.26 -4.84 115.64 108.25 2di7 s THR 71 Ca 0.64 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.67 2di7 s THR 71 Cb -0.11 -1.00 0.11 0.00 0.01 0.00 0.00 72.50 71.51 2di7 s THR 71 CO 0.51 0.00 0.12 -0.60 -0.69 0.00 0.00 174.62 173.96 2di7 s ARG 72 N 1.04 1.51 -0.14 4.92 3.52 -1.26 -5.05 118.95 123.48 2di7 s ARG 72 Ca -0.05 -1.99 0.02 0.00 -0.13 0.00 0.00 55.73 53.58 2di7 s ARG 72 Cb -0.05 -3.04 0.01 0.00 -1.56 0.00 0.00 34.95 30.32 2di7 s ARG 72 CO -0.12 -1.01 -0.19 0.08 -0.81 0.00 0.00 175.30 173.26 2di7 s VAL 73 N 0.63 1.87 -1.30 7.11 1.01 -1.26 -4.99 120.40 123.47 2di7 s VAL 73 Ca 0.13 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 2di7 s VAL 73 Cb -0.21 -1.68 0.12 0.00 0.00 0.00 0.00 36.38 34.61 2di7 s VAL 73 CO -0.07 0.51 1.76 0.61 0.00 0.00 0.00 175.10 177.91 2di7 n GLY 74 N 4.25 3.60 3.71 4.51 0.00 -1.26 -4.95 105.19 115.05 2di7 n GLY 74 Ca -0.20 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.63 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 2.42 5.00 0.06 1.61 1.01 -1.26 -4.19 120.40 125.04 2di7 s VAL 75 Ca 0.46 1.56 0.06 0.00 0.00 0.00 0.00 61.98 64.06 2di7 s VAL 75 Cb 0.05 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 2di7 s VAL 75 CO 0.01 0.21 -0.16 -1.58 0.00 0.00 0.00 175.10 173.58 2di7 s GLN 76 N 1.02 0.98 -0.29 2.72 2.00 -0.99 -5.00 119.66 120.09 2di7 s GLN 76 Ca 0.40 -0.91 -0.00 0.00 -2.00 0.00 0.00 55.36 52.84 2di7 s GLN 76 Cb -0.18 -1.04 0.06 0.00 0.80 0.00 0.00 33.01 32.64 2di7 s GLN 76 CO 0.19 0.25 -0.02 0.14 -0.50 0.00 0.00 175.29 175.34 2di7 s VAL 77 N -1.04 2.75 0.26 1.34 -7.23 -1.26 -1.96 120.40 113.25 2di7 s VAL 77 Ca 0.02 -1.51 0.08 0.00 -1.81 0.00 0.00 61.98 58.76 2di7 s VAL 77 Cb -0.09 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 2di7 s VAL 77 CO 0.02 -0.12 0.14 -0.22 -0.31 0.00 0.00 175.10 174.61 2di7 s LEU 78 N 1.19 3.63 -0.38 1.32 0.20 -0.31 -4.88 118.68 119.45 2di7 s LEU 78 Ca -0.05 -0.37 -0.18 0.00 0.69 0.00 0.00 54.13 54.21 2di7 s LEU 78 Cb -0.20 -2.16 0.01 0.00 -0.43 0.00 0.00 46.19 43.41 2di7 s LEU 78 CO -0.02 -0.04 0.51 -1.81 -0.29 0.00 0.00 176.35 174.69 2di7 s ASP 79 N -3.80 6.28 0.01 3.68 1.01 -1.26 -0.51 116.67 122.07 2di7 s ASP 79 Ca 0.33 -0.25 -0.05 0.00 0.71 0.00 0.00 52.55 53.29 2di7 s ASP 79 Cb -0.07 -2.26 -0.02 0.00 1.01 0.00 0.00 42.92 41.58 2di7 s ASP 79 CO 0.24 -0.55 -0.10 0.54 0.21 0.00 0.00 175.17 175.51 2di7 n ARG 80 N 5.78 0.15 -1.88 8.23 5.12 -1.26 -4.99 116.66 127.81 2di7 n ARG 80 Ca -0.05 0.06 -0.30 0.00 -1.93 0.00 0.00 57.85 55.63 2di7 n ARG 80 Cb 0.48 -0.77 0.21 0.00 -1.16 0.00 0.00 32.46 31.22 2di7 n ARG 80 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2di7 s LYS 81 N -2.26 0.20 -0.79 5.56 1.02 -1.25 -4.98 119.74 117.24 2di7 s LYS 81 Ca -0.09 -0.51 -0.01 0.00 0.02 0.00 0.00 55.97 55.38 2di7 s LYS 81 Cb 0.01 -1.80 0.36 0.00 -0.52 0.00 0.00 37.83 35.88 2di7 s LYS 81 CO 0.13 -2.70 1.93 -0.25 -0.92 0.00 0.00 175.35 173.54 2di7 n ASP 82 N -3.94 7.24 0.00 2.83 8.00 -1.26 -4.45 116.55 124.97 2di7 n ASP 82 Ca 0.17 -3.82 0.00 0.00 0.71 0.00 0.00 54.79 51.84 2di7 n ASP 82 Cb 0.59 -1.00 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 2di7 n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2di7 n GLY 83 N -0.56 0.49 3.72 0.44 0.00 -1.26 -4.20 105.19 103.81 2di7 n GLY 83 Ca 0.53 -0.03 -0.24 0.00 0.00 0.00 0.00 46.02 46.29 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 0.00 4.52 0.34 1.61 0.01 -1.26 -4.43 113.70 114.48 2di7 s SER 84 Ca 0.00 -0.90 0.08 0.00 1.31 0.00 0.00 55.95 56.44 2di7 s SER 84 Cb 0.00 -0.61 -0.04 0.00 0.21 0.00 0.00 66.02 65.58 2di7 s SER 84 CO 0.00 -0.37 0.13 -0.36 0.41 0.00 0.00 173.24 173.05 2di7 s PHE 85 N -2.50 2.70 -0.14 2.43 0.40 -1.21 -3.79 117.98 115.88 2di7 s PHE 85 Ca 0.38 -0.38 0.01 0.00 -0.60 0.00 0.00 56.93 56.34 2di7 s PHE 85 Cb -0.00 -1.61 -0.01 0.00 0.51 0.00 0.00 43.02 41.91 2di7 s PHE 85 CO 0.22 0.36 -0.15 -1.50 0.70 0.00 0.00 175.22 174.85 2di7 s ILE 86 N -2.43 2.75 -0.36 0.64 2.07 0.33 -2.83 121.20 121.37 2di7 s ILE 86 Ca 0.37 -0.76 -0.09 0.00 -1.41 0.00 0.00 60.65 58.77 2di7 s ILE 86 Cb -0.02 -2.15 0.03 0.00 0.13 0.00 0.00 42.46 40.45 2di7 s ILE 86 CO 0.22 0.52 0.16 -0.69 -1.91 0.00 0.00 174.94 173.24 2di7 s VAL 87 N 0.57 4.20 -0.12 4.00 1.01 -1.20 -1.16 120.40 127.69 2di7 s VAL 87 Ca -0.09 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 60.93 2di7 s VAL 87 Cb -0.16 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2di7 s VAL 87 CO 0.04 -0.21 -0.22 0.00 0.00 0.00 0.00 175.10 174.71 2di7 s ARG 88 N 1.48 3.09 0.15 2.72 1.70 -0.83 -4.19 118.95 123.07 2di7 s ARG 88 Ca 0.00 -0.84 0.02 0.00 -0.47 0.00 0.00 55.73 54.44 2di7 s ARG 88 Cb -0.19 -2.40 -0.04 0.00 -0.57 0.00 0.00 34.95 31.74 2di7 s ARG 88 CO 0.05 0.10 -0.04 1.52 -1.08 0.00 0.00 175.30 175.86 2di7 s TYR 89 N 0.54 1.14 -0.01 5.89 -0.85 -1.26 -2.33 117.35 120.46 2di7 s TYR 89 Ca -0.13 -0.94 0.03 0.00 -0.52 0.00 0.00 57.07 55.51 2di7 s TYR 89 Cb -0.17 -0.64 -0.01 0.00 0.38 0.00 0.00 41.96 41.53 2di7 s TYR 89 CO 0.04 -0.13 -0.10 0.50 -1.52 0.00 0.00 175.55 174.34 2di7 s ARG 90 N -3.86 0.82 -0.10 -3.49 3.52 -1.26 -4.84 118.95 109.74 2di7 s ARG 90 Ca 0.19 -0.35 -0.06 0.00 -0.13 0.00 0.00 55.73 55.38 2di7 s ARG 90 Cb 0.05 -0.79 0.04 0.00 -1.56 0.00 0.00 34.95 32.69 2di7 s ARG 90 CO 0.01 0.20 0.24 1.41 -0.81 0.00 0.00 175.30 176.35 2di7 s MET 91 N -0.18 0.23 -0.43 5.12 1.75 -1.26 -4.28 119.30 120.25 2di7 s MET 91 Ca 0.03 0.46 0.06 0.00 -1.25 0.00 0.00 55.69 54.99 2di7 s MET 91 Cb -0.04 -0.04 0.42 0.00 2.84 0.00 0.00 34.83 38.01 2di7 s MET 91 CO -0.00 -0.12 1.10 2.48 -0.65 0.00 0.00 175.02 177.83 2di7 n TYR 92 N 3.83 3.28 -3.86 4.11 4.11 -1.26 -5.04 117.16 122.34 2di7 n TYR 92 Ca -0.21 -3.08 -0.09 0.00 -0.00 0.00 0.00 57.90 54.52 2di7 n TYR 92 Cb 0.55 -0.10 -0.08 0.00 -0.00 0.00 0.00 39.34 39.71 2di7 n TYR 92 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2di7 s ALA 93 N -3.52 -0.25 -0.48 -3.48 0.00 -1.26 -5.08 121.76 107.69 2di7 s ALA 93 Ca 0.47 -0.53 -0.38 0.00 0.00 0.00 0.00 51.96 51.51 2di7 s ALA 93 Cb 0.40 0.42 -0.17 0.00 0.00 0.00 0.00 23.12 23.77 2di7 s ALA 93 CO -0.17 -0.46 1.95 -1.13 0.00 0.00 0.00 175.76 175.95 2di7 n SER 94 N 0.17 0.64 -4.09 0.00 3.41 -1.26 -4.86 113.62 107.63 2di7 n SER 94 Ca -0.16 0.58 -0.36 0.00 -0.26 0.00 0.00 58.87 58.66 2di7 n SER 94 Cb 0.61 -0.81 -0.10 0.00 -0.26 0.00 0.00 64.21 63.66 2di7 n SER 94 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2di7 s TYR 95 N 5.57 3.43 -0.24 7.33 5.04 -1.26 -4.88 117.35 132.35 2di7 s TYR 95 Ca 1.08 -2.68 -0.12 0.00 -2.44 0.00 0.00 57.07 52.91 2di7 s TYR 95 Cb -1.33 -3.19 -0.10 0.00 0.35 0.00 0.00 41.96 37.69 2di7 s TYR 95 CO 0.58 -0.86 -0.31 1.17 -1.34 0.00 0.00 175.55 174.79 2di7 n LYS 96 N 3.68 0.50 -3.78 4.97 4.81 -1.26 -5.01 118.16 122.07 2di7 n LYS 96 Ca 0.06 0.22 -0.14 0.00 -0.87 0.00 0.00 58.31 57.58 2di7 n LYS 96 Cb 0.38 -1.35 -0.15 0.00 0.02 0.00 0.00 35.03 33.93 2di7 n LYS 96 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2di7 s ASN 97 N -7.10 -0.00 0.21 3.14 0.02 -1.26 -4.79 114.94 105.16 2di7 s ASN 97 Ca -0.33 0.12 0.06 0.00 -1.02 0.00 0.00 52.86 51.69 2di7 s ASN 97 Cb 0.12 0.03 -0.05 0.00 0.02 0.00 0.00 41.25 41.37 2di7 s ASN 97 CO 0.42 -0.11 -0.09 -0.76 0.02 0.00 0.00 177.10 176.58 2di7 s LEU 98 N 0.91 2.46 -0.06 0.60 1.43 -1.22 -4.22 118.68 118.58 2di7 s LEU 98 Ca -0.07 -1.10 0.04 0.00 -1.03 0.00 0.00 54.13 51.97 2di7 s LEU 98 Cb -0.10 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 45.61 2di7 s LEU 98 CO -0.03 -0.31 -0.17 -0.75 0.23 0.00 0.00 176.35 175.31 2di7 s LYS 99 N -3.73 1.99 -0.09 1.70 2.20 0.29 -3.31 119.74 118.78 2di7 s LYS 99 Ca 0.24 -0.60 -0.04 0.00 -0.36 0.00 0.00 55.97 55.21 2di7 s LYS 99 Cb 0.02 -1.65 -0.04 0.00 -1.51 0.00 0.00 37.83 34.66 2di7 s LYS 99 CO 0.07 0.17 0.06 0.08 -0.36 0.00 0.00 175.35 175.36 2di7 s VAL 100 N 0.28 4.76 -0.17 4.02 1.01 -1.18 -1.70 120.40 127.42 2di7 s VAL 100 Ca -0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 2di7 s VAL 100 Cb -0.14 -3.04 0.08 0.00 0.00 0.00 0.00 36.38 33.28 2di7 s VAL 100 CO 0.04 0.60 0.18 -1.61 0.00 0.00 0.00 175.10 174.30 2di7 s GLU 101 N -0.98 0.13 -0.15 2.72 2.02 -0.88 -1.56 118.70 120.00 2di7 s GLU 101 Ca 0.14 0.20 0.00 0.00 0.02 0.00 0.00 54.97 55.33 2di7 s GLU 101 Cb -0.12 -1.20 -0.00 0.00 0.10 0.00 0.00 34.13 32.91 2di7 s GLU 101 CO 0.03 -0.60 -0.15 0.42 0.02 0.00 0.00 175.26 174.99 2di7 s ILE 102 N 2.27 2.74 0.14 -1.63 1.09 -1.26 -1.04 121.20 123.51 2di7 s ILE 102 Ca 0.05 -0.75 0.04 0.00 -1.10 0.00 0.00 60.65 58.90 2di7 s ILE 102 Cb -0.15 -2.16 -0.04 0.00 -1.06 0.00 0.00 42.46 39.05 2di7 s ILE 102 CO -0.10 0.51 -0.10 -0.54 -0.10 0.00 0.00 174.94 174.61 2di7 s LYS 103 N 0.77 1.02 -0.20 2.79 1.02 -1.21 -2.91 119.74 121.02 2di7 s LYS 103 Ca -0.06 -1.39 -0.04 0.00 0.02 0.00 0.00 55.97 54.51 2di7 s LYS 103 Cb -0.15 -0.61 0.07 0.00 -0.52 0.00 0.00 37.83 36.61 2di7 s LYS 103 CO 0.01 0.08 0.07 0.12 -0.92 0.00 0.00 175.35 174.71 2di7 s PHE 104 N -3.14 0.65 -1.14 3.18 5.36 0.12 -3.77 117.98 119.25 2di7 s PHE 104 Ca 0.14 -0.69 -0.01 0.00 -0.96 0.00 0.00 56.93 55.42 2di7 s PHE 104 Cb 0.01 -0.92 0.00 0.00 -0.34 0.00 0.00 43.02 41.78 2di7 s PHE 104 CO 0.00 -0.61 0.04 1.04 -1.46 0.00 0.00 175.22 174.23 2di7 n GLN 105 N 5.15 -2.30 -1.44 10.12 6.02 -1.26 -1.63 117.38 132.04 2di7 n GLN 105 Ca -0.07 0.63 0.00 0.00 -0.01 0.00 0.00 57.00 57.55 2di7 n GLN 105 Cb 0.47 -5.25 0.00 0.00 1.02 0.00 0.00 30.24 26.48 2di7 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2di7 n GLY 106 N -0.86 0.92 3.47 1.08 0.00 -1.26 -5.09 105.19 103.46 2di7 n GLY 106 Ca -0.15 -0.39 -0.06 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.84 0.49 0.52 1.61 -0.21 -0.65 -5.15 119.66 113.44 2di7 s GLN 107 Ca 0.00 1.19 -0.22 0.00 0.02 0.00 0.00 55.36 56.35 2di7 s GLN 107 Cb 0.00 0.46 -0.06 0.00 1.00 0.00 0.00 33.01 34.40 2di7 s GLN 107 CO 0.00 -0.20 1.25 0.72 -2.12 0.00 0.00 175.29 174.94 2di7 n HIS 108 N 5.08 1.94 -0.05 0.91 8.25 -1.26 0.16 115.22 130.25 2di7 n HIS 108 Ca -0.14 0.45 -0.05 0.00 -0.26 0.00 0.00 57.72 57.73 2di7 n HIS 108 Cb 0.52 -2.32 -0.07 0.00 1.12 0.00 0.00 29.99 29.24 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 -0.94 0.62 -4.39 1.59 0.31 -1.14 -3.03 118.33 111.36 2di7 n VAL 109 Ca 0.10 -0.37 -0.18 0.00 -0.01 0.00 0.00 64.34 63.88 2di7 n VAL 109 Cb 0.44 -0.77 -0.04 0.00 -0.91 0.00 0.00 33.84 32.55 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 -2.38 0.32 -0.81 3.52 0.00 -1.26 -4.10 120.51 115.80 2di7 n ALA 110 Ca -0.15 -1.37 -0.11 0.00 0.00 0.00 0.00 53.44 51.81 2di7 n ALA 110 Cb 0.79 0.84 -0.13 0.00 0.00 0.00 0.00 19.45 20.95 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 -0.68 1.68 -3.14 0.00 4.76 -1.26 -4.88 118.16 114.65 2di7 n LYS 111 Ca -0.08 -0.86 -0.24 0.00 -2.87 0.00 0.00 58.31 54.25 2di7 n LYS 111 Cb 0.40 -1.94 -0.00 0.00 -1.84 0.00 0.00 35.03 31.64 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 2.24 6.20 1.00 4.39 0.01 -1.26 -4.42 113.70 121.86 2di7 s SER 112 Ca 0.54 0.53 -0.12 0.00 1.31 0.00 0.00 55.95 58.21 2di7 s SER 112 Cb 0.25 -1.99 0.19 0.00 0.21 0.00 0.00 66.02 64.67 2di7 s SER 112 CO -0.00 -0.43 1.09 -2.16 0.41 0.00 0.00 173.24 172.15 2di7 s PRO 113 N -4.46 0.45 -0.14 12.44 0.04 -1.26 -5.03 135.00 137.04 2di7 s PRO 113 Ca 0.43 0.53 0.00 0.00 0.04 0.00 0.00 61.00 62.00 2di7 s PRO 113 Cb -0.10 -1.74 -0.00 0.00 0.04 0.00 0.00 34.50 32.70 2di7 s PRO 113 CO 0.38 -2.72 -0.15 0.71 0.04 0.00 0.00 177.00 175.26 2di7 s TYR 114 N -2.96 2.77 -0.41 0.56 2.02 -0.60 -4.94 117.35 113.78 2di7 s TYR 114 Ca 0.65 -0.94 -0.11 0.00 -0.37 0.00 0.00 57.07 56.31 2di7 s TYR 114 Cb -0.19 -1.86 0.06 0.00 -0.40 0.00 0.00 41.96 39.57 2di7 s TYR 114 CO 0.58 -0.40 0.26 0.42 -1.57 0.00 0.00 175.55 174.83 2di7 s ILE 115 N 0.66 4.48 -0.35 2.71 -1.09 -1.26 -3.12 121.20 123.24 2di7 s ILE 115 Ca -0.08 -1.17 -0.00 0.00 -2.23 0.00 0.00 60.65 57.17 2di7 s ILE 115 Cb -0.16 -3.65 0.09 0.00 -1.58 0.00 0.00 42.46 37.16 2di7 s ILE 115 CO 0.02 -0.42 0.08 -0.76 -1.23 0.00 0.00 174.94 172.63 2di7 s LEU 116 N 1.50 4.60 -0.04 2.97 1.43 -1.21 -4.89 118.68 123.05 2di7 s LEU 116 Ca 0.03 -1.82 0.05 0.00 -1.03 0.00 0.00 54.13 51.36 2di7 s LEU 116 Cb -0.22 -1.72 0.08 0.00 0.03 0.00 0.00 46.19 44.36 2di7 s LEU 116 CO 0.04 -0.39 0.93 2.29 0.23 0.00 0.00 176.35 179.45 2di7 n LYS 117 N 4.49 1.08 -2.68 1.70 0.00 -1.26 -3.38 118.16 118.10 2di7 n LYS 117 Ca -0.04 -1.43 -0.05 0.00 -0.00 0.00 0.00 58.31 56.78 2di7 n LYS 117 Cb 0.42 -0.89 -0.04 0.00 -0.00 0.00 0.00 35.03 34.52 2di7 n LYS 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2di7 n GLY 118 N -0.51 -4.41 2.74 2.58 0.00 -1.26 -5.01 105.19 99.33 2di7 n GLY 118 Ca 0.04 1.52 -0.26 0.00 0.00 0.00 0.00 46.02 47.32 2di7 n GLY 118 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2di7 s SER 119 N -0.55 2.41 0.00 1.61 0.15 -1.26 -5.08 113.70 110.98 2di7 s SER 119 Ca -0.24 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 55.86 2di7 s SER 119 Cb 0.02 -0.53 0.00 0.00 -1.71 0.00 0.00 66.02 63.80 2di7 s SER 119 CO 0.65 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.44 2di7 n GLY 120 N 5.09 2.73 3.67 9.45 0.00 -1.26 -5.01 105.19 119.86 2di7 n GLY 120 Ca -0.08 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 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 -4.39 4.22 -0.13 1.61 0.04 -1.26 -5.01 135.00 130.08 2di7 s PRO 121 Ca 0.00 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.06 2di7 s PRO 121 Cb 0.00 -3.79 0.02 0.00 0.04 0.00 0.00 34.50 30.77 2di7 s PRO 121 CO 0.00 -0.73 -0.11 0.45 0.04 0.00 0.00 177.00 176.65 2di7 s SER 122 N 2.56 2.42 -0.26 6.66 0.15 -1.26 -5.11 113.70 118.86 2di7 s SER 122 Ca 0.66 -0.40 -0.07 0.00 0.70 0.00 0.00 55.95 56.85 2di7 s SER 122 Cb -0.31 -1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 62.98 2di7 s SER 122 CO 0.25 -0.08 0.05 -0.44 1.20 0.00 0.00 173.24 174.23 2di7 s SER 123 N 1.55 4.98 0.00 5.45 0.01 -1.26 -4.95 113.70 119.48 2di7 s SER 123 Ca 0.04 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2di7 s SER 123 Cb -0.13 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 64.22 2di7 s SER 123 CO -0.09 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.10