#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8f h THR 15 N 0.00 1.36 -0.36 0.00 1.03 -2.03 -3.17 112.91 109.73 1i8f h THR 15 Ca 0.00 -2.16 -0.05 0.00 -0.01 0.00 0.00 66.41 64.18 1i8f h THR 15 Cb 0.00 2.15 -0.01 0.00 -1.07 0.00 0.00 68.15 69.22 1i8f h THR 15 CO 0.00 0.66 0.03 -0.07 -0.01 0.00 0.00 175.52 176.12 1i8f h LEU 16 N 0.33 0.61 -1.66 0.00 3.38 -2.00 -2.63 115.31 113.35 1i8f h LEU 16 Ca -0.05 -0.29 0.12 0.00 0.09 0.00 0.00 57.88 57.75 1i8f h LEU 16 Cb 1.40 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.94 1i8f h LEU 16 CO 0.14 0.75 0.43 -0.61 0.09 0.00 0.00 178.44 179.24 1i8f h GLN 17 N 0.45 0.35 0.00 1.13 5.75 -1.99 0.44 115.11 121.24 1i8f h GLN 17 Ca 0.11 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1i8f h GLN 17 Cb 0.42 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.89 1i8f h GLN 17 CO 0.01 0.23 -0.01 -0.44 -2.65 0.00 0.00 178.83 175.97 1i8f h ASP 18 N 0.36 0.00 -0.02 -0.69 3.32 -1.45 -3.20 116.42 114.74 1i8f h ASP 18 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1i8f h ASP 18 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1i8f h ASP 18 CO -0.08 0.01 -0.01 -1.20 -1.72 0.00 0.00 179.24 176.24 1i8f n SER 19 N -3.10 2.41 -4.69 6.45 7.64 0.15 -4.91 113.62 117.56 1i8f n SER 19 Ca 0.03 -1.80 -0.44 0.00 1.01 0.00 0.00 58.87 57.67 1i8f n SER 19 Cb 0.47 0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.64 1i8f n SER 19 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1i8f n ILE 20 N 0.87 0.03 -0.27 0.44 2.08 -0.86 -1.06 119.36 120.60 1i8f n ILE 20 Ca 0.16 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.46 1i8f n ILE 20 Cb 0.50 -1.74 0.00 0.00 -0.75 0.00 0.00 39.64 37.65 1i8f n ILE 20 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1i8f n GLY 21 N 3.69 1.21 3.70 7.39 0.00 0.11 -4.98 105.19 116.30 1i8f n GLY 21 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1i8f n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i8f s LYS 22 N -0.45 2.39 0.12 1.61 3.01 -0.22 -4.82 119.74 121.37 1i8f s LYS 22 Ca 0.00 -1.43 -0.30 0.00 -1.01 0.00 0.00 55.97 53.23 1i8f s LYS 22 Cb 0.00 -2.21 -0.06 0.00 -1.01 0.00 0.00 37.83 34.55 1i8f s LYS 22 CO 0.00 0.27 0.99 -1.14 0.51 0.00 0.00 175.35 175.99 1i8f s GLN 23 N -3.76 4.67 0.11 1.68 0.74 -1.26 -1.08 119.66 120.77 1i8f s GLN 23 Ca 0.34 1.51 0.08 0.00 0.05 0.00 0.00 55.36 57.34 1i8f s GLN 23 Cb -0.05 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.67 1i8f s GLN 23 CO 0.21 0.17 -0.19 0.14 -0.55 0.00 0.00 175.29 175.08 1i8f s VAL 24 N -0.01 1.65 -0.17 1.34 -7.23 0.18 -0.74 120.40 115.42 1i8f s VAL 24 Ca 0.48 -1.62 -0.07 0.00 -1.81 0.00 0.00 61.98 58.96 1i8f s VAL 24 Cb -0.25 -1.57 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 1i8f s VAL 24 CO 0.31 -0.16 0.08 -0.22 -0.31 0.00 0.00 175.10 174.79 1i8f s LEU 25 N -2.10 3.93 -0.07 1.32 2.96 0.15 -2.41 118.68 122.47 1i8f s LEU 25 Ca 0.08 0.17 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 1i8f s LEU 25 Cb -0.09 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.63 1i8f s LEU 25 CO 0.04 0.23 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.49 1i8f s VAL 26 N 0.02 1.15 -0.04 1.68 1.01 0.11 -0.30 120.40 124.03 1i8f s VAL 26 Ca 0.07 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 61.61 1i8f s VAL 26 Cb -0.12 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1i8f s VAL 26 CO 0.01 0.36 -0.19 -0.54 0.00 0.00 0.00 175.10 174.73 1i8f s LYS 27 N 0.67 2.38 0.32 2.72 1.02 -1.04 -1.05 119.74 124.76 1i8f s LYS 27 Ca -0.15 -0.80 0.10 0.00 0.02 0.00 0.00 55.97 55.15 1i8f s LYS 27 Cb -0.16 -2.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.85 1i8f s LYS 27 CO 0.04 0.58 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.40 1i8f s LEU 28 N -0.63 2.67 0.85 3.17 1.43 -0.50 -0.57 118.68 125.11 1i8f s LEU 28 Ca 0.10 -1.14 -0.14 0.00 -1.03 0.00 0.00 54.13 51.91 1i8f s LEU 28 Cb -0.11 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 45.10 1i8f s LEU 28 CO 0.00 -0.13 0.46 0.54 0.23 0.00 0.00 176.35 177.46 1i8f n ARG 29 N -0.72 -0.02 -2.03 1.70 5.12 -0.04 -2.77 116.66 117.90 1i8f n ARG 29 Ca -0.05 0.04 -0.11 0.00 -1.93 0.00 0.00 57.85 55.81 1i8f n ARG 29 Cb 0.62 -1.85 -0.01 0.00 -1.16 0.00 0.00 32.46 30.06 1i8f n ARG 29 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1i8f n ASP 30 N -0.87 -3.64 -2.86 0.55 8.00 -1.26 -3.89 116.55 112.57 1i8f n ASP 30 Ca 0.08 0.04 -0.21 0.00 0.71 0.00 0.00 54.79 55.41 1i8f n ASP 30 Cb 0.52 -2.74 0.03 0.00 -0.02 0.00 0.00 41.12 38.92 1i8f n ASP 30 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1i8f n SER 31 N 0.04 -5.94 -4.85 -2.24 7.64 -1.19 -5.01 113.62 102.07 1i8f n SER 31 Ca -0.12 -0.27 -0.36 0.00 1.01 0.00 0.00 58.87 59.13 1i8f n SER 31 Cb 0.55 -4.77 -0.06 0.00 -1.01 0.00 0.00 64.21 58.92 1i8f n SER 31 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1i8f s HIS 32 N -3.15 3.64 -0.08 1.43 3.76 -1.11 -4.96 115.29 114.82 1i8f s HIS 32 Ca 0.28 0.93 -0.00 0.00 -0.15 0.00 0.00 55.06 56.12 1i8f s HIS 32 Cb -0.12 -2.26 0.02 0.00 1.11 0.00 0.00 32.58 31.33 1i8f s HIS 32 CO 0.35 0.54 -0.05 -2.00 -0.85 0.00 0.00 174.74 172.73 1i8f s GLU 33 N -1.63 1.07 0.03 1.40 2.12 -1.26 -1.40 118.70 119.02 1i8f s GLU 33 Ca 0.31 -0.11 0.03 0.00 0.36 0.00 0.00 54.97 55.56 1i8f s GLU 33 Cb -0.15 -1.19 -0.02 0.00 0.26 0.00 0.00 34.13 33.03 1i8f s GLU 33 CO 0.17 -0.21 -0.08 0.42 -0.54 0.00 0.00 175.26 175.02 1i8f s ILE 34 N 1.51 0.63 0.06 -3.70 1.01 -0.21 -1.08 121.20 119.42 1i8f s ILE 34 Ca -0.01 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 59.84 1i8f s ILE 34 Cb -0.13 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 41.68 1i8f s ILE 34 CO -0.04 -0.18 -0.16 -0.13 0.00 0.00 0.00 174.94 174.43 1i8f s ARG 35 N -1.14 0.98 -0.06 2.79 0.52 -0.64 0.08 118.95 121.48 1i8f s ARG 35 Ca -0.05 -0.89 -0.32 0.00 -0.52 0.00 0.00 55.73 53.95 1i8f s ARG 35 Cb -0.08 -1.04 0.13 0.00 0.52 0.00 0.00 34.95 34.49 1i8f s ARG 35 CO 0.00 0.25 1.34 0.20 0.02 0.00 0.00 175.30 177.12 1i8f s GLY 36 N -1.42 -0.43 -0.13 -3.53 0.00 -1.01 -0.04 107.32 100.76 1i8f s GLY 36 Ca 0.02 0.88 -0.22 0.00 0.00 0.00 0.00 44.72 45.39 1i8f s GLY 36 CO 0.02 0.18 0.67 -0.42 0.00 0.00 0.00 173.10 173.55 1i8f s ILE 37 N -2.27 5.03 -0.25 0.90 -1.09 0.25 -0.65 121.20 123.12 1i8f s ILE 37 Ca 0.14 1.34 -0.29 0.00 -2.23 0.00 0.00 60.65 59.61 1i8f s ILE 37 Cb 0.05 -4.00 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 1i8f s ILE 37 CO -0.05 0.18 1.18 -0.22 -1.23 0.00 0.00 174.94 174.80 1i8f s LEU 38 N 1.33 4.03 -0.23 2.97 2.96 -0.24 -1.14 118.68 128.35 1i8f s LEU 38 Ca 0.34 1.35 0.10 0.00 -0.22 0.00 0.00 54.13 55.69 1i8f s LEU 38 Cb -0.17 -3.54 -0.21 0.00 0.50 0.00 0.00 46.19 42.77 1i8f s LEU 38 CO 0.14 -0.85 -0.07 0.54 -1.32 0.00 0.00 176.35 174.78 1i8f n ARG 39 N 6.80 0.67 -3.67 1.98 5.12 0.30 0.07 116.66 127.92 1i8f n ARG 39 Ca 0.13 0.08 -0.09 0.00 -1.93 0.00 0.00 57.85 56.03 1i8f n ARG 39 Cb 0.46 -1.52 -0.02 0.00 -1.16 0.00 0.00 32.46 30.21 1i8f n ARG 39 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1i8f s SER 40 N -6.02 -0.38 0.20 0.55 1.04 -1.16 -4.84 113.70 103.08 1i8f s SER 40 Ca -0.23 -0.36 -0.21 0.00 0.48 0.00 0.00 55.95 55.64 1i8f s SER 40 Cb 0.08 0.66 0.05 0.00 0.10 0.00 0.00 66.02 66.90 1i8f s SER 40 CO 0.71 -1.17 0.60 0.72 0.98 0.00 0.00 173.24 175.09 1i8f s PHE 41 N -3.85 -0.34 0.10 5.02 -0.71 -1.26 -0.95 117.98 115.99 1i8f s PHE 41 Ca 0.07 0.03 0.01 0.00 -1.04 0.00 0.00 56.93 56.00 1i8f s PHE 41 Cb -0.03 0.54 -0.00 0.00 -1.21 0.00 0.00 43.02 42.31 1i8f s PHE 41 CO -0.02 -0.96 0.05 -0.40 -1.34 0.00 0.00 175.22 172.55 1i8f n ASP 42 N -0.38 0.75 0.00 1.98 5.68 -1.12 -5.00 116.55 118.46 1i8f n ASP 42 Ca -0.12 -1.56 0.09 0.00 -0.50 0.00 0.00 54.79 52.70 1i8f n ASP 42 Cb 0.63 0.30 0.44 0.00 -1.14 0.00 0.00 41.12 41.35 1i8f n ASP 42 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1i8f n GLN 43 N -0.22 0.14 -0.09 0.11 10.64 -1.26 -1.99 117.38 124.71 1i8f n GLN 43 Ca -0.01 0.14 0.11 0.00 -1.83 0.00 0.00 57.00 55.41 1i8f n GLN 43 Cb 0.16 -1.50 0.15 0.00 -0.86 0.00 0.00 30.24 28.18 1i8f n GLN 43 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1i8f n HIS 44 N -1.39 0.24 -1.22 2.61 -0.00 -1.26 -4.94 115.22 109.25 1i8f n HIS 44 Ca 0.07 -0.13 -0.08 0.00 -0.00 0.00 0.00 57.72 57.58 1i8f n HIS 44 Cb 0.19 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.14 1i8f n HIS 44 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1i8f n VAL 45 N 1.30 0.00 -2.12 1.59 0.31 -0.84 -3.97 118.33 114.59 1i8f n VAL 45 Ca 0.15 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 64.11 1i8f n VAL 45 Cb 0.56 -1.03 0.01 0.00 -0.91 0.00 0.00 33.84 32.46 1i8f n VAL 45 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1i8f s ASN 46 N -2.79 5.83 0.07 4.52 0.01 -1.26 -3.62 114.94 117.69 1i8f s ASN 46 Ca 0.00 2.41 0.06 0.00 -0.71 0.00 0.00 52.86 54.63 1i8f s ASN 46 Cb 0.00 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 39.02 1i8f s ASN 46 CO 0.00 -1.16 -0.17 -0.76 -1.51 0.00 0.00 177.10 173.50 1i8f s LEU 47 N -3.30 2.23 -0.21 0.60 1.43 -0.27 -2.81 118.68 116.35 1i8f s LEU 47 Ca 0.67 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 53.19 1i8f s LEU 47 Cb -0.31 -0.72 0.01 0.00 0.03 0.00 0.00 46.19 45.20 1i8f s LEU 47 CO 0.37 0.03 -0.11 -0.22 0.23 0.00 0.00 176.35 176.65 1i8f s LEU 48 N -1.51 2.64 0.03 1.79 2.96 -0.12 -0.96 118.68 123.50 1i8f s LEU 48 Ca 0.03 -0.62 0.06 0.00 -0.22 0.00 0.00 54.13 53.38 1i8f s LEU 48 Cb -0.09 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 1i8f s LEU 48 CO 0.02 -0.04 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.10 1i8f s LEU 49 N 1.36 2.72 0.22 -0.68 1.43 0.08 -0.54 118.68 123.27 1i8f s LEU 49 Ca 0.04 -0.35 0.11 0.00 -1.03 0.00 0.00 54.13 52.89 1i8f s LEU 49 Cb -0.14 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 1i8f s LEU 49 CO -0.08 0.27 -0.16 -1.61 0.23 0.00 0.00 176.35 175.00 1i8f s GLU 50 N -1.38 1.80 -1.48 1.70 2.02 -0.30 -0.58 118.70 120.48 1i8f s GLU 50 Ca 0.15 -1.50 -0.12 0.00 0.02 0.00 0.00 54.97 53.52 1i8f s GLU 50 Cb -0.11 -1.95 0.09 0.00 0.10 0.00 0.00 34.13 32.26 1i8f s GLU 50 CO 0.05 0.39 0.76 -0.25 0.02 0.00 0.00 175.26 176.23 1i8f n ASP 51 N -0.13 -4.35 -4.81 -0.19 8.00 -0.74 -0.58 116.55 113.75 1i8f n ASP 51 Ca -0.10 -0.64 -0.32 0.00 0.71 0.00 0.00 54.79 54.44 1i8f n ASP 51 Cb 0.57 -3.52 0.03 0.00 -0.02 0.00 0.00 41.12 38.18 1i8f n ASP 51 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i8f s ALA 52 N -3.16 2.72 -0.03 2.24 0.00 0.19 -4.54 121.76 119.19 1i8f s ALA 52 Ca 0.56 0.26 -0.18 0.00 0.00 0.00 0.00 51.96 52.60 1i8f s ALA 52 Cb -0.29 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.66 1i8f s ALA 52 CO 0.69 -0.97 0.39 -1.83 0.00 0.00 0.00 175.76 174.05 1i8f s GLU 53 N -4.48 0.74 -0.01 0.00 -1.05 0.94 -0.27 118.70 114.58 1i8f s GLU 53 Ca 0.61 -0.05 -0.03 0.00 -0.15 0.00 0.00 54.97 55.35 1i8f s GLU 53 Cb -0.15 0.33 -0.04 0.00 -0.44 0.00 0.00 34.13 33.83 1i8f s GLU 53 CO 0.44 -0.21 0.19 -1.21 0.95 0.00 0.00 175.26 175.43 1i8f s GLU 54 N -1.21 3.46 -0.27 -4.83 2.02 0.22 -1.63 118.70 116.46 1i8f s GLU 54 Ca -0.12 -0.29 -0.05 0.00 0.02 0.00 0.00 54.97 54.53 1i8f s GLU 54 Cb -0.04 -3.09 0.01 0.00 0.10 0.00 0.00 34.13 31.11 1i8f s GLU 54 CO 0.05 0.67 0.03 0.42 0.02 0.00 0.00 175.26 176.45 1i8f s ILE 55 N -1.33 3.64 -0.11 -1.63 1.09 -0.24 -0.64 121.20 121.98 1i8f s ILE 55 Ca 0.27 -0.74 -0.01 0.00 -1.10 0.00 0.00 60.65 59.07 1i8f s ILE 55 Cb -0.13 -2.84 0.03 0.00 -1.06 0.00 0.00 42.46 38.47 1i8f s ILE 55 CO 0.18 0.16 -0.01 -0.63 -0.10 0.00 0.00 174.94 174.54 1i8f s ILE 56 N 1.46 0.57 -1.46 2.92 1.01 0.16 -4.33 121.20 121.52 1i8f s ILE 56 Ca 0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 1i8f s ILE 56 Cb -0.17 -0.77 0.05 0.00 0.01 0.00 0.00 42.46 41.58 1i8f s ILE 56 CO 0.00 0.18 0.91 0.47 0.00 0.00 0.00 174.94 176.50 1i8f n ASP 57 N 5.07 -5.39 0.00 3.58 8.00 -1.26 -1.50 116.55 125.05 1i8f n ASP 57 Ca -0.09 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.84 1i8f n ASP 57 Cb 0.49 -4.31 0.00 0.00 -0.02 0.00 0.00 41.12 37.28 1i8f n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i8f n GLY 58 N -1.69 0.79 3.90 0.44 0.00 -1.26 -5.00 105.19 102.36 1i8f n GLY 58 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1i8f n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1i8f s ASN 59 N -2.73 6.30 -0.14 1.61 0.02 -0.56 -5.09 114.94 114.35 1i8f s ASN 59 Ca 0.00 0.31 -0.04 0.00 -1.02 0.00 0.00 52.86 52.11 1i8f s ASN 59 Cb 0.00 -1.96 -0.03 0.00 0.02 0.00 0.00 41.25 39.28 1i8f s ASN 59 CO 0.00 0.25 -0.00 0.68 0.02 0.00 0.00 177.10 178.05 1i8f s VAL 60 N -1.35 4.26 -0.24 1.60 -7.23 -1.26 0.35 120.40 116.53 1i8f s VAL 60 Ca 0.28 -0.24 0.02 0.00 -1.81 0.00 0.00 61.98 60.24 1i8f s VAL 60 Cb -0.13 -2.85 0.05 0.00 0.56 0.00 0.00 36.38 34.01 1i8f s VAL 60 CO 0.20 0.53 -0.13 -0.31 -0.31 0.00 0.00 175.10 175.07 1i8f s TYR 61 N -0.09 3.12 0.12 2.82 2.02 0.19 -4.96 117.35 120.57 1i8f s TYR 61 Ca 0.04 -2.13 -0.31 0.00 -0.37 0.00 0.00 57.07 54.30 1i8f s TYR 61 Cb -0.13 -1.92 -0.07 0.00 -0.40 0.00 0.00 41.96 39.44 1i8f s TYR 61 CO 0.02 -0.86 1.29 -1.59 -1.57 0.00 0.00 175.55 172.84 1i8f s LYS 62 N 1.16 4.39 -0.01 -0.62 -2.85 -1.26 -0.61 119.74 119.93 1i8f s LYS 62 Ca -0.05 1.94 0.01 0.00 -1.00 0.00 0.00 55.97 56.87 1i8f s LYS 62 Cb -0.18 -3.27 -0.02 0.00 -2.06 0.00 0.00 37.83 32.30 1i8f s LYS 62 CO -0.07 -0.30 0.01 0.54 0.10 0.00 0.00 175.35 175.63 1i8f n ARG 63 N 3.53 3.52 0.00 1.78 5.12 0.63 -4.94 116.66 126.30 1i8f n ARG 63 Ca 0.09 -0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 1i8f n ARG 63 Cb 0.44 -1.04 0.00 0.00 -1.16 0.00 0.00 32.46 30.70 1i8f n ARG 63 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1i8f n GLY 64 N 2.88 1.13 3.76 -0.13 0.00 -0.90 -4.89 105.19 107.04 1i8f n GLY 64 Ca -0.02 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 1i8f n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i8f s THR 65 N 0.00 4.65 -0.11 2.61 2.01 -1.26 0.58 115.64 124.12 1i8f s THR 65 Ca 0.00 1.62 -0.07 0.00 0.31 0.00 0.00 61.69 63.55 1i8f s THR 65 Cb 0.00 -4.11 0.04 0.00 0.01 0.00 0.00 72.50 68.44 1i8f s THR 65 CO 0.00 0.41 0.26 -0.32 -0.69 0.00 0.00 174.62 174.28 1i8f s MET 66 N -0.35 0.25 -0.11 4.92 0.00 0.26 -4.95 119.30 119.32 1i8f s MET 66 Ca 0.37 0.49 -0.02 0.00 0.00 0.00 0.00 55.69 56.53 1i8f s MET 66 Cb -0.21 -0.02 -0.03 0.00 0.00 0.00 0.00 34.83 34.57 1i8f s MET 66 CO 0.23 -0.12 -0.03 0.14 0.00 0.00 0.00 175.02 175.25 1i8f s VAL 67 N 0.88 4.01 -0.10 10.11 -7.23 -1.26 -0.74 120.40 126.07 1i8f s VAL 67 Ca -0.06 -0.34 0.04 0.00 -1.81 0.00 0.00 61.98 59.81 1i8f s VAL 67 Cb -0.07 -2.70 -0.00 0.00 0.56 0.00 0.00 36.38 34.16 1i8f s VAL 67 CO -0.06 0.56 -0.24 -0.69 -0.31 0.00 0.00 175.10 174.36 1i8f s VAL 68 N -0.37 2.10 0.10 1.32 1.01 -0.13 -4.98 120.40 119.44 1i8f s VAL 68 Ca 0.06 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 1i8f s VAL 68 Cb -0.12 -1.80 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 1i8f s VAL 68 CO 0.02 0.56 1.03 -0.13 0.00 0.00 0.00 175.10 176.59 1i8f s ARG 69 N 0.31 4.60 0.39 2.72 0.52 -1.26 -1.12 118.95 125.11 1i8f s ARG 69 Ca -0.18 1.56 0.12 0.00 -0.52 0.00 0.00 55.73 56.71 1i8f s ARG 69 Cb -0.18 -3.37 0.78 0.00 0.52 0.00 0.00 34.95 32.70 1i8f s ARG 69 CO 0.09 0.05 1.87 0.78 0.02 0.00 0.00 175.30 178.11 1i8f h GLY 70 N 5.91 0.08 0.91 -3.53 0.00 -1.69 -3.04 103.07 101.72 1i8f h GLY 70 Ca -0.43 -0.06 0.09 0.00 0.00 0.00 0.00 47.33 46.93 1i8f h GLY 70 CO 0.74 0.05 0.46 0.83 0.00 0.00 0.00 176.54 178.63 1i8f h GLU 71 N 0.07 0.00 -0.19 4.80 3.07 -1.88 -1.54 114.58 118.91 1i8f h GLU 71 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1i8f h GLU 71 Cb 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1i8f h GLU 71 CO 0.04 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.74 1i8f n ASN 72 N -3.41 2.44 -4.71 1.42 3.02 -1.15 -5.00 115.26 107.88 1i8f n ASN 72 Ca 0.05 -1.75 -0.42 0.00 -0.03 0.00 0.00 54.58 52.43 1i8f n ASN 72 Cb 0.60 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.62 1i8f n ASN 72 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1i8f s VAL 73 N -0.95 4.21 -0.15 2.41 1.01 -0.58 -0.86 120.40 125.48 1i8f s VAL 73 Ca 0.18 1.58 -0.11 0.00 0.00 0.00 0.00 61.98 63.62 1i8f s VAL 73 Cb 0.10 -4.01 -0.07 0.00 0.00 0.00 0.00 36.38 32.40 1i8f s VAL 73 CO 0.14 0.09 -0.02 -0.07 0.00 0.00 0.00 175.10 175.24 1i8f h LEU 74 N 7.15 0.00 -7.57 3.92 3.38 -1.16 -3.47 115.31 117.56 1i8f h LEU 74 Ca -0.40 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.37 1i8f h LEU 74 Cb 1.20 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.83 1i8f h LEU 74 CO 0.82 0.88 -0.07 0.72 0.09 0.00 0.00 178.44 180.89 1i8f s PHE 75 N -2.16 -0.11 -0.04 1.13 -0.12 -1.17 -5.01 117.98 110.50 1i8f s PHE 75 Ca -0.16 -0.23 0.02 0.00 -0.05 0.00 0.00 56.93 56.52 1i8f s PHE 75 Cb 0.02 0.27 0.01 0.00 -0.63 0.00 0.00 43.02 42.69 1i8f s PHE 75 CO 0.29 -0.78 -0.09 0.42 -0.05 0.00 0.00 175.22 175.01 1i8f s ILE 76 N -3.85 0.84 -0.12 -4.49 1.01 -1.26 -2.48 121.20 110.85 1i8f s ILE 76 Ca 0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 1i8f s ILE 76 Cb 0.01 -0.77 0.04 0.00 0.01 0.00 0.00 42.46 41.75 1i8f s ILE 76 CO -0.08 0.27 0.03 -0.55 0.00 0.00 0.00 174.94 174.61 1i8f s SER 77 N 0.45 2.06 0.30 3.58 0.15 0.59 -4.97 113.70 115.86 1i8f s SER 77 Ca -0.08 -0.37 -0.30 0.00 0.70 0.00 0.00 55.95 55.91 1i8f s SER 77 Cb -0.12 -0.44 -0.11 0.00 -1.71 0.00 0.00 66.02 63.64 1i8f s SER 77 CO 0.01 -0.25 1.58 -2.84 1.20 0.00 0.00 173.24 172.94 1i8f s PRO 78 N 1.97 4.12 -0.17 5.44 0.02 -1.26 0.34 135.00 145.47 1i8f s PRO 78 Ca 0.03 2.57 -0.29 0.00 0.02 0.00 0.00 61.00 63.33 1i8f s PRO 78 Cb -0.14 -3.02 -0.01 0.00 0.02 0.00 0.00 34.50 31.34 1i8f s PRO 78 CO -0.06 -0.62 1.26 0.08 -0.33 0.00 0.00 177.00 177.33 1i8f s VAL 79 N -0.10 4.29 -0.11 3.83 1.01 0.08 -4.81 120.40 124.59 1i8f s VAL 79 Ca 0.62 1.56 -0.37 0.00 0.00 0.00 0.00 61.98 63.79 1i8f s VAL 79 Cb -0.48 -4.00 -0.15 0.00 0.00 0.00 0.00 36.38 31.75 1i8f s VAL 79 CO 0.49 -0.14 1.69 -2.65 0.00 0.00 0.00 175.10 174.49 1i8f n PRO 80 N 6.60 1.54 0.00 2.72 -0.02 -1.26 -4.87 135.00 139.72 1i8f n PRO 80 Ca 0.14 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1i8f n PRO 80 Cb 0.45 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1i8f n PRO 80 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89