#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v30 s VAL 8 N 0.00 2.08 -0.19 2.46 1.01 0.39 -4.92 120.40 121.23 1v30 s VAL 8 Ca 0.00 -1.08 -0.15 0.00 0.00 0.00 0.00 61.98 60.75 1v30 s VAL 8 Cb 0.00 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1v30 s VAL 8 CO 0.00 0.58 0.35 -0.60 0.00 0.00 0.00 175.10 175.42 1v30 s ARG 9 N -0.39 4.19 0.14 2.72 3.52 -1.26 -0.26 118.95 127.61 1v30 s ARG 9 Ca 0.03 0.13 0.08 0.00 -0.13 0.00 0.00 55.73 55.84 1v30 s ARG 9 Cb -0.12 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.73 1v30 s ARG 9 CO 0.01 0.05 -0.18 0.96 -0.81 0.00 0.00 175.30 175.33 1v30 s ILE 10 N 1.05 1.70 -0.21 4.11 -4.36 0.03 -0.62 121.20 122.89 1v30 s ILE 10 Ca 0.17 -1.76 0.01 0.00 -0.26 0.00 0.00 60.65 58.82 1v30 s ILE 10 Cb -0.14 -1.69 0.05 0.00 1.25 0.00 0.00 42.46 41.93 1v30 s ILE 10 CO 0.07 -0.25 -0.10 0.00 0.24 0.00 0.00 174.94 174.90 1v30 s ALA 11 N -1.76 2.05 -0.10 2.27 0.00 0.42 -1.03 121.76 123.60 1v30 s ALA 11 Ca 0.11 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1v30 s ALA 11 Cb -0.07 -1.33 -0.02 0.00 0.00 0.00 0.00 23.12 21.69 1v30 s ALA 11 CO 0.05 -0.92 -0.10 0.14 0.00 0.00 0.00 175.76 174.94 1v30 s VAL 12 N 1.37 3.39 -0.29 0.00 -7.23 -0.39 -4.48 120.40 112.77 1v30 s VAL 12 Ca -0.03 -0.57 0.07 0.00 -1.81 0.00 0.00 61.98 59.64 1v30 s VAL 12 Cb -0.17 -2.40 -0.08 0.00 0.56 0.00 0.00 36.38 34.29 1v30 s VAL 12 CO -0.08 0.56 0.28 0.00 -0.31 0.00 0.00 175.10 175.55 1v30 n TYR 13 N 2.86 0.00 0.00 2.82 4.11 -1.26 -0.79 117.16 124.89 1v30 n TYR 13 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.72 1v30 n TYR 13 Cb 0.53 -0.02 0.00 0.00 -0.00 0.00 0.00 39.34 39.85 1v30 n TYR 13 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1v30 n GLY 14 N 1.28 2.51 0.45 -7.48 0.00 -1.26 -4.36 105.19 96.33 1v30 n GLY 14 Ca 0.01 -0.31 0.27 0.00 0.00 0.00 0.00 46.02 45.99 1v30 n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1v30 h THR 15 N 0.00 0.58 -0.00 2.61 2.02 -1.96 -1.00 112.91 115.15 1v30 h THR 15 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1v30 h THR 15 Cb 0.00 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1v30 h THR 15 CO 0.00 0.01 -0.42 0.18 0.37 0.00 0.00 175.52 175.66 1v30 n LEU 16 N -4.31 0.71 -4.73 2.58 4.77 -1.26 -1.11 117.00 113.65 1v30 n LEU 16 Ca 0.18 -0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.72 1v30 n LEU 16 Cb 0.91 -0.20 0.10 0.00 -2.33 0.00 0.00 43.42 41.91 1v30 n LEU 16 CO 0.37 0.15 0.75 -0.13 -1.33 0.00 0.00 177.39 177.21 1v30 s ARG 17 N -2.82 2.04 0.12 3.23 0.52 -0.38 -4.30 118.95 117.36 1v30 s ARG 17 Ca 0.16 1.59 -0.36 0.00 -0.52 0.00 0.00 55.73 56.60 1v30 s ARG 17 Cb 0.18 -1.84 -0.16 0.00 0.52 0.00 0.00 34.95 33.65 1v30 s ARG 17 CO 0.64 -1.88 1.40 1.17 0.02 0.00 0.00 175.30 176.66 1v30 n LYS 18 N -3.07 1.47 0.00 3.54 4.81 -1.26 -0.90 118.16 122.75 1v30 n LYS 18 Ca 0.12 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.09 1v30 n LYS 18 Cb 0.51 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.36 1v30 n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1v30 n GLY 19 N 2.75 2.38 3.91 3.14 0.00 -1.26 -5.03 105.19 111.09 1v30 n GLY 19 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1v30 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v30 s LYS 20 N -0.21 2.92 0.42 1.61 3.01 -0.08 -4.98 119.74 122.43 1v30 s LYS 20 Ca 0.00 0.04 0.26 0.00 -1.01 0.00 0.00 55.97 55.27 1v30 s LYS 20 Cb 0.00 -2.25 1.34 0.00 -1.01 0.00 0.00 37.83 35.91 1v30 s LYS 20 CO 0.00 -0.72 1.65 -1.35 0.51 0.00 0.00 175.35 175.44 1v30 h PRO 21 N -0.21 0.15 -0.26 -1.68 0.11 -1.85 -2.14 132.00 126.11 1v30 h PRO 21 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1v30 h PRO 21 Cb 1.26 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1v30 h PRO 21 CO 0.61 0.10 0.00 1.28 -0.21 0.00 0.00 178.00 179.78 1v30 n LEU 22 N -4.72 3.51 0.29 2.35 4.77 -0.26 -4.67 117.00 118.26 1v30 n LEU 22 Ca 0.35 -2.75 0.15 0.00 -0.03 0.00 0.00 56.01 53.72 1v30 n LEU 22 Cb 1.29 -0.45 0.88 0.00 -2.33 0.00 0.00 43.42 42.81 1v30 n LEU 22 CO 0.20 0.68 1.09 -0.74 -1.33 0.00 0.00 177.39 177.30 1v30 h HIS 23 N 1.69 0.00 -0.04 -1.77 2.76 -1.41 -2.30 115.15 114.08 1v30 h HIS 23 Ca 0.00 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1v30 h HIS 23 Cb 1.22 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.18 1v30 h HIS 23 CO 0.39 0.03 0.13 0.11 -1.30 0.00 0.00 177.93 177.29 1v30 h TRP 24 N 0.00 0.00 0.00 5.26 5.08 -1.83 0.91 115.95 125.37 1v30 h TRP 24 Ca -0.00 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.96 1v30 h TRP 24 Cb 0.08 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.24 1v30 h TRP 24 CO 0.00 0.00 -0.02 1.88 -1.28 0.00 0.00 178.44 179.02 1v30 h TYR 25 N 0.00 0.00 -0.53 0.12 -1.99 -1.80 -2.89 116.97 109.89 1v30 h TYR 25 Ca 0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1v30 h TYR 25 Cb 0.28 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.01 1v30 h TYR 25 CO 0.00 0.02 0.00 1.28 -0.00 0.00 0.00 178.16 179.46 1v30 n LEU 26 N -3.15 3.84 0.19 3.88 4.77 0.31 -4.66 117.00 122.19 1v30 n LEU 26 Ca -0.00 -2.25 0.18 0.00 -0.03 0.00 0.00 56.01 53.91 1v30 n LEU 26 Cb 0.25 -0.43 0.82 0.00 -2.33 0.00 0.00 43.42 41.72 1v30 n LEU 26 CO 0.26 0.82 1.16 0.11 -1.33 0.00 0.00 177.39 178.40 1v30 h LYS 27 N 3.18 0.00 -0.00 3.23 6.56 -1.56 -0.76 116.57 127.21 1v30 h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1v30 h LYS 27 Cb 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1v30 h LYS 27 CO 0.09 0.00 -0.71 0.41 -2.06 0.00 0.00 179.45 177.19 1v30 n GLY 28 N -1.39 -0.47 3.77 3.86 0.00 -1.26 -5.00 105.19 104.69 1v30 n GLY 28 Ca 0.03 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 1v30 n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v30 s ALA 29 N -2.55 2.15 -0.27 4.61 0.00 -0.29 -5.02 121.76 120.38 1v30 s ALA 29 Ca 0.10 0.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.07 1v30 s ALA 29 Cb 0.15 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 20.00 1v30 s ALA 29 CO 0.66 -1.82 0.17 0.21 0.00 0.00 0.00 175.76 174.99 1v30 s LYS 30 N -4.96 3.91 -0.19 0.00 2.20 -0.65 -4.94 119.74 115.11 1v30 s LYS 30 Ca 0.61 -0.34 -0.29 0.00 -0.36 0.00 0.00 55.97 55.59 1v30 s LYS 30 Cb -0.17 -3.60 0.00 0.00 -1.51 0.00 0.00 37.83 32.56 1v30 s LYS 30 CO 0.56 -0.17 1.03 0.12 -0.36 0.00 0.00 175.35 176.53 1v30 s PHE 31 N 1.69 3.40 -0.09 4.03 5.36 -1.26 -1.05 117.98 130.06 1v30 s PHE 31 Ca 0.07 1.51 0.09 0.00 -0.96 0.00 0.00 56.93 57.64 1v30 s PHE 31 Cb -0.16 -3.24 -0.24 0.00 -0.34 0.00 0.00 43.02 39.04 1v30 s PHE 31 CO 0.09 -0.39 0.49 1.28 -1.46 0.00 0.00 175.22 175.23 1v30 n LEU 32 N 5.87 1.17 0.00 6.12 4.77 0.13 -5.00 117.00 130.07 1v30 n LEU 32 Ca 0.11 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1v30 n LEU 32 Cb 0.47 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1v30 n LEU 32 CO 0.52 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 1v30 n GLY 33 N 1.69 1.90 3.95 -0.72 0.00 -1.21 -5.01 105.19 105.79 1v30 n GLY 33 Ca -0.23 -1.71 -0.23 0.00 0.00 0.00 0.00 46.02 43.85 1v30 n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1v30 s GLU 34 N -1.62 3.36 0.34 1.61 2.02 -1.26 -0.67 118.70 122.48 1v30 s GLU 34 Ca 0.00 -0.42 -0.14 0.00 0.02 0.00 0.00 54.97 54.43 1v30 s GLU 34 Cb 0.00 -2.65 0.03 0.00 0.10 0.00 0.00 34.13 31.61 1v30 s GLU 34 CO 0.00 0.05 0.69 0.34 0.02 0.00 0.00 175.26 176.36 1v30 s ASP 35 N -4.09 0.12 -0.08 -0.19 2.15 -0.34 -4.91 116.67 109.34 1v30 s ASP 35 Ca 0.42 -1.09 0.04 0.00 0.43 0.00 0.00 52.55 52.34 1v30 s ASP 35 Cb -0.10 0.77 0.00 0.00 -0.30 0.00 0.00 42.92 43.29 1v30 s ASP 35 CO 0.36 -1.50 -0.19 0.26 -0.17 0.00 0.00 175.17 173.93 1v30 s TRP 36 N -2.92 2.09 -0.25 -5.34 0.52 -1.26 -1.07 118.94 110.72 1v30 s TRP 36 Ca 0.18 -0.79 -0.09 0.00 0.02 0.00 0.00 56.10 55.42 1v30 s TRP 36 Cb -0.04 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 30.81 1v30 s TRP 36 CO 0.12 -0.32 0.12 0.42 0.02 0.00 0.00 176.95 177.31 1v30 s ILE 37 N 0.36 4.85 0.40 2.03 -1.09 0.77 -4.87 121.20 123.65 1v30 s ILE 37 Ca -0.14 0.01 -0.22 0.00 -2.23 0.00 0.00 60.65 58.06 1v30 s ILE 37 Cb -0.16 -3.28 -0.11 0.00 -1.58 0.00 0.00 42.46 37.34 1v30 s ILE 37 CO 0.06 0.32 0.95 -1.61 -1.23 0.00 0.00 174.94 173.43 1v30 s GLU 38 N 1.48 4.31 0.00 2.79 0.41 -1.26 -0.54 118.70 125.89 1v30 s GLU 38 Ca 0.06 1.19 0.00 0.00 -0.41 0.00 0.00 54.97 55.82 1v30 s GLU 38 Cb -0.15 -2.35 0.00 0.00 -1.78 0.00 0.00 34.13 29.85 1v30 s GLU 38 CO 0.06 0.04 0.00 0.41 -0.49 0.00 0.00 175.26 175.28 1v30 n GLY 39 N -0.28 0.63 3.05 -1.39 0.00 -0.02 -4.95 105.19 102.23 1v30 n GLY 39 Ca 0.06 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.33 1v30 n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1v30 s TYR 40 N -2.00 0.70 0.17 1.61 1.51 -0.94 -1.53 117.35 116.87 1v30 s TYR 40 Ca 0.00 -0.39 0.11 0.00 -1.01 0.00 0.00 57.07 55.78 1v30 s TYR 40 Cb 0.00 -0.42 -0.04 0.00 -0.11 0.00 0.00 41.96 41.39 1v30 s TYR 40 CO 0.00 -0.05 -0.22 -0.65 -1.11 0.00 0.00 175.55 173.52 1v30 s GLN 41 N -1.20 1.60 -0.11 -0.62 -0.21 0.32 -3.27 119.66 116.17 1v30 s GLN 41 Ca -0.06 -1.41 0.03 0.00 0.02 0.00 0.00 55.36 53.94 1v30 s GLN 41 Cb -0.08 -1.93 -0.00 0.00 1.00 0.00 0.00 33.01 32.00 1v30 s GLN 41 CO 0.00 0.42 -0.22 -1.17 -2.12 0.00 0.00 175.29 172.21 1v30 s LEU 42 N -2.50 2.20 0.20 2.90 2.96 -1.26 -1.84 118.68 121.34 1v30 s LEU 42 Ca 0.20 -0.53 0.09 0.00 -0.22 0.00 0.00 54.13 53.67 1v30 s LEU 42 Cb -0.09 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.11 1v30 s LEU 42 CO 0.10 0.14 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.78 1v30 s TYR 43 N 0.45 1.92 -0.15 5.38 1.51 -0.18 -0.22 117.35 126.07 1v30 s TYR 43 Ca -0.15 -0.46 -0.06 0.00 -1.01 0.00 0.00 57.07 55.39 1v30 s TYR 43 Cb -0.17 -0.91 0.07 0.00 -0.11 0.00 0.00 41.96 40.83 1v30 s TYR 43 CO 0.06 0.43 0.33 0.12 -1.11 0.00 0.00 175.55 175.38 1v30 s PHE 44 N -2.36 -0.53 0.00 2.71 2.19 -0.70 -0.24 117.98 119.05 1v30 s PHE 44 Ca 0.21 1.13 0.00 0.00 0.33 0.00 0.00 56.93 58.60 1v30 s PHE 44 Cb -0.04 0.13 0.00 0.00 -1.31 0.00 0.00 43.02 41.79 1v30 s PHE 44 CO 0.09 -0.36 0.00 -1.91 1.83 0.00 0.00 175.22 174.87 1v30 n GLU 45 N 4.90 0.00 -0.00 10.12 2.13 -1.23 -2.51 120.64 134.05 1v30 n GLU 45 Ca -0.14 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.75 1v30 n GLU 45 Cb 0.51 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 32.12 1v30 n GLU 45 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1v30 n TYR 46 N 0.00 0.00 -4.11 4.31 4.02 -1.26 -4.98 117.16 115.14 1v30 n TYR 46 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 1v30 n TYR 46 Cb 0.00 -0.23 -0.11 0.00 -0.02 0.00 0.00 39.34 38.98 1v30 n TYR 46 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1v30 s LEU 47 N -3.61 2.37 0.18 7.72 1.43 -1.26 -5.15 118.68 120.36 1v30 s LEU 47 Ca -0.02 -0.76 -0.23 0.00 -1.03 0.00 0.00 54.13 52.09 1v30 s LEU 47 Cb 0.10 -0.12 -0.08 0.00 0.03 0.00 0.00 46.19 46.13 1v30 s LEU 47 CO 0.64 -0.33 0.74 -2.16 0.23 0.00 0.00 176.35 175.47 1v30 s PRO 48 N -2.63 4.41 -0.08 1.29 0.04 -1.26 -4.37 135.00 132.40 1v30 s PRO 48 Ca 0.00 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.05 1v30 s PRO 48 Cb -0.03 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.43 1v30 s PRO 48 CO -0.02 0.50 -0.07 0.71 0.04 0.00 0.00 177.00 178.17 1v30 s TYR 49 N -1.30 1.19 -0.21 0.56 1.51 0.66 -4.94 117.35 114.82 1v30 s TYR 49 Ca 0.38 -0.49 -0.06 0.00 -1.01 0.00 0.00 57.07 55.89 1v30 s TYR 49 Cb -0.20 -1.01 -0.03 0.00 -0.11 0.00 0.00 41.96 40.61 1v30 s TYR 49 CO 0.23 -0.37 0.04 0.00 -1.11 0.00 0.00 175.55 174.35 1v30 s ALA 50 N 1.38 3.16 0.08 3.71 0.00 -1.26 -1.01 121.76 127.83 1v30 s ALA 50 Ca -0.02 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 50.98 1v30 s ALA 50 Cb -0.14 -1.92 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 1v30 s ALA 50 CO -0.04 -0.20 -0.10 0.14 0.00 0.00 0.00 175.76 175.57 1v30 s VAL 51 N 1.09 0.84 0.36 0.00 -7.23 -0.77 -1.47 120.40 113.22 1v30 s VAL 51 Ca 0.03 -1.48 -0.28 0.00 -1.81 0.00 0.00 61.98 58.44 1v30 s VAL 51 Cb -0.14 -1.16 -0.11 0.00 0.56 0.00 0.00 36.38 35.53 1v30 s VAL 51 CO 0.03 -0.49 1.40 -0.54 -0.31 0.00 0.00 175.10 175.18 1v30 s LYS 52 N -2.43 4.21 0.00 4.82 1.02 -1.26 -0.52 119.74 125.58 1v30 s LYS 52 Ca 0.01 2.40 0.00 0.00 0.02 0.00 0.00 55.97 58.40 1v30 s LYS 52 Cb -0.05 -3.00 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1v30 s LYS 52 CO 0.00 -0.38 0.00 0.41 -0.92 0.00 0.00 175.35 174.46 1v30 n GLY 53 N 0.62 0.85 3.68 -3.33 0.00 -0.58 -4.72 105.19 101.70 1v30 n GLY 53 Ca 0.01 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 1v30 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v30 s LYS 54 N -2.00 4.16 0.00 1.61 -0.14 -1.26 -2.22 119.74 119.89 1v30 s LYS 54 Ca 0.00 2.45 0.00 0.00 -1.36 0.00 0.00 55.97 57.06 1v30 s LYS 54 Cb 0.00 -3.84 0.00 0.00 -1.68 0.00 0.00 37.83 32.31 1v30 s LYS 54 CO 0.00 -0.85 0.00 0.41 -0.76 0.00 0.00 175.35 174.15 1v30 n GLY 55 N 4.24 1.40 3.26 -3.33 0.00 -1.26 -4.71 105.19 104.79 1v30 n GLY 55 Ca 0.18 -1.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 1v30 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v30 s LYS 56 N -1.18 1.34 -0.13 1.61 -2.85 -1.20 -0.84 119.74 116.49 1v30 s LYS 56 Ca 0.00 -0.98 0.01 0.00 -1.00 0.00 0.00 55.97 54.00 1v30 s LYS 56 Cb 0.00 -1.48 -0.01 0.00 -2.06 0.00 0.00 37.83 34.28 1v30 s LYS 56 CO 0.00 0.37 -0.17 -1.17 0.10 0.00 0.00 175.35 174.49 1v30 s LEU 57 N -1.31 2.49 -0.01 2.77 2.96 0.30 -4.28 118.68 121.60 1v30 s LEU 57 Ca 0.07 -0.42 -0.28 0.00 -0.22 0.00 0.00 54.13 53.28 1v30 s LEU 57 Cb -0.09 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 45.02 1v30 s LEU 57 CO 0.02 0.15 0.88 -0.75 -1.32 0.00 0.00 176.35 175.33 1v30 s LYS 58 N 0.43 4.53 0.14 1.98 2.20 0.06 -0.16 119.74 128.91 1v30 s LYS 58 Ca -0.12 1.23 0.03 0.00 -0.36 0.00 0.00 55.97 56.75 1v30 s LYS 58 Cb -0.16 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1v30 s LYS 58 CO 0.06 0.02 -0.08 0.14 -0.36 0.00 0.00 175.35 175.13 1v30 s VAL 59 N 0.81 0.96 -0.15 4.02 -7.23 -0.23 -4.42 120.40 114.17 1v30 s VAL 59 Ca 0.46 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.60 1v30 s VAL 59 Cb -0.20 -1.84 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 1v30 s VAL 59 CO 0.25 -0.74 -0.08 -1.61 -0.31 0.00 0.00 175.10 172.60 1v30 s GLU 60 N -3.80 3.51 -0.18 4.82 2.02 0.03 -1.20 118.70 123.90 1v30 s GLU 60 Ca 0.16 -0.60 -0.07 0.00 0.02 0.00 0.00 54.97 54.48 1v30 s GLU 60 Cb 0.04 -2.80 -0.04 0.00 0.10 0.00 0.00 34.13 31.43 1v30 s GLU 60 CO -0.00 0.19 0.06 0.08 0.02 0.00 0.00 175.26 175.60 1v30 s VAL 61 N 0.46 4.78 0.16 2.63 1.01 0.16 -1.26 120.40 128.33 1v30 s VAL 61 Ca -0.06 -0.04 0.06 0.00 0.00 0.00 0.00 61.98 61.94 1v30 s VAL 61 Cb -0.15 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1v30 s VAL 61 CO 0.04 0.47 -0.13 -0.31 0.00 0.00 0.00 175.10 175.16 1v30 s TYR 62 N 0.33 1.45 -0.20 5.22 1.51 -0.20 -0.69 117.35 124.78 1v30 s TYR 62 Ca 0.03 -0.63 -0.03 0.00 -1.01 0.00 0.00 57.07 55.43 1v30 s TYR 62 Cb -0.12 -0.72 -0.01 0.00 -0.11 0.00 0.00 41.96 40.99 1v30 s TYR 62 CO 0.00 0.19 -0.06 -1.21 -1.11 0.00 0.00 175.55 173.36 1v30 s GLU 63 N -3.35 3.41 0.12 -0.62 2.02 -0.22 -0.79 118.70 119.26 1v30 s GLU 63 Ca 0.16 -0.62 0.07 0.00 0.02 0.00 0.00 54.97 54.60 1v30 s GLU 63 Cb -0.01 -2.93 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 1v30 s GLU 63 CO 0.03 -0.07 -0.17 0.14 0.02 0.00 0.00 175.26 175.21 1v30 s VAL 64 N 1.14 1.53 0.82 2.63 -7.23 0.64 -1.64 120.40 118.30 1v30 s VAL 64 Ca 0.02 -1.63 -0.12 0.00 -1.81 0.00 0.00 61.98 58.44 1v30 s VAL 64 Cb -0.15 -1.53 0.09 0.00 0.56 0.00 0.00 36.38 35.35 1v30 s VAL 64 CO -0.01 -0.23 1.14 1.51 -0.31 0.00 0.00 175.10 177.20 1v30 s ASP 65 N -2.18 4.36 0.17 4.85 1.47 -1.26 0.15 116.67 124.22 1v30 s ASP 65 Ca 0.08 0.95 -0.15 0.00 1.18 0.00 0.00 52.55 54.61 1v30 s ASP 65 Cb -0.08 -1.55 0.12 0.00 -0.34 0.00 0.00 42.92 41.08 1v30 s ASP 65 CO 0.04 -2.02 1.74 0.50 0.68 0.00 0.00 175.17 176.11 1v30 h LYS 66 N -1.13 0.26 -0.60 2.11 3.64 -1.96 -1.45 116.57 117.44 1v30 h LYS 66 Ca -0.47 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 1v30 h LYS 66 Cb 1.31 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 1v30 h LYS 66 CO 0.64 0.17 0.38 1.49 -2.27 0.00 0.00 179.45 179.86 1v30 h GLU 67 N 0.27 0.75 -0.31 1.90 4.22 -1.99 -0.62 114.58 118.79 1v30 h GLU 67 Ca 0.20 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.58 1v30 h GLU 67 Cb 0.22 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1v30 h GLU 67 CO -0.24 0.49 0.12 1.15 -2.18 0.00 0.00 179.01 178.35 1v30 h THR 68 N 0.77 1.19 -0.44 0.32 2.02 -1.84 -1.55 112.91 113.37 1v30 h THR 68 Ca 0.23 -0.58 0.01 0.00 0.77 0.00 0.00 66.41 66.84 1v30 h THR 68 Cb -0.04 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1v30 h THR 68 CO -0.07 0.20 0.29 0.15 0.37 0.00 0.00 175.52 176.46 1v30 h PHE 69 N 0.34 0.55 -0.71 3.16 3.57 -0.92 -1.81 116.94 121.12 1v30 h PHE 69 Ca 0.10 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 1v30 h PHE 69 Cb 0.20 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1v30 h PHE 69 CO -0.00 0.34 0.36 0.93 -2.23 0.00 0.00 178.31 177.71 1v30 h GLU 70 N 0.59 1.01 -0.43 1.11 5.08 -0.97 -0.41 114.58 120.56 1v30 h GLU 70 Ca 0.16 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1v30 h GLU 70 Cb -0.06 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 28.98 1v30 h GLU 70 CO -0.04 0.76 0.17 0.00 -1.00 0.00 0.00 179.01 178.90 1v30 h ARG 71 N 1.01 0.65 -0.42 2.33 3.08 -0.85 -2.61 114.38 117.58 1v30 h ARG 71 Ca 0.25 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 1v30 h ARG 71 Cb 0.08 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1v30 h ARG 71 CO -0.04 0.61 0.10 0.82 -1.07 0.00 0.00 179.97 180.39 1v30 h ILE 72 N 0.56 1.23 0.00 2.04 2.04 -0.98 -2.52 117.51 119.88 1v30 h ILE 72 Ca 0.14 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1v30 h ILE 72 Cb 0.20 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1v30 h ILE 72 CO -0.01 0.28 0.00 -3.20 0.00 0.00 0.00 178.15 175.22 1v30 n ASN 73 N -4.55 0.00 -0.01 1.72 5.15 -0.19 -1.76 115.26 115.62 1v30 n ASN 73 Ca -0.00 -0.79 0.07 0.00 -0.60 0.00 0.00 54.58 53.26 1v30 n ASN 73 Cb 0.21 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.35 1v30 n ASN 73 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1v30 n GLU 74 N -0.84 0.72 -1.63 1.20 1.02 -0.96 -5.00 120.64 115.15 1v30 n GLU 74 Ca 0.10 -0.12 -0.48 0.00 -0.02 0.00 0.00 57.16 56.64 1v30 n GLU 74 Cb 0.04 -1.33 -0.05 0.00 -0.02 0.00 0.00 31.44 30.09 1v30 n GLU 74 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1v30 n ILE 75 N -1.91 0.29 -0.31 -3.67 5.41 -0.72 -4.87 119.36 113.58 1v30 n ILE 75 Ca -0.02 -0.07 0.06 0.00 1.00 0.00 0.00 62.75 63.72 1v30 n ILE 75 Cb 0.36 -1.16 0.22 0.00 -0.71 0.00 0.00 39.64 38.35 1v30 n ILE 75 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1v30 h GLU 76 N 4.77 0.70 0.00 0.38 4.57 -1.94 -1.01 114.58 122.04 1v30 h GLU 76 Ca -0.46 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1v30 h GLU 76 Cb 1.30 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 1v30 h GLU 76 CO 0.80 0.46 0.00 0.97 -1.18 0.00 0.00 179.01 180.06 1v30 h ILE 77 N 0.72 0.00 0.00 2.32 6.09 -1.96 -1.15 117.51 123.53 1v30 h ILE 77 Ca 0.46 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.90 1v30 h ILE 77 Cb 0.57 0.59 0.00 0.00 0.47 0.00 0.00 36.82 38.46 1v30 h ILE 77 CO -0.32 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.37 1v30 n GLY 78 N -1.07 -1.05 0.28 8.18 0.00 -0.38 -4.14 105.19 107.00 1v30 n GLY 78 Ca -0.01 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 45.92 1v30 n GLY 78 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1v30 h THR 79 N 0.00 0.37 -0.01 2.61 2.02 -1.37 -1.51 112.91 115.03 1v30 h THR 79 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1v30 h THR 79 Cb 0.14 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1v30 h THR 79 CO 0.00 0.03 -0.06 0.61 0.37 0.00 0.00 175.52 176.47 1v30 n GLY 80 N -1.40 -0.72 3.71 2.16 0.00 -1.26 -4.86 105.19 102.82 1v30 n GLY 80 Ca 0.14 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 1v30 n GLY 80 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1v30 s TYR 81 N -2.24 3.08 0.06 1.61 1.51 -0.57 -0.49 117.35 120.31 1v30 s TYR 81 Ca 0.36 0.04 0.08 0.00 -1.01 0.00 0.00 57.07 56.54 1v30 s TYR 81 Cb 0.21 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.42 1v30 s TYR 81 CO 0.42 0.49 -0.22 1.03 -1.11 0.00 0.00 175.55 176.15 1v30 s ARG 82 N -2.10 1.41 -0.03 -0.62 0.52 0.72 -4.87 118.95 113.99 1v30 s ARG 82 Ca 0.25 -1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 54.11 1v30 s ARG 82 Cb -0.12 -1.60 -0.04 0.00 0.52 0.00 0.00 34.95 33.71 1v30 s ARG 82 CO 0.17 0.40 1.25 -1.17 0.02 0.00 0.00 175.30 175.97 1v30 s LEU 83 N -1.39 4.30 0.24 2.53 2.96 -1.26 -0.84 118.68 125.22 1v30 s LEU 83 Ca 0.09 1.91 0.03 0.00 -0.22 0.00 0.00 54.13 55.94 1v30 s LEU 83 Cb -0.09 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.98 1v30 s LEU 83 CO 0.03 -0.60 0.01 0.68 -1.32 0.00 0.00 176.35 175.15 1v30 s VAL 84 N 2.10 1.01 -0.08 1.68 -7.23 0.09 -4.95 120.40 113.02 1v30 s VAL 84 Ca 0.58 -2.03 -0.01 0.00 -1.81 0.00 0.00 61.98 58.72 1v30 s VAL 84 Cb -0.27 -2.42 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 1v30 s VAL 84 CO 0.24 -0.26 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.12 1v30 s GLU 85 N -3.88 2.93 0.09 4.82 2.02 -1.26 -0.66 118.70 122.75 1v30 s GLU 85 Ca 0.30 -0.50 0.03 0.00 0.02 0.00 0.00 54.97 54.82 1v30 s GLU 85 Cb 0.06 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.56 1v30 s GLU 85 CO 0.10 0.63 -0.09 0.14 0.02 0.00 0.00 175.26 176.06 1v30 s VAL 86 N -0.70 0.79 0.08 2.63 -7.23 0.06 -4.95 120.40 111.07 1v30 s VAL 86 Ca 0.11 -1.59 -0.19 0.00 -1.81 0.00 0.00 61.98 58.50 1v30 s VAL 86 Cb -0.11 -1.28 -0.07 0.00 0.56 0.00 0.00 36.38 35.48 1v30 s VAL 86 CO 0.02 -0.60 0.56 -0.44 -0.31 0.00 0.00 175.10 174.34 1v30 s SER 87 N -2.41 7.05 0.16 4.85 0.01 -1.26 -1.18 113.70 120.91 1v30 s SER 87 Ca 0.04 1.25 0.01 0.00 1.31 0.00 0.00 55.95 58.55 1v30 s SER 87 Cb -0.02 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 1v30 s SER 87 CO -0.01 0.27 0.02 0.42 0.41 0.00 0.00 173.24 174.35 1v30 s THR 88 N -1.13 0.48 -1.51 1.44 -4.23 -1.07 -4.87 115.64 104.76 1v30 s THR 88 Ca 0.29 -1.96 0.15 0.00 -1.18 0.00 0.00 61.69 59.00 1v30 s THR 88 Cb -0.19 -2.10 0.29 0.00 1.34 0.00 0.00 72.50 71.84 1v30 s THR 88 CO 0.19 -0.47 1.42 2.29 -0.54 0.00 0.00 174.62 177.51 1v30 n LYS 89 N -0.20 0.26 -0.04 3.99 2.85 -1.26 -1.20 118.16 122.56 1v30 n LYS 89 Ca -0.06 0.12 0.09 0.00 -1.05 0.00 0.00 58.31 57.40 1v30 n LYS 89 Cb 0.63 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.61 1v30 n LYS 89 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1v30 n PHE 90 N -1.24 0.10 0.00 5.58 3.01 -1.26 -5.08 117.46 118.57 1v30 n PHE 90 Ca 0.08 -0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1v30 n PHE 90 Cb 0.11 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.58 1v30 n PHE 90 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1v30 n GLY 91 N 0.97 1.45 3.76 1.37 0.00 -0.34 -5.04 105.19 107.36 1v30 n GLY 91 Ca 0.11 -2.21 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 1v30 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v30 s LYS 92 N -1.44 3.62 0.07 1.61 -0.14 -1.26 -2.58 119.74 119.61 1v30 s LYS 92 Ca 0.00 2.41 -0.05 0.00 -1.36 0.00 0.00 55.97 56.97 1v30 s LYS 92 Cb 0.00 -2.61 -0.02 0.00 -1.68 0.00 0.00 37.83 33.52 1v30 s LYS 92 CO 0.00 -0.87 0.10 0.00 -0.76 0.00 0.00 175.35 173.82 1v30 s ALA 93 N -1.21 0.07 0.15 5.17 0.00 -0.33 -4.73 121.76 120.88 1v30 s ALA 93 Ca 0.62 -0.83 -0.11 0.00 0.00 0.00 0.00 51.96 51.64 1v30 s ALA 93 Cb -0.44 0.38 -0.07 0.00 0.00 0.00 0.00 23.12 22.99 1v30 s ALA 93 CO 0.56 -0.43 0.49 -0.06 0.00 0.00 0.00 175.76 176.31 1v30 s PHE 94 N -3.74 3.54 0.00 0.00 0.40 0.21 -0.76 117.98 117.63 1v30 s PHE 94 Ca 0.05 0.89 -0.01 0.00 -0.60 0.00 0.00 56.93 57.25 1v30 s PHE 94 Cb 0.05 -2.25 -0.01 0.00 0.51 0.00 0.00 43.02 41.33 1v30 s PHE 94 CO -0.10 0.42 0.01 -1.17 0.70 0.00 0.00 175.22 175.08 1v30 s LEU 95 N -2.21 2.01 -0.54 -0.37 0.20 0.16 -0.44 118.68 117.49 1v30 s LEU 95 Ca 0.39 -0.18 -0.19 0.00 0.69 0.00 0.00 54.13 54.84 1v30 s LEU 95 Cb -0.13 0.13 0.08 0.00 -0.43 0.00 0.00 46.19 45.84 1v30 s LEU 95 CO 0.20 -0.15 0.65 0.26 -0.29 0.00 0.00 176.35 177.02 1v30 s TRP 96 N -0.66 3.04 -0.03 5.38 0.51 -1.26 -0.73 118.94 125.19 1v30 s TRP 96 Ca -0.07 -0.76 -0.22 0.00 -2.12 0.00 0.00 56.10 52.93 1v30 s TRP 96 Cb -0.05 -3.74 -0.05 0.00 -0.81 0.00 0.00 33.47 28.83 1v30 s TRP 96 CO -0.00 -1.14 0.63 -2.00 -0.51 0.00 0.00 176.95 173.93 1v30 s GLU 97 N 2.59 4.38 0.17 4.98 2.12 -0.02 -4.72 118.70 128.19 1v30 s GLU 97 Ca 0.13 0.78 -0.32 0.00 0.36 0.00 0.00 54.97 55.92 1v30 s GLU 97 Cb -0.22 -3.39 -0.10 0.00 0.26 0.00 0.00 34.13 30.68 1v30 s GLU 97 CO 0.09 0.24 1.59 -0.46 -0.54 0.00 0.00 175.26 176.18 1v30 s TRP 98 N 0.23 3.03 -1.71 5.30 -0.11 -0.54 -0.20 118.94 124.94 1v30 s TRP 98 Ca 0.33 0.57 0.12 0.00 1.22 0.00 0.00 56.10 58.35 1v30 s TRP 98 Cb -0.18 -3.96 0.39 0.00 -1.50 0.00 0.00 33.47 28.22 1v30 s TRP 98 CO 0.17 -3.57 1.29 0.41 -4.62 0.00 0.00 176.95 170.63 1v30 n GLY 99 N 3.80 1.26 0.48 5.86 0.00 0.36 -4.80 105.19 112.14 1v30 n GLY 99 Ca 0.14 -0.47 -0.03 0.00 0.00 0.00 0.00 46.02 45.66 1v30 n GLY 99 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v30 n SER 100 N 0.66 0.00 -4.77 1.61 7.64 -1.26 -5.06 113.62 112.44 1v30 n SER 100 Ca 0.14 -1.33 -0.41 0.00 1.01 0.00 0.00 58.87 58.29 1v30 n SER 100 Cb 0.45 0.24 -0.01 0.00 -1.01 0.00 0.00 64.21 63.88 1v30 n SER 100 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1v30 s LYS 101 N -2.21 4.20 0.70 1.43 1.02 -1.26 -4.96 119.74 118.67 1v30 s LYS 101 Ca 0.06 2.43 -0.12 0.00 0.02 0.00 0.00 55.97 58.36 1v30 s LYS 101 Cb 0.00 -3.02 0.02 0.00 -0.52 0.00 0.00 37.83 34.31 1v30 s LYS 101 CO 0.04 -0.42 1.08 -1.25 -0.92 0.00 0.00 175.35 173.88 1v30 s PRO 102 N -1.71 2.71 0.13 -1.68 0.04 -1.26 -5.06 135.00 128.18 1v30 s PRO 102 Ca 0.53 1.18 0.08 0.00 0.04 0.00 0.00 61.00 62.82 1v30 s PRO 102 Cb -0.44 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1v30 s PRO 102 CO 0.57 -1.29 -0.18 1.03 0.04 0.00 0.00 177.00 177.16 1v30 s ARG 103 N -4.61 1.15 0.00 4.56 0.52 -1.26 -5.10 118.95 114.22 1v30 s ARG 103 Ca 0.62 -1.27 0.00 0.00 -0.52 0.00 0.00 55.73 54.57 1v30 s ARG 103 Cb -0.17 -1.26 0.00 0.00 0.52 0.00 0.00 34.95 34.04 1v30 s ARG 103 CO 0.49 0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.49 1v30 n GLY 104 N 0.68 -0.55 3.79 -3.53 0.00 -1.26 -3.31 105.19 101.00 1v30 n GLY 104 Ca -0.16 -1.77 -0.35 0.00 0.00 0.00 0.00 46.02 43.74 1v30 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v30 s LYS 105 N -1.21 3.79 0.21 1.61 3.01 -1.04 -4.52 119.74 121.58 1v30 s LYS 105 Ca 0.00 1.47 -0.30 0.00 -1.01 0.00 0.00 55.97 56.13 1v30 s LYS 105 Cb 0.00 -2.19 -0.08 0.00 -1.01 0.00 0.00 37.83 34.55 1v30 s LYS 105 CO 0.00 -0.46 1.04 0.50 0.51 0.00 0.00 175.35 176.94 1v30 s ARG 106 N -3.06 4.69 -0.67 1.68 3.52 -1.26 -1.71 118.95 122.13 1v30 s ARG 106 Ca 0.66 1.65 -0.16 0.00 -0.13 0.00 0.00 55.73 57.74 1v30 s ARG 106 Cb -0.20 -3.27 0.15 0.00 -1.56 0.00 0.00 34.95 30.07 1v30 s ARG 106 CO 0.24 0.24 0.69 0.42 -0.81 0.00 0.00 175.30 176.08 1v30 s ILE 107 N -0.68 5.18 0.33 4.11 1.01 0.69 -4.93 121.20 126.91 1v30 s ILE 107 Ca 0.46 -1.65 0.08 0.00 0.00 0.00 0.00 60.65 59.54 1v30 s ILE 107 Cb -0.28 -4.46 0.32 0.00 0.01 0.00 0.00 42.46 38.05 1v30 s ILE 107 CO 0.35 -1.04 1.81 0.11 0.00 0.00 0.00 174.94 176.16 1v30 h LYS 108 N 8.64 0.68 0.00 2.79 6.56 -1.94 -0.93 116.57 132.38 1v30 h LYS 108 Ca -0.14 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 1v30 h LYS 108 Cb 1.07 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.58 1v30 h LYS 108 CO 0.98 0.45 0.00 0.66 -2.06 0.00 0.00 179.45 179.48 1v30 h SER 109 N 0.70 0.00 -0.01 0.86 4.64 -1.93 -3.46 113.55 114.34 1v30 h SER 109 Ca 0.54 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.85 1v30 h SER 109 Cb 0.91 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1v30 h SER 109 CO -0.31 0.00 -0.01 0.61 -0.87 0.00 0.00 176.83 176.26 1v30 n GLY 110 N 0.09 0.41 3.15 -0.77 0.00 -0.35 -4.79 105.19 102.93 1v30 n GLY 110 Ca 0.02 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1v30 n GLY 110 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1v30 s ASP 111 N -2.06 3.62 0.64 1.61 -1.08 -1.26 -0.76 116.67 117.39 1v30 s ASP 111 Ca 0.00 -0.75 0.35 0.00 -0.52 0.00 0.00 52.55 51.63 1v30 s ASP 111 Cb 0.00 -1.55 1.97 0.00 -1.46 0.00 0.00 42.92 41.89 1v30 s ASP 111 CO 0.00 -0.05 2.19 0.15 0.52 0.00 0.00 175.17 177.98 1v30 h PHE 112 N 7.95 0.00 0.00 -5.34 3.57 -1.87 -0.97 116.94 120.28 1v30 h PHE 112 Ca -0.40 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.10 1v30 h PHE 112 Cb 1.12 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1v30 h PHE 112 CO 0.52 0.00 0.00 -0.25 -2.23 0.00 0.00 178.31 176.35 1v30 n ASP 113 N -3.33 0.13 0.13 0.41 8.00 -1.26 -2.44 116.55 118.20 1v30 n ASP 113 Ca -0.01 0.54 0.11 0.00 0.71 0.00 0.00 54.79 56.13 1v30 n ASP 113 Cb 0.21 -0.56 0.61 0.00 -0.02 0.00 0.00 41.12 41.36 1v30 n ASP 113 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1v30 h GLU 114 N 0.00 0.10 -0.26 -1.24 4.81 -1.61 0.04 114.58 116.43 1v30 h GLU 114 Ca 0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 1v30 h GLU 114 Cb 0.21 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1v30 h GLU 114 CO 0.00 0.07 -0.10 0.82 -0.73 0.00 0.00 179.01 179.07 1v30 h ILE 115 N 0.11 1.21 0.00 2.32 1.08 -1.72 -1.85 117.51 118.65 1v30 h ILE 115 Ca 0.10 -0.90 -0.11 0.00 -0.39 0.00 0.00 64.86 63.57 1v30 h ILE 115 Cb 0.28 1.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 1v30 h ILE 115 CO -0.01 0.29 -0.51 0.03 -0.69 0.00 0.00 178.15 177.26 1v30 h ARG 116 N 0.39 0.00 -0.19 2.37 3.08 -1.20 -2.24 114.38 116.60 1v30 h ARG 116 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1v30 h ARG 116 Cb 0.42 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1v30 h ARG 116 CO 0.02 0.51 -0.21 -0.07 -1.07 0.00 0.00 179.97 179.15 1v30 h LEU 117 N 0.00 0.32 -0.51 3.04 3.38 -1.02 -0.69 115.31 119.84 1v30 h LEU 117 Ca -0.01 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 1v30 h LEU 117 Cb 0.95 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1v30 h LEU 117 CO 0.07 0.55 -0.23 -0.33 0.09 0.00 0.00 178.44 178.58 1v30 h GLU 118 N 0.30 0.97 -0.60 1.13 5.08 -1.10 -1.25 114.58 119.11 1v30 h GLU 118 Ca 0.05 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1v30 h GLU 118 Cb 0.55 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1v30 h GLU 118 CO 0.04 1.09 0.37 1.25 -1.00 0.00 0.00 179.01 180.76 1v30 h HIS 119 N 0.83 0.77 -0.57 4.33 2.76 -0.94 -2.08 115.15 120.25 1v30 h HIS 119 Ca 0.10 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.32 1v30 h HIS 119 Cb 0.81 -0.26 -0.04 0.00 1.55 0.00 0.00 27.41 29.47 1v30 h HIS 119 CO 0.05 0.51 0.32 1.25 -1.30 0.00 0.00 177.93 178.77 1v30 h HIS 120 N 0.81 0.60 -0.21 5.26 6.17 -0.82 -1.15 115.15 125.81 1v30 h HIS 120 Ca 0.22 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.28 1v30 h HIS 120 Cb -0.05 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.68 1v30 h HIS 120 CO -0.03 0.32 -0.03 1.25 0.71 0.00 0.00 177.93 180.16 1v30 h HIS 121 N 0.63 0.32 0.00 5.26 6.17 -0.73 -0.70 115.15 126.11 1v30 h HIS 121 Ca 0.24 -0.02 -0.23 0.00 0.71 0.00 0.00 60.37 61.06 1v30 h HIS 121 Cb 0.07 -0.10 -0.04 0.00 2.52 0.00 0.00 27.41 29.87 1v30 h HIS 121 CO -0.07 0.36 -1.51 0.45 0.71 0.00 0.00 177.93 177.86 1v30 h HIS 122 N 0.31 0.00 0.00 5.26 3.86 -0.86 -3.41 115.15 120.32 1v30 h HIS 122 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1v30 h HIS 122 Cb 0.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1v30 h HIS 122 CO 0.01 0.82 -0.52 0.72 0.86 0.00 0.00 177.93 179.82 1v30 n HIS 123 N -3.01 0.00 -0.21 2.45 8.25 -0.48 -5.11 115.22 117.10 1v30 n HIS 123 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 1v30 n HIS 123 Cb 0.95 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 32.03 1v30 n HIS 123 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70