#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i79 s HIS 5 N 0.00 0.32 -0.04 0.00 5.04 -1.26 -5.15 115.29 114.20 1i79 s HIS 5 Ca 0.00 -0.03 -0.10 0.00 -1.54 0.00 0.00 55.06 53.39 1i79 s HIS 5 Cb 0.00 -0.33 0.02 0.00 0.04 0.00 0.00 32.58 32.31 1i79 s HIS 5 CO 0.00 -0.08 0.23 0.12 -2.34 0.00 0.00 174.74 172.67 1i79 s PHE 6 N 0.58 -0.14 -0.05 3.88 5.36 -1.26 -5.15 117.98 121.20 1i79 s PHE 6 Ca -0.06 0.28 -0.00 0.00 -0.96 0.00 0.00 56.93 56.19 1i79 s PHE 6 Cb -0.09 0.05 0.03 0.00 -0.34 0.00 0.00 43.02 42.66 1i79 s PHE 6 CO -0.01 -0.26 -0.01 0.12 -1.46 0.00 0.00 175.22 173.60 1i79 s PHE 7 N -0.82 0.56 -0.59 10.12 5.36 -1.26 -5.10 117.98 126.25 1i79 s PHE 7 Ca -0.09 -0.11 -0.25 0.00 -0.96 0.00 0.00 56.93 55.52 1i79 s PHE 7 Cb -0.05 -0.64 0.04 0.00 -0.34 0.00 0.00 43.02 42.04 1i79 s PHE 7 CO 0.02 -0.23 1.01 -2.00 -1.46 0.00 0.00 175.22 172.56 1i79 s GLU 8 N 1.43 3.30 0.35 10.12 2.56 -1.26 -4.88 118.70 130.33 1i79 s GLU 8 Ca -0.04 -0.29 0.19 0.00 0.00 0.00 0.00 54.97 54.83 1i79 s GLU 8 Cb -0.13 -4.09 0.40 0.00 2.00 0.00 0.00 34.13 32.31 1i79 s GLU 8 CO -0.03 -1.64 1.60 0.78 -0.56 0.00 0.00 175.26 175.41 1i79 h GLY 9 N 11.38 0.00 -5.45 -1.50 0.00 -2.06 -3.45 103.07 101.99 1i79 h GLY 9 Ca -0.27 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.50 1i79 h GLY 9 CO 1.14 0.00 1.14 2.41 0.00 0.00 0.00 176.54 181.23 1i79 n THR 10 N -3.29 0.60 -3.22 4.70 -1.04 -1.26 -4.96 114.28 105.80 1i79 n THR 10 Ca 0.01 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.05 61.65 1i79 n THR 10 Cb 0.61 -2.08 -0.02 0.00 -1.82 0.00 0.00 70.33 67.02 1i79 n THR 10 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1i79 s GLU 11 N 3.88 3.58 -0.16 -2.82 8.01 -1.26 -5.09 118.70 124.83 1i79 s GLU 11 Ca 0.89 -0.05 -0.08 0.00 0.01 0.00 0.00 54.97 55.74 1i79 s GLU 11 Cb -0.56 -2.60 -0.04 0.00 -4.31 0.00 0.00 34.13 26.62 1i79 s GLU 11 CO 0.45 0.12 0.10 0.15 0.01 0.00 0.00 175.26 176.09 1i79 s LYS 12 N -3.99 3.83 -0.09 1.61 1.02 -1.26 -5.09 119.74 115.77 1i79 s LYS 12 Ca 0.43 -0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.19 1i79 s LYS 12 Cb -0.10 -3.24 0.01 0.00 -0.52 0.00 0.00 37.83 33.98 1i79 s LYS 12 CO 0.34 0.44 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.91 1i79 s LEU 13 N -0.09 1.66 -0.10 3.17 2.96 -1.26 -5.12 118.68 119.90 1i79 s LEU 13 Ca 0.09 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.65 1i79 s LEU 13 Cb -0.12 -1.00 0.00 0.00 0.50 0.00 0.00 46.19 45.58 1i79 s LEU 13 CO 0.00 0.01 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.61 1i79 s LEU 14 N 0.93 2.04 -0.07 -0.68 2.96 -1.26 -5.11 118.68 117.49 1i79 s LEU 14 Ca -0.08 -0.54 0.00 0.00 -0.22 0.00 0.00 54.13 53.29 1i79 s LEU 14 Cb -0.15 -1.35 0.02 0.00 0.50 0.00 0.00 46.19 45.21 1i79 s LEU 14 CO -0.00 0.13 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.41 1i79 s GLU 15 N 0.49 0.97 -0.03 1.98 2.12 -1.26 -5.14 118.70 117.83 1i79 s GLU 15 Ca -0.16 -0.10 0.03 0.00 0.36 0.00 0.00 54.97 55.10 1i79 s GLU 15 Cb -0.17 -1.05 0.00 0.00 0.26 0.00 0.00 34.13 33.16 1i79 s GLU 15 CO 0.06 -0.16 -0.11 0.08 -0.54 0.00 0.00 175.26 174.58 1i79 s VAL 16 N 1.32 0.96 -0.21 3.70 1.01 -1.26 -5.12 120.40 120.81 1i79 s VAL 16 Ca -0.04 -0.47 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 1i79 s VAL 16 Cb -0.14 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1i79 s VAL 16 CO -0.02 0.29 -0.04 0.26 0.00 0.00 0.00 175.10 175.58 1i79 s TRP 17 N 0.11 2.96 0.19 5.22 0.52 -1.26 -5.11 118.94 121.57 1i79 s TRP 17 Ca -0.02 -0.86 0.03 0.00 0.02 0.00 0.00 56.10 55.26 1i79 s TRP 17 Cb -0.09 -2.09 -0.03 0.00 -1.15 0.00 0.00 33.47 30.11 1i79 s TRP 17 CO 0.01 -0.49 0.33 -0.06 0.02 0.00 0.00 176.95 176.76 1i79 s PHE 18 N 1.36 3.48 0.19 -1.98 0.40 -1.26 -5.12 117.98 115.05 1i79 s PHE 18 Ca 0.04 0.11 -0.14 0.00 -0.60 0.00 0.00 56.93 56.34 1i79 s PHE 18 Cb -0.14 -1.67 0.01 0.00 0.51 0.00 0.00 43.02 41.73 1i79 s PHE 18 CO -0.02 0.46 0.44 -1.54 0.70 0.00 0.00 175.22 175.26 1i79 s SER 19 N -3.48 -0.13 -0.14 1.36 1.04 -1.26 -5.16 113.70 105.93 1i79 s SER 19 Ca 0.35 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1i79 s SER 19 Cb -0.10 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 1i79 s SER 19 CO 0.29 -1.02 -0.14 -0.60 0.98 0.00 0.00 173.24 172.75 1i79 s ARG 20 N -3.93 3.31 0.25 4.02 3.52 -1.26 -5.00 118.95 119.86 1i79 s ARG 20 Ca 0.14 -0.72 -0.04 0.00 -0.13 0.00 0.00 55.73 54.98 1i79 s ARG 20 Cb 0.00 -2.61 0.40 0.00 -1.56 0.00 0.00 34.95 31.19 1i79 s ARG 20 CO 0.00 0.15 1.82 0.37 -0.81 0.00 0.00 175.30 176.83 1i79 h GLN 21 N 6.90 0.84 0.00 5.12 4.15 -2.03 -3.47 115.11 126.62 1i79 h GLN 21 Ca -0.27 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1i79 h GLN 21 Cb 1.21 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1i79 h GLN 21 CO 0.55 0.55 0.00 0.94 -1.93 0.00 0.00 178.83 178.94 1i79 n GLN 22 N -4.70 0.00 -0.94 1.69 -0.06 -1.26 -5.35 117.38 106.76 1i79 n GLN 22 Ca 0.14 0.00 -0.28 0.00 -2.00 0.00 0.00 57.00 54.85 1i79 n GLN 22 Cb 0.26 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 26.42 1i79 n GLN 22 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1i79 n PRO 23 N 0.00 2.48 0.00 3.69 -0.04 -1.26 -5.24 135.00 134.63 1i79 n PRO 23 Ca 0.00 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 61.75 1i79 n PRO 23 Cb 0.00 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 30.86 1i79 n PRO 23 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1i79 n GLN 27 N 4.31 0.82 0.00 0.54 7.27 -1.26 -5.27 117.38 123.79 1i79 n GLN 27 Ca 0.54 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.61 1i79 n GLN 27 Cb 0.18 -0.65 0.00 0.00 2.41 0.00 0.00 30.24 32.18 1i79 n GLN 27 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1i79 n GLY 28 N 1.51 -1.29 0.15 1.69 0.00 -1.26 -4.57 105.19 101.42 1i79 n GLY 28 Ca 0.00 -1.58 0.02 0.00 0.00 0.00 0.00 46.02 44.46 1i79 n GLY 28 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1i79 h SER 29 N 0.00 0.00 -0.75 1.61 4.64 -2.04 -3.47 113.55 113.54 1i79 h SER 29 Ca 0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1i79 h SER 29 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1i79 h SER 29 CO 0.00 0.53 -0.18 0.61 -0.87 0.00 0.00 176.83 176.92 1i79 n GLY 30 N 0.83 0.54 3.40 -0.77 0.00 -1.26 -5.00 105.19 102.93 1i79 n GLY 30 Ca 0.01 -0.62 -0.06 0.00 0.00 0.00 0.00 46.02 45.35 1i79 n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1i79 s ASP 31 N -2.78 -0.57 0.60 1.61 -1.08 -1.26 -5.03 116.67 108.15 1i79 s ASP 31 Ca 0.00 1.19 0.31 0.00 -0.52 0.00 0.00 52.55 53.53 1i79 s ASP 31 Cb 0.00 1.69 1.87 0.00 -1.46 0.00 0.00 42.92 45.02 1i79 s ASP 31 CO 0.00 -0.23 2.26 -0.07 0.52 0.00 0.00 175.17 177.65 1i79 h LEU 32 N 8.11 0.00 -0.25 -1.34 3.38 -1.99 -1.97 115.31 121.24 1i79 h LEU 32 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1i79 h LEU 32 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1i79 h LEU 32 CO 0.11 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.18 1i79 n ARG 33 N -3.78 0.05 0.22 1.13 1.74 -1.26 -1.87 116.66 112.88 1i79 n ARG 33 Ca -0.03 0.37 0.10 0.00 -0.77 0.00 0.00 57.85 57.52 1i79 n ARG 33 Cb 0.10 -1.61 0.38 0.00 -1.02 0.00 0.00 32.46 30.30 1i79 n ARG 33 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1i79 h THR 34 N 0.00 0.42 -2.52 0.55 2.02 -1.78 -3.44 112.91 108.16 1i79 h THR 34 Ca 0.00 -1.18 -0.53 0.00 0.77 0.00 0.00 66.41 65.47 1i79 h THR 34 Cb 0.20 1.87 0.04 0.00 -1.74 0.00 0.00 68.15 68.52 1i79 h THR 34 CO 0.00 0.19 1.13 -0.63 0.37 0.00 0.00 175.52 176.58 1i79 s ILE 35 N -3.46 2.59 0.65 3.11 1.01 -0.78 -4.93 121.20 119.38 1i79 s ILE 35 Ca 0.02 0.05 -0.16 0.00 0.00 0.00 0.00 60.65 60.56 1i79 s ILE 35 Cb 0.09 -3.03 -0.01 0.00 0.01 0.00 0.00 42.46 39.52 1i79 s ILE 35 CO 0.64 -0.00 1.16 -2.84 0.00 0.00 0.00 174.94 173.90 1i79 s PRO 36 N 2.94 2.74 0.23 2.79 0.02 -1.26 -4.94 135.00 137.52 1i79 s PRO 36 Ca 0.82 1.60 -0.07 0.00 0.02 0.00 0.00 61.00 63.37 1i79 s PRO 36 Cb -0.46 -1.92 0.29 0.00 0.02 0.00 0.00 34.50 32.44 1i79 s PRO 36 CO 0.37 -1.34 1.84 -0.09 -0.33 0.00 0.00 177.00 177.45 1i79 h ARG 37 N 0.28 0.84 -0.82 5.54 9.65 -1.95 -1.55 114.38 126.37 1i79 h ARG 37 Ca -0.48 -0.05 0.14 0.00 -1.10 0.00 0.00 59.98 58.49 1i79 h ARG 37 Cb 1.27 -0.19 -0.06 0.00 -1.39 0.00 0.00 29.97 29.60 1i79 h ARG 37 CO 0.53 0.56 0.54 0.66 2.80 0.00 0.00 179.97 185.06 1i79 h SER 38 N 0.86 0.53 0.60 -3.80 4.64 -2.00 -0.52 113.55 113.87 1i79 h SER 38 Ca 0.34 0.03 -0.18 0.00 -0.47 0.00 0.00 61.79 61.52 1i79 h SER 38 Cb 0.17 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1i79 h SER 38 CO -0.17 0.27 -0.79 -0.33 -0.87 0.00 0.00 176.83 174.94 1i79 h GLU 39 N 0.56 0.14 -0.38 4.77 4.39 -1.66 -2.71 114.58 119.70 1i79 h GLU 39 Ca 0.41 -0.14 -0.16 0.00 0.34 0.00 0.00 59.36 59.81 1i79 h GLU 39 Cb 0.77 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 1i79 h GLU 39 CO -0.16 0.86 -0.39 -1.49 -1.16 0.00 0.00 179.01 176.67 1i79 h TRP 40 N 0.09 1.12 -0.96 4.33 -0.00 -0.94 -1.49 115.95 118.10 1i79 h TRP 40 Ca -0.03 -0.34 0.04 0.00 -0.00 0.00 0.00 58.89 58.56 1i79 h TRP 40 Cb 1.38 -0.23 -0.06 0.00 -0.00 0.00 0.00 29.16 30.25 1i79 h TRP 40 CO 0.02 1.17 0.63 -0.44 -0.00 0.00 0.00 178.44 179.82 1i79 h ASP 41 N 0.75 1.05 -0.18 -3.49 3.32 -1.12 -0.16 116.42 116.58 1i79 h ASP 41 Ca 0.06 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 1i79 h ASP 41 Cb 0.99 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1i79 h ASP 41 CO 0.10 0.72 -0.32 0.40 -1.72 0.00 0.00 179.24 178.41 1i79 h ILE 42 N 1.22 1.34 -0.42 0.35 2.04 -1.34 -2.90 117.51 117.79 1i79 h ILE 42 Ca 0.38 -1.55 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 1i79 h ILE 42 Cb -0.00 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 1i79 h ILE 42 CO -0.12 0.47 0.25 0.25 0.00 0.00 0.00 178.15 179.00 1i79 h LEU 43 N 0.19 0.51 -1.94 1.44 6.46 -0.95 -2.80 115.31 118.22 1i79 h LEU 43 Ca 0.01 -0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.71 1i79 h LEU 43 Cb 0.91 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 40.71 1i79 h LEU 43 CO 0.07 0.42 -0.01 -0.07 -0.62 0.00 0.00 178.44 178.24 1i79 h LEU 44 N 0.56 0.00 -0.96 2.25 3.38 -1.06 -2.91 115.31 116.57 1i79 h LEU 44 Ca 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1i79 h LEU 44 Cb 0.01 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1i79 h LEU 44 CO -0.03 0.01 0.48 0.11 0.09 0.00 0.00 178.44 179.10 1i79 h LYS 45 N 0.00 1.22 0.00 1.13 1.57 -1.28 -1.75 116.57 117.45 1i79 h LYS 45 Ca -0.00 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.58 1i79 h LYS 45 Cb 0.35 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1i79 h LYS 45 CO 0.00 0.88 -0.31 -0.44 -0.57 0.00 0.00 179.45 179.02 1i79 h ASP 46 N 1.22 0.00 1.76 0.86 5.19 -1.63 -2.55 116.42 121.28 1i79 h ASP 46 Ca 0.31 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.72 1i79 h ASP 46 Cb 0.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.53 1i79 h ASP 46 CO -0.05 0.31 -0.16 0.58 -3.12 0.00 0.00 179.24 176.80 1i79 h VAL 47 N 0.00 0.00 -1.43 -1.35 2.07 -1.45 -3.48 116.25 110.60 1i79 h VAL 47 Ca -0.00 -0.92 -0.06 0.00 0.82 0.00 0.00 66.70 66.53 1i79 h VAL 47 Cb 0.66 1.84 0.02 0.00 -1.52 0.00 0.00 31.29 32.29 1i79 h VAL 47 CO 0.04 0.00 -0.10 0.00 0.02 0.00 0.00 177.57 177.54 1i79 n GLN 48 N -2.91 -0.97 -4.06 1.57 6.02 -0.73 -5.07 117.38 111.23 1i79 n GLN 48 Ca 0.04 0.13 -0.10 0.00 -0.01 0.00 0.00 57.00 57.05 1i79 n GLN 48 Cb 0.52 -3.18 -0.07 0.00 1.02 0.00 0.00 30.24 28.53 1i79 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1i79 s SER 50 N -3.06 0.10 0.00 0.00 1.04 -0.70 -4.12 113.70 106.96 1i79 s SER 50 Ca 0.27 -0.87 -0.30 0.00 0.48 0.00 0.00 55.95 55.53 1i79 s SER 50 Cb 0.03 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 1i79 s SER 50 CO 0.08 -0.83 1.05 -0.63 0.98 0.00 0.00 173.24 173.89 1i79 s ILE 51 N -3.95 4.62 -0.03 -1.02 1.01 -1.26 -0.98 121.20 119.59 1i79 s ILE 51 Ca 0.15 1.88 0.01 0.00 0.00 0.00 0.00 60.65 62.70 1i79 s ILE 51 Cb 0.04 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 1i79 s ILE 51 CO -0.02 0.12 0.04 2.30 0.00 0.00 0.00 174.94 177.38 1i79 n ILE 52 N 4.02 0.00 -3.67 2.92 -5.35 -0.54 -4.93 119.36 111.81 1i79 n ILE 52 Ca 0.07 -0.22 -0.15 0.00 -0.27 0.00 0.00 62.75 62.19 1i79 n ILE 52 Cb 0.49 0.70 -0.08 0.00 -1.74 0.00 0.00 39.64 39.01 1i79 n ILE 52 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1i79 s SER 53 N -1.72 -0.48 -0.02 7.28 0.15 -1.12 -4.98 113.70 112.80 1i79 s SER 53 Ca -0.00 0.70 0.01 0.00 0.70 0.00 0.00 55.95 57.36 1i79 s SER 53 Cb 0.01 0.72 0.02 0.00 -1.71 0.00 0.00 66.02 65.06 1i79 s SER 53 CO 0.06 -0.37 -0.01 -0.69 1.20 0.00 0.00 173.24 173.43 1i79 s VAL 54 N -0.56 0.17 -0.06 4.45 1.01 -1.26 -1.05 120.40 123.10 1i79 s VAL 54 Ca -0.07 0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.96 1i79 s VAL 54 Cb -0.03 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 36.14 1i79 s VAL 54 CO 0.04 0.12 -0.06 -0.89 0.00 0.00 0.00 175.10 174.31 1i79 s THR 55 N 0.71 0.70 -0.03 3.92 2.01 0.15 -5.01 115.64 118.08 1i79 s THR 55 Ca -0.07 -0.18 0.07 0.00 0.31 0.00 0.00 61.69 61.82 1i79 s THR 55 Cb -0.10 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 1i79 s THR 55 CO -0.01 0.27 -0.25 -0.54 -0.69 0.00 0.00 174.62 173.41 1i79 s LYS 56 N 1.10 2.21 0.44 4.92 1.02 -1.26 -0.60 119.74 127.58 1i79 s LYS 56 Ca -0.08 -0.90 0.03 0.00 0.02 0.00 0.00 55.97 55.04 1i79 s LYS 56 Cb -0.14 -2.10 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1i79 s LYS 56 CO -0.01 0.54 0.07 0.95 -0.92 0.00 0.00 175.35 175.99 1i79 s THR 57 N -0.56 0.92 0.19 2.17 -4.23 -0.68 -5.04 115.64 108.41 1i79 s THR 57 Ca 0.08 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.47 1i79 s THR 57 Cb -0.11 -2.34 0.11 0.00 1.34 0.00 0.00 72.50 71.50 1i79 s THR 57 CO -0.00 0.00 1.84 0.44 -0.54 0.00 0.00 174.62 176.36 1i79 h ASP 58 N 1.64 0.65 0.96 3.99 3.32 -2.05 -3.23 116.42 121.70 1i79 h ASP 58 Ca -0.39 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1i79 h ASP 58 Cb 1.29 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1i79 h ASP 58 CO 0.65 0.46 -0.93 0.11 -1.72 0.00 0.00 179.24 177.82 1i79 h LYS 59 N 0.78 0.00 -2.47 3.56 1.57 -2.04 -3.49 116.57 114.49 1i79 h LYS 59 Ca 0.24 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1i79 h LYS 59 Cb -0.02 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.13 1i79 h LYS 59 CO -0.08 0.00 0.31 1.14 -0.57 0.00 0.00 179.45 180.25 1i79 s GLN 60 N -3.32 1.05 -0.14 3.15 -2.07 -1.22 -5.15 119.66 111.96 1i79 s GLN 60 Ca 0.01 -0.22 -0.02 0.00 -1.82 0.00 0.00 55.36 53.31 1i79 s GLN 60 Cb 0.10 0.49 -0.03 0.00 -1.09 0.00 0.00 33.01 32.48 1i79 s GLN 60 CO 0.78 -0.43 -0.06 -1.21 -1.32 0.00 0.00 175.29 173.06 1i79 s GLU 61 N -2.82 3.47 -0.08 9.60 2.02 -1.26 -1.69 118.70 127.95 1i79 s GLU 61 Ca -0.01 -0.55 0.04 0.00 0.02 0.00 0.00 54.97 54.48 1i79 s GLU 61 Cb -0.01 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.40 1i79 s GLU 61 CO -0.06 0.31 -0.21 0.00 0.02 0.00 0.00 175.26 175.32 1i79 s ALA 62 N 0.15 2.33 -0.03 5.21 0.00 0.23 -5.00 121.76 124.66 1i79 s ALA 62 Ca -0.03 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.00 1i79 s ALA 62 Cb -0.14 -0.84 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 1i79 s ALA 62 CO 0.03 0.39 -0.22 0.71 0.00 0.00 0.00 175.76 176.67 1i79 s TYR 63 N -0.09 2.04 -0.20 0.00 1.51 -1.26 -0.68 117.35 118.68 1i79 s TYR 63 Ca -0.05 -0.45 -0.09 0.00 -1.01 0.00 0.00 57.07 55.48 1i79 s TYR 63 Cb -0.14 -1.33 -0.05 0.00 -0.11 0.00 0.00 41.96 40.33 1i79 s TYR 63 CO 0.04 -0.08 0.11 0.08 -1.11 0.00 0.00 175.55 174.59 1i79 s VAL 64 N -0.41 5.19 0.37 0.71 1.01 -0.21 -4.99 120.40 122.07 1i79 s VAL 64 Ca 0.05 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.22 1i79 s VAL 64 Cb -0.10 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1i79 s VAL 64 CO 0.00 0.44 0.37 -0.76 0.00 0.00 0.00 175.10 175.15 1i79 s LEU 65 N 0.44 3.59 0.05 3.92 1.43 -1.26 -1.47 118.68 125.37 1i79 s LEU 65 Ca 0.06 -0.53 -0.08 0.00 -1.03 0.00 0.00 54.13 52.56 1i79 s LEU 65 Cb -0.12 -2.28 -0.00 0.00 0.03 0.00 0.00 46.19 43.82 1i79 s LEU 65 CO -0.01 -0.51 0.16 -0.55 0.23 0.00 0.00 176.35 175.67 1i79 s SER 66 N -4.10 0.12 0.00 2.29 0.15 -0.15 -4.84 113.70 107.17 1i79 s SER 66 Ca 0.45 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.59 1i79 s SER 66 Cb -0.06 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 1i79 s SER 66 CO 0.28 -0.59 0.00 -0.62 1.20 0.00 0.00 173.24 173.51