#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 0.77 -0.30 1.61 0.15 -1.26 -5.04 113.70 109.63 2di7 s SER 2 Ca 0.00 -0.12 -0.06 0.00 0.70 0.00 0.00 55.95 56.47 2di7 s SER 2 Cb 0.00 -0.08 0.18 0.00 -1.71 0.00 0.00 66.02 64.41 2di7 s SER 2 CO 0.00 0.08 0.79 -0.94 1.20 0.00 0.00 173.24 174.36 2di7 s SER 3 N -0.17 -1.01 -0.31 5.45 1.04 -1.26 -5.12 113.70 112.31 2di7 s SER 3 Ca 0.02 0.60 -0.09 0.00 0.48 0.00 0.00 55.95 56.96 2di7 s SER 3 Cb -0.03 1.83 0.19 0.00 0.10 0.00 0.00 66.02 68.12 2di7 s SER 3 CO -0.00 -0.19 1.02 -0.83 0.98 0.00 0.00 173.24 174.21 2di7 s GLY 4 N 2.90 -1.17 0.67 7.32 0.00 -1.26 -5.16 107.32 110.62 2di7 s GLY 4 Ca 0.12 1.71 -0.17 0.00 0.00 0.00 0.00 44.72 46.38 2di7 s GLY 4 CO -0.17 4.15 1.09 -1.26 0.00 0.00 0.00 173.10 176.90 2di7 n SER 5 N 4.60 1.12 -4.79 1.64 2.88 -1.26 -4.96 113.62 112.85 2di7 n SER 5 Ca 0.08 0.76 -0.36 0.00 -1.33 0.00 0.00 58.87 58.02 2di7 n SER 5 Cb 0.60 -1.46 -0.06 0.00 -0.75 0.00 0.00 64.21 62.54 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 -1.46 7.00 -0.01 -3.46 0.15 -1.26 -5.00 113.70 109.66 2di7 s SER 6 Ca 0.78 1.86 -0.23 0.00 0.70 0.00 0.00 55.95 59.05 2di7 s SER 6 Cb -0.38 -2.57 -0.15 0.00 -1.71 0.00 0.00 66.02 61.21 2di7 s SER 6 CO 0.46 -0.31 1.07 1.23 1.20 0.00 0.00 173.24 176.89 2di7 h GLY 7 N 2.53 -0.43 -2.55 9.45 0.00 -2.07 -3.46 103.07 106.54 2di7 h GLY 7 Ca -0.48 0.16 -0.45 0.00 0.00 0.00 0.00 47.33 46.56 2di7 h GLY 7 CO 0.63 -0.16 -0.34 -0.54 0.00 0.00 0.00 176.54 176.14 2di7 s GLU 8 N -4.21 2.88 -0.20 4.80 2.02 -1.26 -5.11 118.70 117.63 2di7 s GLU 8 Ca -0.13 -1.20 -0.06 0.00 0.02 0.00 0.00 54.97 53.60 2di7 s GLU 8 Cb 0.02 -2.69 -0.03 0.00 0.10 0.00 0.00 34.13 31.53 2di7 s GLU 8 CO 0.49 -0.08 0.03 -0.08 0.02 0.00 0.00 175.26 175.64 2di7 s THR 9 N -2.29 4.24 -0.06 3.63 -1.32 -1.26 -5.09 115.64 113.49 2di7 s THR 9 Ca 0.48 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.75 2di7 s THR 9 Cb -0.08 -2.92 0.02 0.00 -1.51 0.00 0.00 72.50 68.01 2di7 s THR 9 CO 0.31 0.43 -0.04 -0.83 -2.21 0.00 0.00 174.62 172.27 2di7 s GLY 10 N 0.88 0.50 0.25 6.08 0.00 -1.26 -5.03 107.32 108.73 2di7 s GLY 10 Ca 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 44.72 44.59 2di7 s GLY 10 CO 0.02 0.62 1.74 -1.33 0.00 0.00 0.00 173.10 174.15 2di7 h GLY 11 N 7.52 0.90 -1.73 0.20 0.00 -2.09 -3.45 103.07 104.43 2di7 h GLY 11 Ca -0.33 -0.62 -0.48 0.00 0.00 0.00 0.00 47.33 45.91 2di7 h GLY 11 CO 0.42 0.57 -1.21 -1.84 0.00 0.00 0.00 176.54 174.47 2di7 n GLU 12 N -4.21 -1.02 -0.58 4.80 0.28 -1.26 -4.92 120.64 113.74 2di7 n GLU 12 Ca 0.03 -0.28 -0.25 0.00 -0.16 0.00 0.00 57.16 56.49 2di7 n GLU 12 Cb 0.31 -1.61 0.16 0.00 1.43 0.00 0.00 31.44 31.73 2di7 n GLU 12 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2di7 n ARG 13 N -1.18 -2.11 -3.92 3.44 1.74 -1.26 -4.99 116.66 108.37 2di7 n ARG 13 Ca 0.02 -0.62 -0.30 0.00 -0.77 0.00 0.00 57.85 56.18 2di7 n ARG 13 Cb 0.62 -1.58 -0.15 0.00 -1.02 0.00 0.00 32.46 30.32 2di7 n ARG 13 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2di7 s GLN 14 N -3.51 1.49 -0.20 5.56 -0.21 -1.26 -5.05 119.66 116.48 2di7 s GLN 14 Ca 0.46 -1.10 -0.41 0.00 0.02 0.00 0.00 55.36 54.33 2di7 s GLN 14 Cb -0.08 -2.59 -0.18 0.00 1.00 0.00 0.00 33.01 31.16 2di7 s GLN 14 CO 0.49 -0.68 1.47 -0.11 -2.12 0.00 0.00 175.29 174.33 2di7 n LEU 15 N 4.65 1.36 -4.15 2.90 7.94 -1.26 -2.97 117.00 125.47 2di7 n LEU 15 Ca -0.09 1.14 -0.35 0.00 -1.11 0.00 0.00 56.01 55.59 2di7 n LEU 15 Cb 0.44 -1.03 -0.13 0.00 0.53 0.00 0.00 43.42 43.23 2di7 n LEU 15 CO 0.18 -1.01 -0.28 -0.55 -1.11 0.00 0.00 177.39 174.62 2di7 s SER 16 N 1.94 5.04 0.20 1.96 0.15 0.11 -4.80 113.70 118.31 2di7 s SER 16 Ca 0.96 -1.62 -0.03 0.00 0.70 0.00 0.00 55.95 55.95 2di7 s SER 16 Cb -1.21 -1.76 0.16 0.00 -1.71 0.00 0.00 66.02 61.50 2di7 s SER 16 CO 0.64 -0.38 1.56 1.55 1.20 0.00 0.00 173.24 177.81 2di7 h PRO 17 N 8.00 0.63 -0.60 5.44 0.13 -1.88 -2.38 132.00 141.34 2di7 h PRO 17 Ca -0.17 -0.33 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2di7 h PRO 17 Cb 1.05 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 2di7 h PRO 17 CO 0.60 0.93 0.20 1.05 -0.23 0.00 0.00 178.00 180.56 2di7 h GLU 18 N 0.51 0.93 -0.32 0.86 4.11 -1.72 -3.01 114.58 115.94 2di7 h GLU 18 Ca 0.04 -0.19 -0.09 0.00 0.07 0.00 0.00 59.36 59.19 2di7 h GLU 18 Cb 0.94 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2di7 h GLU 18 CO 0.08 0.82 -0.16 0.87 0.07 0.00 0.00 179.01 180.69 2di7 h LYS 19 N 0.85 0.68 -4.50 1.06 1.79 -1.80 -3.46 116.57 111.19 2di7 h LYS 19 Ca 0.20 -0.30 -0.46 0.00 -2.18 0.00 0.00 60.65 57.90 2di7 h LYS 19 Cb 0.26 -0.02 0.12 0.00 -1.58 0.00 0.00 32.23 31.02 2di7 h LYS 19 CO -0.01 0.89 -0.73 0.43 -1.08 0.00 0.00 179.45 178.95 2di7 n SER 20 N -4.36 -2.24 -4.13 0.86 7.64 -0.90 -4.85 113.62 105.64 2di7 n SER 20 Ca -0.03 0.59 -0.33 0.00 1.01 0.00 0.00 58.87 60.11 2di7 n SER 20 Cb 0.39 -0.66 -0.16 0.00 -1.01 0.00 0.00 64.21 62.77 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 -0.75 3.02 -0.23 1.43 0.41 -1.18 -4.83 118.70 116.57 2di7 s GLU 21 Ca 0.44 -0.81 -0.07 0.00 -0.41 0.00 0.00 54.97 54.12 2di7 s GLU 21 Cb -0.46 -2.60 -0.03 0.00 -1.78 0.00 0.00 34.13 29.26 2di7 s GLU 21 CO 0.47 -0.21 0.05 0.42 -0.49 0.00 0.00 175.26 175.50 2di7 s ILE 22 N 1.30 4.24 0.31 -1.63 1.01 -1.26 -3.64 121.20 121.53 2di7 s ILE 22 Ca 0.05 -0.20 0.09 0.00 0.00 0.00 0.00 60.65 60.58 2di7 s ILE 22 Cb -0.13 -2.96 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 2di7 s ILE 22 CO -0.12 0.37 -0.10 -1.66 0.00 0.00 0.00 174.94 173.44 2di7 s TRP 23 N 1.35 2.18 0.00 3.97 -2.14 -1.26 -5.10 118.94 117.94 2di7 s TRP 23 Ca 0.05 -0.56 0.00 0.00 2.66 0.00 0.00 56.10 58.25 2di7 s TRP 23 Cb -0.15 -1.21 0.00 0.00 -3.10 0.00 0.00 33.47 29.02 2di7 s TRP 23 CO 0.03 0.47 0.00 0.41 -2.66 0.00 0.00 176.95 175.20 2di7 n GLY 24 N -0.67 3.71 0.19 3.67 0.00 -1.26 -3.90 105.19 106.93 2di7 n GLY 24 Ca -0.05 -0.88 -0.03 0.00 0.00 0.00 0.00 46.02 45.06 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 0.22 -1.53 1.61 0.13 -1.96 -3.21 132.00 127.25 2di7 h PRO 25 Ca 0.00 -0.12 0.47 0.00 -0.87 0.00 0.00 66.00 65.48 2di7 h PRO 25 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 2di7 h PRO 25 CO 0.00 0.65 1.06 0.41 -0.23 0.00 0.00 178.00 179.89 2di7 n GLY 26 N -0.07 -0.82 0.12 1.56 0.00 -1.26 0.16 105.19 104.89 2di7 n GLY 26 Ca -0.02 0.64 -0.21 0.00 0.00 0.00 0.00 46.02 46.43 2di7 n GLY 26 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2di7 h LEU 27 N 0.00 0.52 -9.37 0.99 3.38 -1.97 -3.47 115.31 105.39 2di7 h LEU 27 Ca 0.81 -0.92 -0.50 0.00 0.09 0.00 0.00 57.88 57.36 2di7 h LEU 27 Cb 3.00 -0.17 0.24 0.00 0.09 0.00 0.00 40.66 43.82 2di7 h LEU 27 CO -0.18 1.53 -1.65 0.29 0.09 0.00 0.00 178.44 178.52 2di7 n LYS 28 N -3.97 -0.61 0.00 1.13 4.76 0.42 -4.94 118.16 114.94 2di7 n LYS 28 Ca -0.18 -0.17 0.00 0.00 -2.87 0.00 0.00 58.31 55.10 2di7 n LYS 28 Cb 0.91 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 2di7 n LYS 28 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2di7 n ALA 29 N -3.67 -0.28 -2.10 7.82 0.00 -1.26 -4.23 120.51 116.79 2di7 n ALA 29 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 2di7 n ALA 29 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.04 2di7 n ALA 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2di7 s ASP 30 N -2.17 5.19 0.74 0.00 1.01 -1.26 -4.93 116.67 115.24 2di7 s ASP 30 Ca 0.00 -1.40 -0.03 0.00 0.71 0.00 0.00 52.55 51.84 2di7 s ASP 30 Cb 0.00 -2.58 0.13 0.00 1.01 0.00 0.00 42.92 41.48 2di7 s ASP 30 CO 0.00 -2.85 0.89 1.33 0.21 0.00 0.00 175.17 174.75 2di7 n VAL 31 N 7.74 0.00 -1.13 -1.27 0.24 -1.26 -5.01 118.33 117.64 2di7 n VAL 31 Ca 0.43 -1.23 -0.30 0.00 -2.04 0.00 0.00 64.34 61.20 2di7 n VAL 31 Cb 0.47 -1.08 0.15 0.00 -1.47 0.00 0.00 33.84 31.90 2di7 n VAL 31 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2di7 s VAL 32 N -2.71 2.59 -0.04 3.34 -7.23 -1.26 -5.02 120.40 110.06 2di7 s VAL 32 Ca 0.57 0.19 -0.02 0.00 -1.81 0.00 0.00 61.98 60.91 2di7 s VAL 32 Cb -0.03 -2.62 -0.01 0.00 0.56 0.00 0.00 36.38 34.28 2di7 s VAL 32 CO 0.38 -0.25 0.13 -0.07 -0.31 0.00 0.00 175.10 174.98 2di7 h LEU 33 N -1.64 -0.06 0.00 1.32 3.38 -1.99 -3.45 115.31 112.88 2di7 h LEU 33 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2di7 h LEU 33 Cb 1.29 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2di7 h LEU 33 CO 0.53 0.19 0.00 -0.81 0.09 0.00 0.00 178.44 178.44 2di7 n PRO 34 N -3.47 0.00 -4.34 1.13 -0.04 -1.26 -4.89 135.00 122.13 2di7 n PRO 34 Ca -0.01 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.27 2di7 n PRO 34 Cb 0.03 -0.23 -0.10 0.00 -0.04 0.00 0.00 33.50 33.16 2di7 n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2di7 s ALA 35 N -2.97 1.97 0.32 0.55 0.00 -1.26 -4.91 121.76 115.47 2di7 s ALA 35 Ca 0.00 -1.65 0.09 0.00 0.00 0.00 0.00 51.96 50.40 2di7 s ALA 35 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 2di7 s ALA 35 CO 0.00 0.05 0.05 -0.98 0.00 0.00 0.00 175.76 174.87 2di7 s ARG 36 N -3.66 2.21 -0.02 0.00 1.04 -1.26 -4.81 118.95 112.45 2di7 s ARG 36 Ca 0.22 -1.62 0.00 0.00 -1.04 0.00 0.00 55.73 53.30 2di7 s ARG 36 Cb -0.00 -2.05 0.03 0.00 -2.04 0.00 0.00 34.95 30.88 2di7 s ARG 36 CO 0.06 0.18 0.02 1.52 -0.04 0.00 0.00 175.30 177.04 2di7 s TYR 37 N -2.45 0.11 0.12 5.89 -0.85 -1.26 -4.56 117.35 114.34 2di7 s TYR 37 Ca 0.35 0.08 0.02 0.00 -0.52 0.00 0.00 57.07 56.99 2di7 s TYR 37 Cb -0.02 -0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.02 2di7 s TYR 37 CO 0.20 -0.09 -0.04 -0.59 -1.52 0.00 0.00 175.55 173.52 2di7 s PHE 38 N 0.92 0.98 0.24 -3.49 -0.12 -1.24 -4.74 117.98 110.52 2di7 s PHE 38 Ca -0.08 -0.96 0.06 0.00 -0.05 0.00 0.00 56.93 55.89 2di7 s PHE 38 Cb -0.12 -0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 41.68 2di7 s PHE 38 CO -0.02 -0.19 0.25 0.71 -0.05 0.00 0.00 175.22 175.92 2di7 s TYR 39 N -3.66 3.25 -0.29 3.49 2.02 -1.25 -2.50 117.35 118.40 2di7 s TYR 39 Ca 0.16 -0.06 0.01 0.00 -0.37 0.00 0.00 57.07 56.81 2di7 s TYR 39 Cb 0.06 -1.48 0.09 0.00 -0.40 0.00 0.00 41.96 40.22 2di7 s TYR 39 CO -0.02 0.49 0.03 0.42 -1.57 0.00 0.00 175.55 174.90 2di7 s ILE 40 N -2.04 1.51 -0.10 2.71 1.01 -1.01 -4.09 121.20 119.19 2di7 s ILE 40 Ca 0.33 -1.60 -0.20 0.00 0.00 0.00 0.00 60.65 59.18 2di7 s ILE 40 Cb -0.09 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 2di7 s ILE 40 CO 0.26 -0.44 0.56 -1.58 0.00 0.00 0.00 174.94 173.74 2di7 s GLN 41 N 1.33 4.38 0.11 2.79 2.00 -1.24 -3.77 119.66 125.27 2di7 s GLN 41 Ca 0.04 0.61 -0.17 0.00 -2.00 0.00 0.00 55.36 53.85 2di7 s GLN 41 Cb -0.18 -3.44 -0.07 0.00 0.80 0.00 0.00 33.01 30.12 2di7 s GLN 41 CO -0.13 0.12 0.56 0.00 -0.50 0.00 0.00 175.29 175.34 2di7 s ALA 42 N 0.70 3.58 0.02 1.58 0.00 -1.26 -3.11 121.76 123.27 2di7 s ALA 42 Ca 0.30 -0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2di7 s ALA 42 Cb -0.16 -2.57 -0.01 0.00 0.00 0.00 0.00 23.12 20.37 2di7 s ALA 42 CO 0.13 0.43 -0.07 0.08 0.00 0.00 0.00 175.76 176.33 2di7 s VAL 43 N -1.31 0.56 1.02 0.00 1.01 -1.25 -2.35 120.40 118.07 2di7 s VAL 43 Ca 0.34 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 2di7 s VAL 43 Cb -0.17 -0.54 0.20 0.00 0.00 0.00 0.00 36.38 35.87 2di7 s VAL 43 CO 0.19 -0.10 1.15 -0.62 0.00 0.00 0.00 175.10 175.73 2di7 s ASP 44 N -0.84 2.55 0.45 3.32 2.15 -1.17 0.07 116.67 123.20 2di7 s ASP 44 Ca -0.03 0.79 0.31 0.00 0.43 0.00 0.00 52.55 54.05 2di7 s ASP 44 Cb -0.06 -1.19 1.55 0.00 -0.30 0.00 0.00 42.92 42.91 2di7 s ASP 44 CO 0.00 -3.13 1.94 0.71 -0.17 0.00 0.00 175.17 174.52 2di7 h THR 45 N -1.90 0.00 0.00 1.71 1.35 -1.84 -3.02 112.91 109.21 2di7 h THR 45 Ca -0.49 -0.14 -0.38 0.00 -0.55 0.00 0.00 66.41 64.85 2di7 h THR 45 Cb 1.31 0.92 -0.06 0.00 -1.73 0.00 0.00 68.15 68.59 2di7 h THR 45 CO 0.50 0.00 -2.08 -1.20 -0.25 0.00 0.00 175.52 172.48 2di7 n SER 46 N -2.65 1.93 0.00 5.36 7.64 -1.26 -5.02 113.62 119.62 2di7 n SER 46 Ca -0.01 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2di7 n SER 46 Cb 0.13 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 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 1.40 0.09 3.21 0.23 0.00 -1.14 -5.13 105.19 103.85 2di7 n GLY 47 Ca -0.46 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 2di7 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2di7 s ASN 48 N -0.11 5.31 0.10 1.61 2.20 -1.26 -4.85 114.94 117.94 2di7 s ASN 48 Ca 0.00 -1.50 -0.36 0.00 -0.94 0.00 0.00 52.86 50.06 2di7 s ASN 48 Cb 0.00 -1.86 -0.17 0.00 -2.00 0.00 0.00 41.25 37.22 2di7 s ASN 48 CO 0.00 -0.43 1.15 0.29 -2.94 0.00 0.00 177.10 175.17 2di7 n LYS 49 N 4.75 0.76 -0.08 3.55 4.01 -1.26 -3.05 118.16 126.83 2di7 n LYS 49 Ca -0.09 0.27 -0.04 0.00 -0.51 0.00 0.00 58.31 57.94 2di7 n LYS 49 Cb 0.43 -1.78 0.17 0.00 -0.51 0.00 0.00 35.03 33.33 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 3.49 0.79 -3.63 2.13 -1.00 -1.83 -3.46 116.94 113.43 2di7 h PHE 50 Ca -0.46 -0.12 -0.04 0.00 2.81 0.00 0.00 57.97 60.16 2di7 h PHE 50 Cb 1.37 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.71 2di7 h PHE 50 CO 0.56 0.77 -0.05 0.25 -1.61 0.00 0.00 178.31 178.23 2di7 n THR 51 N -4.20 -0.06 -4.44 -1.55 -2.24 -1.26 -4.84 114.28 95.68 2di7 n THR 51 Ca 0.02 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.58 2di7 n THR 51 Cb 0.32 -0.27 -0.09 0.00 -2.10 0.00 0.00 70.33 68.18 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 -1.68 2.24 -0.41 3.42 0.01 -1.26 -4.25 113.70 111.76 2di7 s SER 52 Ca 0.00 -1.52 -0.19 0.00 1.31 0.00 0.00 55.95 55.56 2di7 s SER 52 Cb 0.00 0.24 0.02 0.00 0.21 0.00 0.00 66.02 66.49 2di7 s SER 52 CO 0.00 -0.79 0.54 -0.55 0.41 0.00 0.00 173.24 172.85 2di7 s SER 53 N -3.49 6.27 0.02 2.44 0.15 -1.23 -3.75 113.70 114.11 2di7 s SER 53 Ca 0.32 -0.41 -0.22 0.00 0.70 0.00 0.00 55.95 56.34 2di7 s SER 53 Cb 0.06 -2.27 -0.17 0.00 -1.71 0.00 0.00 66.02 61.93 2di7 s SER 53 CO 0.15 -0.65 1.32 1.55 1.20 0.00 0.00 173.24 176.81 2di7 h PRO 54 N 8.74 0.22 0.00 5.44 0.13 -2.00 -3.50 132.00 141.04 2di7 h PRO 54 Ca -0.26 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 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 0.83 0.64 0.00 0.41 -0.23 0.00 0.00 178.00 179.65 2di7 n GLY 55 N 0.21 -0.24 1.08 1.56 0.00 -1.26 -5.06 105.19 101.47 2di7 n GLY 55 Ca -0.07 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2di7 n GLY 55 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2di7 n GLU 56 N 0.00 0.00 -3.71 1.61 2.13 -1.26 -4.97 120.64 114.44 2di7 n GLU 56 Ca 0.00 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.54 2di7 n GLU 56 Cb 0.00 -0.48 -0.12 0.00 0.27 0.00 0.00 31.44 31.11 2di7 n GLU 56 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2di7 s LYS 57 N -2.00 1.72 -0.02 5.31 -0.14 -1.26 -4.87 119.74 118.48 2di7 s LYS 57 Ca 0.00 -2.64 0.14 0.00 -1.36 0.00 0.00 55.97 52.11 2di7 s LYS 57 Cb 0.00 -2.59 -0.21 0.00 -1.68 0.00 0.00 37.83 33.35 2di7 s LYS 57 CO 0.00 -1.28 0.31 1.33 -0.76 0.00 0.00 175.35 174.95 2di7 n VAL 58 N 2.65 0.00 -4.24 3.17 0.24 -1.26 -4.93 118.33 113.96 2di7 n VAL 58 Ca 0.19 -0.31 -0.33 0.00 -2.04 0.00 0.00 64.34 61.85 2di7 n VAL 58 Cb 0.38 0.20 -0.16 0.00 -1.47 0.00 0.00 33.84 32.79 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 -2.95 2.76 0.11 6.34 0.08 -1.26 -4.73 117.98 118.33 2di7 s PHE 59 Ca -0.05 -1.56 0.06 0.00 0.12 0.00 0.00 56.93 55.50 2di7 s PHE 59 Cb 0.09 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.60 2di7 s PHE 59 CO 0.58 -0.76 -0.04 -1.14 -0.10 0.00 0.00 175.22 173.76 2di7 s GLN 60 N 1.19 2.34 -0.04 0.44 0.74 -1.17 -4.94 119.66 118.21 2di7 s GLN 60 Ca 0.02 -0.96 0.01 0.00 0.05 0.00 0.00 55.36 54.48 2di7 s GLN 60 Cb -0.14 -2.41 0.02 0.00 1.10 0.00 0.00 33.01 31.59 2di7 s GLN 60 CO -0.10 0.51 -0.03 0.08 -0.55 0.00 0.00 175.29 175.20 2di7 s VAL 61 N -1.34 0.46 0.08 1.34 1.01 -1.26 -2.68 120.40 118.01 2di7 s VAL 61 Ca 0.24 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 62.21 2di7 s VAL 61 Cb -0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2di7 s VAL 61 CO 0.16 0.21 -0.07 -0.75 0.00 0.00 0.00 175.10 174.66 2di7 s LYS 62 N 1.01 2.31 0.05 2.72 2.47 0.10 -4.83 119.74 123.57 2di7 s LYS 62 Ca -0.10 -0.92 0.06 0.00 -1.56 0.00 0.00 55.97 53.45 2di7 s LYS 62 Cb -0.14 -2.40 -0.02 0.00 -1.46 0.00 0.00 37.83 33.80 2di7 s LYS 62 CO -0.01 0.53 -0.17 0.08 0.16 0.00 0.00 175.35 175.95 2di7 s VAL 63 N -1.20 1.33 0.09 4.02 1.01 -1.26 -1.05 120.40 123.34 2di7 s VAL 63 Ca 0.22 -1.14 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 2di7 s VAL 63 Cb -0.11 -1.19 0.05 0.00 0.00 0.00 0.00 36.38 35.13 2di7 s VAL 63 CO 0.14 0.04 0.53 -0.55 0.00 0.00 0.00 175.10 175.25 2di7 s SER 64 N -1.28 -0.44 0.08 3.32 0.15 -1.11 -4.96 113.70 109.45 2di7 s SER 64 Ca 0.03 0.04 -0.15 0.00 0.70 0.00 0.00 55.95 56.57 2di7 s SER 64 Cb -0.08 0.52 -0.06 0.00 -1.71 0.00 0.00 66.02 64.68 2di7 s SER 64 CO 0.02 -0.82 0.50 0.00 1.20 0.00 0.00 173.24 174.14 2di7 s ALA 65 N -3.09 3.63 0.03 5.45 0.00 -1.26 -0.95 121.76 125.57 2di7 s ALA 65 Ca -0.02 -0.13 -0.21 0.00 0.00 0.00 0.00 51.96 51.60 2di7 s ALA 65 Cb -0.00 -2.50 -0.15 0.00 0.00 0.00 0.00 23.12 20.47 2di7 s ALA 65 CO -0.07 0.46 1.33 -1.00 0.00 0.00 0.00 175.76 176.48 2di7 h PRO 66 N 4.16 0.30 0.00 0.00 0.13 -1.91 -3.40 132.00 131.28 2di7 h PRO 66 Ca -0.50 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2di7 h PRO 66 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2di7 h PRO 66 CO 0.64 0.70 -0.60 -1.91 -0.23 0.00 0.00 178.00 176.60 2di7 n GLU 67 N -4.61 0.39 -1.15 0.86 4.07 -1.26 -4.98 120.64 113.96 2di7 n GLU 67 Ca -0.07 0.32 -0.36 0.00 -0.06 0.00 0.00 57.16 56.99 2di7 n GLU 67 Cb 0.34 -1.37 0.06 0.00 -0.06 0.00 0.00 31.44 30.42 2di7 n GLU 67 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2di7 n GLU 68 N -4.09 0.13 -0.04 5.31 1.02 -1.26 -4.93 120.64 116.77 2di7 n GLU 68 Ca -0.08 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2di7 n GLU 68 Cb 0.31 -1.60 -0.13 0.00 -0.02 0.00 0.00 31.44 30.00 2di7 n GLU 68 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2di7 n GLN 69 N -0.09 0.94 -4.63 3.49 0.00 -1.26 -4.60 117.38 111.23 2di7 n GLN 69 Ca 0.07 -0.08 -0.33 0.00 0.00 0.00 0.00 57.00 56.66 2di7 n GLN 69 Cb 0.51 -1.42 -0.14 0.00 0.00 0.00 0.00 30.24 29.19 2di7 n GLN 69 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2di7 s PHE 70 N -2.80 2.84 -0.04 2.61 0.08 -1.26 -4.99 117.98 114.42 2di7 s PHE 70 Ca -0.07 -0.68 -0.01 0.00 0.12 0.00 0.00 56.93 56.29 2di7 s PHE 70 Cb 0.08 -1.88 0.03 0.00 -0.57 0.00 0.00 43.02 40.68 2di7 s PHE 70 CO 0.70 -0.25 0.06 0.99 -0.10 0.00 0.00 175.22 176.61 2di7 s THR 71 N 0.51 -0.09 -0.45 0.64 2.01 -1.26 -4.94 115.64 112.05 2di7 s THR 71 Ca -0.08 0.30 -0.03 0.00 0.31 0.00 0.00 61.69 62.18 2di7 s THR 71 Cb -0.16 -0.13 0.12 0.00 0.01 0.00 0.00 72.50 72.34 2di7 s THR 71 CO 0.04 0.12 0.25 -0.60 -0.69 0.00 0.00 174.62 173.74 2di7 s ARG 72 N 1.55 2.12 0.01 4.92 3.52 -1.26 -5.04 118.95 124.76 2di7 s ARG 72 Ca -0.03 -1.93 0.01 0.00 -0.13 0.00 0.00 55.73 53.66 2di7 s ARG 72 Cb -0.12 -3.63 -0.01 0.00 -1.56 0.00 0.00 34.95 29.63 2di7 s ARG 72 CO -0.03 -1.10 -0.05 0.08 -0.81 0.00 0.00 175.30 173.39 2di7 s VAL 73 N 0.97 0.38 -0.53 7.11 1.01 -1.26 -4.92 120.40 123.17 2di7 s VAL 73 Ca 0.09 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.74 2di7 s VAL 73 Cb -0.23 -0.36 0.13 0.00 0.00 0.00 0.00 36.38 35.93 2di7 s VAL 73 CO -0.04 -0.00 0.27 -0.83 0.00 0.00 0.00 175.10 174.50 2di7 s GLY 74 N -0.41 2.46 0.19 4.51 0.00 -1.26 -5.00 107.32 107.81 2di7 s GLY 74 Ca -0.01 -3.29 -0.30 0.00 0.00 0.00 0.00 44.72 41.13 2di7 s GLY 74 CO -0.00 1.02 0.95 0.14 0.00 0.00 0.00 173.10 175.20 2di7 s VAL 75 N -0.30 4.24 0.03 1.40 1.01 -1.26 -4.09 120.40 121.43 2di7 s VAL 75 Ca 0.17 2.08 0.02 0.00 0.00 0.00 0.00 61.98 64.24 2di7 s VAL 75 Cb -0.25 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.78 2di7 s VAL 75 CO -0.00 0.43 -0.06 -1.58 0.00 0.00 0.00 175.10 173.88 2di7 s GLN 76 N -0.72 0.46 -0.04 2.72 -0.44 -0.45 -5.00 119.66 116.19 2di7 s GLN 76 Ca 0.43 -0.57 0.05 0.00 -2.50 0.00 0.00 55.36 52.77 2di7 s GLN 76 Cb -0.25 -0.27 -0.03 0.00 -1.64 0.00 0.00 33.01 30.82 2di7 s GLN 76 CO 0.31 0.05 -0.16 0.08 0.50 0.00 0.00 175.29 176.07 2di7 s VAL 77 N -1.01 2.89 0.18 1.34 1.01 -1.26 -2.29 120.40 121.26 2di7 s VAL 77 Ca -0.07 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.13 2di7 s VAL 77 Cb -0.08 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 2di7 s VAL 77 CO 0.00 0.56 -0.07 -0.76 0.00 0.00 0.00 175.10 174.83 2di7 s LEU 78 N -0.79 2.42 -0.57 3.92 1.43 -0.84 -5.00 118.68 119.25 2di7 s LEU 78 Ca 0.12 -1.09 -0.18 0.00 -1.03 0.00 0.00 54.13 51.95 2di7 s LEU 78 Cb -0.10 -0.36 0.10 0.00 0.03 0.00 0.00 46.19 45.86 2di7 s LEU 78 CO 0.01 -0.38 0.65 -0.62 0.23 0.00 0.00 176.35 176.23 2di7 s ASP 79 N -3.24 6.19 -0.19 2.29 2.15 -1.26 -2.36 116.67 120.25 2di7 s ASP 79 Ca 0.22 -1.44 -0.15 0.00 0.43 0.00 0.00 52.55 51.60 2di7 s ASP 79 Cb 0.03 -2.28 -0.08 0.00 -0.30 0.00 0.00 42.92 40.30 2di7 s ASP 79 CO 0.04 -1.03 -0.25 0.54 -0.17 0.00 0.00 175.17 174.31 2di7 n ARG 80 N 6.07 0.52 -2.58 4.34 5.12 -1.25 -5.02 116.66 123.87 2di7 n ARG 80 Ca -0.10 0.34 -0.14 0.00 -1.93 0.00 0.00 57.85 56.02 2di7 n ARG 80 Cb 0.42 -1.55 0.03 0.00 -1.16 0.00 0.00 32.46 30.21 2di7 n ARG 80 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2di7 n LYS 81 N -4.46 0.81 0.14 5.56 5.02 -1.16 -5.06 118.16 119.01 2di7 n LYS 81 Ca -0.22 -2.16 -0.06 0.00 -2.02 0.00 0.00 58.31 53.85 2di7 n LYS 81 Cb 0.54 -0.02 -0.03 0.00 -0.02 0.00 0.00 35.03 35.50 2di7 n LYS 81 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2di7 h ASP 82 N 0.20 -0.35 -1.05 4.39 3.58 -1.91 -3.36 116.42 117.92 2di7 h ASP 82 Ca -0.20 0.01 -0.65 0.00 0.42 0.00 0.00 57.03 56.62 2di7 h ASP 82 Cb 0.84 0.09 -0.34 0.00 1.72 0.00 0.00 39.33 41.64 2di7 h ASP 82 CO 0.30 -0.05 0.32 0.61 -2.88 0.00 0.00 179.24 177.54 2di7 n GLY 83 N 0.43 6.01 3.43 -0.78 0.00 -1.25 -3.53 105.19 109.51 2di7 n GLY 83 Ca -0.05 -2.45 -0.15 0.00 0.00 0.00 0.00 46.02 43.37 2di7 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di7 s SER 84 N -2.36 -0.52 0.03 1.61 0.01 -1.26 -4.18 113.70 107.03 2di7 s SER 84 Ca 0.59 0.79 0.06 0.00 1.31 0.00 0.00 55.95 58.70 2di7 s SER 84 Cb 0.47 0.80 -0.02 0.00 0.21 0.00 0.00 66.02 67.48 2di7 s SER 84 CO -0.04 -0.36 -0.18 -0.36 0.41 0.00 0.00 173.24 172.71 2di7 s PHE 85 N -0.45 1.54 -0.10 2.43 0.40 -1.25 -3.01 117.98 117.55 2di7 s PHE 85 Ca -0.06 -0.34 -0.08 0.00 -0.60 0.00 0.00 56.93 55.85 2di7 s PHE 85 Cb -0.03 -0.94 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 2di7 s PHE 85 CO 0.04 0.04 0.18 -1.50 0.70 0.00 0.00 175.22 174.68 2di7 s ILE 86 N -0.70 5.44 -0.10 0.64 2.07 -0.99 -2.41 121.20 125.14 2di7 s ILE 86 Ca 0.05 0.28 0.04 0.00 -1.41 0.00 0.00 60.65 59.61 2di7 s ILE 86 Cb -0.08 -3.45 0.00 0.00 0.13 0.00 0.00 42.46 39.06 2di7 s ILE 86 CO 0.01 0.60 -0.24 -0.69 -1.91 0.00 0.00 174.94 172.71 2di7 s VAL 87 N -1.06 2.06 0.06 4.00 1.01 -1.04 -1.98 120.40 123.45 2di7 s VAL 87 Ca 0.17 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.10 2di7 s VAL 87 Cb -0.13 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2di7 s VAL 87 CO 0.06 0.56 0.04 0.00 0.00 0.00 0.00 175.10 175.76 2di7 s ARG 88 N 0.39 0.69 0.23 2.72 1.70 -0.97 -3.67 118.95 120.05 2di7 s ARG 88 Ca -0.18 -1.13 -0.11 0.00 -0.47 0.00 0.00 55.73 53.84 2di7 s ARG 88 Cb -0.18 0.25 -0.01 0.00 -0.57 0.00 0.00 34.95 34.45 2di7 s ARG 88 CO 0.08 -0.16 0.41 1.52 -1.08 0.00 0.00 175.30 176.06 2di7 s TYR 89 N -3.89 0.48 0.01 5.89 -0.85 -1.26 -1.34 117.35 116.38 2di7 s TYR 89 Ca 0.06 -0.82 0.07 0.00 -0.52 0.00 0.00 57.07 55.86 2di7 s TYR 89 Cb 0.07 0.05 -0.03 0.00 0.38 0.00 0.00 41.96 42.43 2di7 s TYR 89 CO -0.10 -0.91 -0.19 1.03 -1.52 0.00 0.00 175.55 173.85 2di7 s ARG 90 N -4.03 2.17 -0.30 -3.49 3.00 -1.26 -4.78 118.95 110.26 2di7 s ARG 90 Ca 0.24 -0.91 0.00 0.00 0.00 0.00 0.00 55.73 55.07 2di7 s ARG 90 Cb 0.01 -2.19 0.19 0.00 0.00 0.00 0.00 34.95 32.96 2di7 s ARG 90 CO 0.08 0.56 0.63 1.41 0.00 0.00 0.00 175.30 177.99 2di7 s MET 91 N -1.08 0.54 -0.44 3.54 1.75 -1.26 -4.34 119.30 118.00 2di7 s MET 91 Ca 0.13 0.81 -0.01 0.00 -1.25 0.00 0.00 55.69 55.36 2di7 s MET 91 Cb -0.10 0.43 0.32 0.00 2.84 0.00 0.00 34.83 38.31 2di7 s MET 91 CO 0.03 -0.73 1.99 0.66 -0.65 0.00 0.00 175.02 176.32 2di7 n TYR 92 N 5.42 2.20 -4.33 4.11 4.01 -1.26 -4.90 117.16 122.40 2di7 n TYR 92 Ca 0.01 -2.31 -0.17 0.00 -0.16 0.00 0.00 57.90 55.27 2di7 n TYR 92 Cb 0.52 -1.12 -0.10 0.00 -0.31 0.00 0.00 39.34 38.33 2di7 n TYR 92 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2di7 s ALA 93 N -2.58 1.80 -0.35 -0.72 0.00 -1.26 -5.13 121.76 113.52 2di7 s ALA 93 Ca 0.44 -1.87 -0.14 0.00 0.00 0.00 0.00 51.96 50.38 2di7 s ALA 93 Cb 0.35 0.92 -0.01 0.00 0.00 0.00 0.00 23.12 24.38 2di7 s ALA 93 CO 0.00 -0.41 0.30 -1.12 0.00 0.00 0.00 175.76 174.52 2di7 s SER 94 N -3.33 6.11 0.01 0.00 0.01 -1.26 -5.02 113.70 110.22 2di7 s SER 94 Ca 0.36 -0.42 0.05 0.00 1.31 0.00 0.00 55.95 57.24 2di7 s SER 94 Cb 0.08 -2.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 2di7 s SER 94 CO 0.13 -0.31 -0.14 -0.72 0.41 0.00 0.00 173.24 172.61 2di7 s TYR 95 N 1.84 1.24 -0.20 2.43 -0.85 -1.26 -5.04 117.35 115.51 2di7 s TYR 95 Ca 0.08 -0.28 -0.01 0.00 -0.52 0.00 0.00 57.07 56.34 2di7 s TYR 95 Cb -0.17 -0.78 -0.12 0.00 0.38 0.00 0.00 41.96 41.27 2di7 s TYR 95 CO 0.11 0.00 -0.19 1.63 -1.52 0.00 0.00 175.55 175.58 2di7 n LYS 96 N 2.43 0.47 -4.51 -3.49 4.01 -1.26 -5.02 118.16 110.80 2di7 n LYS 96 Ca -0.16 0.13 -0.27 0.00 -0.51 0.00 0.00 58.31 57.51 2di7 n LYS 96 Cb 0.55 -1.35 -0.13 0.00 -0.51 0.00 0.00 35.03 33.59 2di7 n LYS 96 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2di7 s ASN 97 N -6.11 2.81 0.16 4.39 0.01 -1.26 -5.00 114.94 109.94 2di7 s ASN 97 Ca -0.27 -0.64 -0.16 0.00 -0.71 0.00 0.00 52.86 51.08 2di7 s ASN 97 Cb 0.08 -0.20 0.03 0.00 0.41 0.00 0.00 41.25 41.56 2di7 s ASN 97 CO 0.43 0.15 0.43 -0.76 -1.51 0.00 0.00 177.10 175.84 2di7 s LEU 98 N -1.64 0.35 -0.01 0.60 1.43 -1.22 -4.65 118.68 113.54 2di7 s LEU 98 Ca 0.09 -0.46 0.05 0.00 -1.03 0.00 0.00 54.13 52.79 2di7 s LEU 98 Cb -0.10 1.87 -0.03 0.00 0.03 0.00 0.00 46.19 47.97 2di7 s LEU 98 CO 0.04 -0.94 -0.16 -0.75 0.23 0.00 0.00 176.35 174.76 2di7 s LYS 99 N -3.85 2.31 0.01 1.70 2.20 -0.12 -2.97 119.74 119.01 2di7 s LYS 99 Ca 0.07 -0.82 0.08 0.00 -0.36 0.00 0.00 55.97 54.94 2di7 s LYS 99 Cb 0.01 -2.28 -0.02 0.00 -1.51 0.00 0.00 37.83 34.02 2di7 s LYS 99 CO -0.07 0.59 -0.24 0.08 -0.36 0.00 0.00 175.35 175.35 2di7 s VAL 100 N -0.81 1.91 -0.02 4.02 1.01 -1.06 -2.77 120.40 122.69 2di7 s VAL 100 Ca 0.13 -1.14 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 2di7 s VAL 100 Cb -0.11 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.68 2di7 s VAL 100 CO 0.03 0.44 0.03 -1.61 0.00 0.00 0.00 175.10 173.99 2di7 s GLU 101 N -0.82 0.00 -0.20 2.72 2.02 -0.22 -0.31 118.70 121.89 2di7 s GLU 101 Ca 0.10 0.12 -0.03 0.00 0.02 0.00 0.00 54.97 55.18 2di7 s GLU 101 Cb -0.09 -0.11 0.06 0.00 0.10 0.00 0.00 34.13 34.09 2di7 s GLU 101 CO 0.00 -0.08 0.04 0.42 0.02 0.00 0.00 175.26 175.66 2di7 s ILE 102 N 0.54 0.55 0.17 -1.63 1.09 -1.26 0.02 121.20 120.68 2di7 s ILE 102 Ca -0.04 -0.63 0.07 0.00 -1.10 0.00 0.00 60.65 58.94 2di7 s ILE 102 Cb -0.06 -1.08 -0.04 0.00 -1.06 0.00 0.00 42.46 40.21 2di7 s ILE 102 CO -0.02 -0.25 -0.13 -0.54 -0.10 0.00 0.00 174.94 173.90 2di7 s LYS 103 N 1.84 1.19 -0.19 2.79 3.01 -1.09 -2.39 119.74 124.90 2di7 s LYS 103 Ca -0.00 -1.48 -0.02 0.00 -1.01 0.00 0.00 55.97 53.47 2di7 s LYS 103 Cb -0.17 -0.95 0.05 0.00 -1.01 0.00 0.00 37.83 35.75 2di7 s LYS 103 CO -0.10 0.16 0.00 0.12 0.51 0.00 0.00 175.35 176.04 2di7 s PHE 104 N -2.87 1.39 -1.72 3.18 5.36 0.10 -3.05 117.98 120.37 2di7 s PHE 104 Ca 0.18 -1.03 -0.19 0.00 -0.96 0.00 0.00 56.93 54.93 2di7 s PHE 104 Cb -0.01 -1.17 0.16 0.00 -0.34 0.00 0.00 43.02 41.66 2di7 s PHE 104 CO 0.04 -0.63 0.76 1.04 -1.46 0.00 0.00 175.22 174.97 2di7 n GLN 105 N 4.95 -2.88 -1.99 10.12 6.02 -1.26 -0.26 117.38 132.07 2di7 n GLN 105 Ca -0.10 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.24 2di7 n GLN 105 Cb 0.47 -5.03 0.00 0.00 1.02 0.00 0.00 30.24 26.69 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 -1.38 0.67 2.69 1.08 0.00 -1.26 -5.05 105.19 101.94 2di7 n GLY 106 Ca 0.07 -0.75 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 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 -4.04 0.18 0.45 1.61 -0.21 0.64 -5.03 119.66 113.26 2di7 s GLN 107 Ca 0.00 0.01 -0.25 0.00 0.02 0.00 0.00 55.36 55.14 2di7 s GLN 107 Cb 0.00 -1.28 -0.08 0.00 1.00 0.00 0.00 33.01 32.65 2di7 s GLN 107 CO 0.00 -0.75 1.44 -1.01 -2.12 0.00 0.00 175.29 172.85 2di7 s HIS 108 N 2.26 2.45 -0.24 0.91 3.76 -1.26 0.00 115.29 123.18 2di7 s HIS 108 Ca 0.06 1.25 -0.14 0.00 -0.15 0.00 0.00 55.06 56.08 2di7 s HIS 108 Cb -0.16 -3.94 -0.10 0.00 1.11 0.00 0.00 32.58 29.50 2di7 s HIS 108 CO -0.17 -2.98 -0.34 0.28 -0.85 0.00 0.00 174.74 170.69 2di7 n VAL 109 N -0.17 1.45 -3.28 -0.90 0.31 -1.01 -4.15 118.33 110.59 2di7 n VAL 109 Ca 0.05 -0.22 -0.07 0.00 -0.01 0.00 0.00 64.34 64.09 2di7 n VAL 109 Cb 0.42 -1.99 0.01 0.00 -0.91 0.00 0.00 33.84 31.37 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 -4.24 0.32 -0.69 3.52 0.00 -1.26 -3.91 120.51 114.24 2di7 n ALA 110 Ca -0.41 -0.65 -0.07 0.00 0.00 0.00 0.00 53.44 52.31 2di7 n ALA 110 Cb 0.76 0.22 -0.11 0.00 0.00 0.00 0.00 19.45 20.32 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 -1.17 1.38 -2.64 0.00 4.76 -1.26 -4.88 118.16 114.35 2di7 n LYS 111 Ca 0.02 -0.62 -0.29 0.00 -2.87 0.00 0.00 58.31 54.55 2di7 n LYS 111 Cb 0.18 -1.74 -0.02 0.00 -1.84 0.00 0.00 35.03 31.61 2di7 n LYS 111 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2di7 s SER 112 N 2.20 6.41 0.78 4.39 1.04 -1.26 -4.29 113.70 122.96 2di7 s SER 112 Ca 0.42 1.12 -0.10 0.00 0.48 0.00 0.00 55.95 57.87 2di7 s SER 112 Cb 0.20 -2.33 0.06 0.00 0.10 0.00 0.00 66.02 64.05 2di7 s SER 112 CO 0.00 -0.53 1.09 -2.16 0.98 0.00 0.00 173.24 172.63 2di7 s PRO 113 N -4.32 2.24 -0.39 4.02 0.04 -1.26 -5.01 135.00 130.32 2di7 s PRO 113 Ca 0.51 1.17 -0.06 0.00 0.04 0.00 0.00 61.00 62.65 2di7 s PRO 113 Cb -0.10 -1.89 0.08 0.00 0.04 0.00 0.00 34.50 32.62 2di7 s PRO 113 CO 0.38 -1.66 0.20 0.71 0.04 0.00 0.00 177.00 176.68 2di7 s TYR 114 N -2.90 3.39 -0.54 0.56 2.02 0.58 -4.97 117.35 115.49 2di7 s TYR 114 Ca 0.61 -1.83 -0.27 0.00 -0.37 0.00 0.00 57.07 55.21 2di7 s TYR 114 Cb -0.17 -2.88 0.03 0.00 -0.40 0.00 0.00 41.96 38.54 2di7 s TYR 114 CO 0.56 -0.87 1.09 0.42 -1.57 0.00 0.00 175.55 175.18 2di7 s ILE 115 N 1.32 4.19 -0.55 2.71 -1.09 -1.26 -2.57 121.20 123.95 2di7 s ILE 115 Ca 0.03 0.79 -0.14 0.00 -2.23 0.00 0.00 60.65 59.10 2di7 s ILE 115 Cb -0.22 -4.63 0.14 0.00 -1.58 0.00 0.00 42.46 36.17 2di7 s ILE 115 CO -0.00 -1.17 0.49 -0.76 -1.23 0.00 0.00 174.94 172.27 2di7 s LEU 116 N 4.49 6.13 0.15 2.97 1.02 -1.16 -5.03 118.68 127.25 2di7 s LEU 116 Ca 0.40 -1.89 -0.01 0.00 0.02 0.00 0.00 54.13 52.65 2di7 s LEU 116 Cb -0.09 -2.17 -0.04 0.00 0.02 0.00 0.00 46.19 43.91 2di7 s LEU 116 CO 0.25 -0.80 0.07 -1.59 0.02 0.00 0.00 176.35 174.30 2di7 s LYS 117 N 1.43 1.01 0.06 1.70 -2.85 -1.26 -3.43 119.74 116.41 2di7 s LYS 117 Ca 0.05 -1.50 0.00 0.00 -1.00 0.00 0.00 55.97 53.52 2di7 s LYS 117 Cb -0.28 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.69 2di7 s LYS 117 CO 0.01 -0.28 0.00 0.41 0.10 0.00 0.00 175.35 175.59 2di7 n GLY 118 N -0.15 -4.21 3.18 0.59 0.00 -1.26 -4.85 105.19 98.48 2di7 n GLY 118 Ca -0.04 -0.56 -0.44 0.00 0.00 0.00 0.00 46.02 44.99 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 0.65 5.50 0.00 1.61 3.41 -1.26 -4.88 113.62 118.65 2di7 n SER 119 Ca 0.00 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.49 2di7 n SER 119 Cb 0.00 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.51 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 2.86 4.77 0.00 5.00 0.00 -1.26 -4.91 105.19 111.65 2di7 n GLY 120 Ca 0.33 -1.13 0.08 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.94 0.41 -2.28 1.61 -0.04 -1.26 -4.85 135.00 126.66 2di7 n PRO 121 Ca 0.00 0.04 -0.04 0.00 -0.04 0.00 0.00 63.50 63.46 2di7 n PRO 121 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 2di7 n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2di7 n SER 122 N -1.08 -2.32 -4.37 3.54 2.88 -1.26 -5.05 113.62 105.97 2di7 n SER 122 Ca 0.10 -0.17 -0.35 0.00 -1.33 0.00 0.00 58.87 57.12 2di7 n SER 122 Cb 0.07 -1.74 -0.13 0.00 -0.75 0.00 0.00 64.21 61.65 2di7 n SER 122 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2di7 s SER 123 N -3.30 4.48 0.00 -3.46 0.15 -1.26 -5.29 113.70 105.03 2di7 s SER 123 Ca 0.03 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.37 2di7 s SER 123 Cb -0.00 -1.76 0.00 0.00 -1.71 0.00 0.00 66.02 62.54 2di7 s SER 123 CO 0.20 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.27