#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v6g s SER 2 N 0.00 5.71 -0.38 1.61 1.04 -1.26 -5.09 113.70 115.33 1v6g s SER 2 Ca 0.00 0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.47 1v6g s SER 2 Cb 0.00 -1.58 0.13 0.00 0.10 0.00 0.00 66.02 64.66 1v6g s SER 2 CO 0.00 0.15 0.19 -0.94 0.98 0.00 0.00 173.24 173.63 1v6g s SER 3 N -2.54 3.60 0.38 7.02 1.04 -1.26 -5.12 113.70 116.82 1v6g s SER 3 Ca 0.31 -2.26 0.04 0.00 0.48 0.00 0.00 55.95 54.52 1v6g s SER 3 Cb -0.12 -0.84 -0.04 0.00 0.10 0.00 0.00 66.02 65.11 1v6g s SER 3 CO 0.24 -0.32 0.08 -0.83 0.98 0.00 0.00 173.24 173.39 1v6g s GLY 4 N 0.86 2.38 -0.03 7.32 0.00 -1.26 -5.17 107.32 111.42 1v6g s GLY 4 Ca 0.16 -1.60 -0.04 0.00 0.00 0.00 0.00 44.72 43.24 1v6g s GLY 4 CO -0.07 -1.86 0.10 -1.35 0.00 0.00 0.00 173.10 169.93 1v6g s SER 5 N -3.57 -0.06 -0.00 1.64 1.04 -1.26 -5.16 113.70 106.32 1v6g s SER 5 Ca 0.29 0.07 -0.23 0.00 0.48 0.00 0.00 55.95 56.56 1v6g s SER 5 Cb 0.06 0.21 0.05 0.00 0.10 0.00 0.00 66.02 66.44 1v6g s SER 5 CO 0.14 -0.13 0.51 -0.94 0.98 0.00 0.00 173.24 173.81 1v6g s SER 6 N -0.36 -0.44 0.26 7.02 1.04 -1.26 -5.14 113.70 114.81 1v6g s SER 6 Ca -0.04 0.33 -0.29 0.00 0.48 0.00 0.00 55.95 56.43 1v6g s SER 6 Cb -0.03 0.46 -0.15 0.00 0.10 0.00 0.00 66.02 66.40 1v6g s SER 6 CO 0.00 -0.61 1.01 0.61 0.98 0.00 0.00 173.24 175.23 1v6g n GLY 7 N 0.82 -0.30 2.55 7.32 0.00 -1.26 -4.92 105.19 109.39 1v6g n GLY 7 Ca -0.19 0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 1v6g n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1v6g n LEU 8 N 1.45 3.54 -0.05 0.99 4.77 -1.26 -4.81 117.00 121.64 1v6g n LEU 8 Ca 0.11 -4.73 -0.21 0.00 -0.03 0.00 0.00 56.01 51.16 1v6g n LEU 8 Cb 0.30 -0.15 -0.13 0.00 -2.33 0.00 0.00 43.42 41.11 1v6g n LEU 8 CO 0.60 2.02 -0.95 0.47 -1.33 0.00 0.00 177.39 178.20 1v6g n ASP 9 N -0.32 2.05 -0.33 -1.43 9.92 -1.26 -4.27 116.55 120.91 1v6g n ASP 9 Ca 0.28 0.16 0.32 0.00 -0.53 0.00 0.00 54.79 55.02 1v6g n ASP 9 Cb 0.71 -0.76 0.59 0.00 -0.64 0.00 0.00 41.12 41.01 1v6g n ASP 9 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 1v6g h TYR 10 N -0.12 0.81 -0.98 1.24 -0.00 -2.02 0.64 116.97 116.54 1v6g h TYR 10 Ca -0.47 0.04 0.31 0.00 -0.00 0.00 0.00 58.73 58.61 1v6g h TYR 10 Cb 1.90 -0.19 -0.15 0.00 -0.00 0.00 0.00 36.73 38.29 1v6g h TYR 10 CO 0.06 -0.43 0.49 -0.56 -0.00 0.00 0.00 178.16 177.71 1v6g h GLN 11 N 0.03 0.25 -0.48 0.10 3.07 -1.96 -0.71 115.11 115.42 1v6g h GLN 11 Ca 0.84 -0.02 0.20 0.00 0.09 0.00 0.00 58.65 59.77 1v6g h GLN 11 Cb 2.24 -0.06 -0.09 0.00 0.08 0.00 0.00 27.48 29.66 1v6g h GLN 11 CO -0.73 0.17 0.26 0.54 0.09 0.00 0.00 178.83 179.15 1v6g n ARG 12 N -5.12 -0.03 -0.93 0.06 5.12 0.22 -4.47 116.66 111.50 1v6g n ARG 12 Ca 0.30 0.66 -0.32 0.00 -1.93 0.00 0.00 57.85 56.56 1v6g n ARG 12 Cb 0.95 -1.19 0.03 0.00 -1.16 0.00 0.00 32.46 31.09 1v6g n ARG 12 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 1v6g n LEU 13 N -4.09 -4.89 -0.31 0.55 -0.00 -0.27 -4.72 117.00 103.27 1v6g n LEU 13 Ca 0.18 0.25 -0.04 0.00 -0.00 0.00 0.00 56.01 56.40 1v6g n LEU 13 Cb 0.62 -0.69 -0.01 0.00 -0.00 0.00 0.00 43.42 43.33 1v6g n LEU 13 CO 0.00 -5.11 0.42 0.00 -0.00 0.00 0.00 177.39 172.71 1v6g n TYR 14 N -2.02 -0.13 -2.16 1.47 4.11 -1.26 -4.91 117.16 112.27 1v6g n TYR 14 Ca 0.00 0.97 0.00 0.00 -0.00 0.00 0.00 57.90 58.87 1v6g n TYR 14 Cb 0.48 -0.70 0.00 0.00 -0.00 0.00 0.00 39.34 39.12 1v6g n TYR 14 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1v6g n GLY 15 N -1.30 -5.53 3.62 -7.48 0.00 -1.26 -4.85 105.19 88.40 1v6g n GLY 15 Ca 0.05 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 1v6g n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v6g s THR 16 N -0.54 4.51 -0.25 2.61 2.01 -1.26 -5.02 115.64 117.70 1v6g s THR 16 Ca 0.00 1.52 -0.04 0.00 0.31 0.00 0.00 61.69 63.49 1v6g s THR 16 Cb 0.00 -4.40 0.01 0.00 0.01 0.00 0.00 72.50 68.12 1v6g s THR 16 CO 0.00 -0.53 -0.02 -0.60 -0.69 0.00 0.00 174.62 172.78 1v6g s ARG 17 N 3.65 3.07 0.01 4.92 3.52 -1.26 -0.02 118.95 132.83 1v6g s ARG 17 Ca 0.43 -0.84 -0.37 0.00 -0.13 0.00 0.00 55.73 54.82 1v6g s ARG 17 Cb -0.12 -3.10 -0.15 0.00 -1.56 0.00 0.00 34.95 30.02 1v6g s ARG 17 CO 0.18 -0.35 1.52 0.00 -0.81 0.00 0.00 175.30 175.84 1v6g n PHE 19 N 3.69 0.68 0.07 0.00 3.72 0.76 -1.77 117.46 124.60 1v6g n PHE 19 Ca 0.20 -0.70 0.00 0.00 -0.05 0.00 0.00 57.45 56.90 1v6g n PHE 19 Cb 0.21 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 1v6g n PHE 19 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1v6g n SER 20 N 0.12 0.47 -0.90 4.37 2.88 -1.26 -4.84 113.62 114.46 1v6g n SER 20 Ca 0.13 0.21 0.10 0.00 -1.33 0.00 0.00 58.87 57.98 1v6g n SER 20 Cb 0.72 -0.03 0.14 0.00 -0.75 0.00 0.00 64.21 64.28 1v6g n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1v6g n ASP 22 N 1.18 -1.43 -4.02 0.00 9.92 -0.73 -5.00 116.55 116.47 1v6g n ASP 22 Ca 0.14 -0.77 -0.20 0.00 -0.53 0.00 0.00 54.79 53.42 1v6g n ASP 22 Cb 0.52 -4.31 -0.15 0.00 -0.64 0.00 0.00 41.12 36.54 1v6g n ASP 22 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1v6g s GLN 23 N -5.82 0.97 -0.07 -1.24 -1.52 -1.24 -4.88 119.66 105.86 1v6g s GLN 23 Ca 0.01 -0.35 -0.29 0.00 -1.95 0.00 0.00 55.36 52.78 1v6g s GLN 23 Cb -0.00 -0.91 -0.07 0.00 -0.22 0.00 0.00 33.01 31.81 1v6g s GLN 23 CO 0.79 0.16 1.98 -0.06 -0.25 0.00 0.00 175.29 177.91 1v6g s PHE 24 N 0.03 1.39 -0.26 0.91 0.40 -1.26 -0.46 117.98 118.73 1v6g s PHE 24 Ca -0.01 -0.02 -0.25 0.00 -0.60 0.00 0.00 56.93 56.05 1v6g s PHE 24 Cb -0.07 -4.10 -0.00 0.00 0.51 0.00 0.00 43.02 39.35 1v6g s PHE 24 CO 0.00 -4.74 0.85 0.42 0.70 0.00 0.00 175.22 172.45 1v6g s ILE 25 N 5.59 4.79 0.00 0.64 1.01 0.97 -4.90 121.20 129.29 1v6g s ILE 25 Ca 0.89 1.51 0.00 0.00 0.00 0.00 0.00 60.65 63.05 1v6g s ILE 25 Cb -0.37 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 37.94 1v6g s ILE 25 CO 0.37 -0.16 0.00 1.21 0.00 0.00 0.00 174.94 176.37 1v6g n GLU 26 N 6.15 0.00 -0.81 2.79 2.13 -1.26 -4.64 120.64 125.00 1v6g n GLU 26 Ca 0.06 0.47 -0.32 0.00 0.66 0.00 0.00 57.16 58.02 1v6g n GLU 26 Cb 0.48 -0.97 0.14 0.00 0.27 0.00 0.00 31.44 31.35 1v6g n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1v6g n GLY 27 N 1.99 -1.22 1.87 8.31 0.00 -1.26 -4.71 105.19 110.17 1v6g n GLY 27 Ca 0.00 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 1v6g n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1v6g n GLU 28 N -2.69 0.00 -3.49 1.61 2.13 -1.26 -4.88 120.64 112.06 1v6g n GLU 28 Ca 0.09 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.57 1v6g n GLU 28 Cb 0.52 -0.77 -0.05 0.00 0.27 0.00 0.00 31.44 31.41 1v6g n GLU 28 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1v6g s VAL 29 N 0.73 5.00 -0.48 6.31 0.11 -1.26 -4.79 120.40 126.02 1v6g s VAL 29 Ca 0.50 0.55 -0.18 0.00 -2.93 0.00 0.00 61.98 59.92 1v6g s VAL 29 Cb -0.71 -3.67 0.06 0.00 -1.53 0.00 0.00 36.38 30.53 1v6g s VAL 29 CO 0.35 0.21 0.54 -0.69 -3.33 0.00 0.00 175.10 172.18 1v6g s VAL 30 N -1.49 5.00 -0.66 2.04 1.01 -1.10 -4.97 120.40 120.23 1v6g s VAL 30 Ca 0.37 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.49 1v6g s VAL 30 Cb -0.14 -4.21 0.06 0.00 0.00 0.00 0.00 36.38 32.08 1v6g s VAL 30 CO 0.19 -0.69 1.04 -0.55 0.00 0.00 0.00 175.10 175.10 1v6g s SER 31 N 2.53 6.20 0.21 3.32 0.15 -1.26 -2.36 113.70 122.49 1v6g s SER 31 Ca 0.12 -0.74 0.10 0.00 0.70 0.00 0.00 55.95 56.12 1v6g s SER 31 Cb -0.20 -2.46 -0.05 0.00 -1.71 0.00 0.00 66.02 61.60 1v6g s SER 31 CO 0.11 -1.51 -0.19 0.00 1.20 0.00 0.00 173.24 172.85 1v6g s ALA 32 N 4.49 2.28 -1.41 5.45 0.00 0.39 -4.76 121.76 128.19 1v6g s ALA 32 Ca 0.27 -1.65 -0.08 0.00 0.00 0.00 0.00 51.96 50.49 1v6g s ALA 32 Cb -0.14 -0.20 0.08 0.00 0.00 0.00 0.00 23.12 22.86 1v6g s ALA 32 CO 0.13 0.24 0.21 1.28 0.00 0.00 0.00 175.76 177.62 1v6g n LEU 33 N -0.10 -0.75 -3.82 0.00 4.32 -1.26 0.17 117.00 115.57 1v6g n LEU 33 Ca -0.10 -1.05 -0.27 0.00 -0.02 0.00 0.00 56.01 54.57 1v6g n LEU 33 Cb 0.58 -1.32 0.04 0.00 -1.62 0.00 0.00 43.42 41.10 1v6g n LEU 33 CO 0.33 0.26 0.09 0.61 -1.22 0.00 0.00 177.39 177.46 1v6g n GLY 34 N -1.75 -0.46 3.53 -0.72 0.00 -1.26 -4.97 105.19 99.56 1v6g n GLY 34 Ca -0.12 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1v6g n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v6g s LYS 35 N -6.42 1.41 -0.13 1.61 1.02 0.45 -5.16 119.74 112.52 1v6g s LYS 35 Ca 0.51 -1.00 -0.02 0.00 0.02 0.00 0.00 55.97 55.48 1v6g s LYS 35 Cb -0.25 0.49 -0.03 0.00 -0.52 0.00 0.00 37.83 37.53 1v6g s LYS 35 CO 0.81 -0.59 -0.05 0.95 -0.92 0.00 0.00 175.35 175.55 1v6g s THR 36 N -3.92 3.82 0.19 2.17 -4.23 -1.26 -0.46 115.64 111.95 1v6g s THR 36 Ca 0.13 -0.40 -0.04 0.00 -1.18 0.00 0.00 61.69 60.21 1v6g s THR 36 Cb -0.01 -2.64 -0.03 0.00 1.34 0.00 0.00 72.50 71.17 1v6g s THR 36 CO 0.01 0.53 0.19 -0.31 -0.54 0.00 0.00 174.62 174.50 1v6g s TYR 37 N -0.03 0.90 0.52 3.99 2.02 -1.00 -0.17 117.35 123.59 1v6g s TYR 37 Ca 0.01 -1.19 -0.09 0.00 -0.37 0.00 0.00 57.07 55.43 1v6g s TYR 37 Cb -0.13 -0.37 -0.05 0.00 -0.40 0.00 0.00 41.96 41.01 1v6g s TYR 37 CO 0.03 -0.68 0.89 -1.01 -1.57 0.00 0.00 175.55 173.21 1v6g s HIS 38 N -4.10 3.56 -2.00 2.71 3.76 -1.26 -2.70 115.29 115.26 1v6g s HIS 38 Ca 0.32 1.10 0.13 0.00 -0.15 0.00 0.00 55.06 56.45 1v6g s HIS 38 Cb 0.05 -2.53 0.75 0.00 1.11 0.00 0.00 32.58 31.96 1v6g s HIS 38 CO 0.09 -0.41 1.18 -0.35 -0.85 0.00 0.00 174.74 174.39 1v6g n PRO 39 N -2.19 0.49 0.00 8.40 -0.04 -1.26 -2.83 135.00 137.56 1v6g n PRO 39 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1v6g n PRO 39 Cb 0.54 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1v6g n PRO 39 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1v6g n ASP 40 N -0.90 2.89 0.25 3.54 2.03 -1.26 -4.73 116.55 118.37 1v6g n ASP 40 Ca 0.09 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.54 1v6g n ASP 40 Cb 0.04 0.32 0.63 0.00 -0.72 0.00 0.00 41.12 41.40 1v6g n ASP 40 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1v6g n PHE 42 N -3.38 0.59 -3.97 0.00 7.35 -1.15 -4.85 117.46 112.04 1v6g n PHE 42 Ca -0.01 -1.04 -0.26 0.00 -0.76 0.00 0.00 57.45 55.39 1v6g n PHE 42 Cb 0.33 -0.52 -0.03 0.00 0.35 0.00 0.00 39.48 39.61 1v6g n PHE 42 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1v6g s VAL 43 N -0.75 1.90 1.04 -2.13 -7.23 -1.11 -4.64 120.40 107.48 1v6g s VAL 43 Ca 0.11 -1.56 -0.16 0.00 -1.81 0.00 0.00 61.98 58.56 1v6g s VAL 43 Cb 0.09 -2.46 0.08 0.00 0.56 0.00 0.00 36.38 34.65 1v6g s VAL 43 CO 0.01 0.00 0.24 0.00 -0.31 0.00 0.00 175.10 175.04 1v6g n ALA 45 N -4.05 1.57 -0.01 0.00 0.00 -0.89 -3.51 120.51 113.61 1v6g n ALA 45 Ca 0.04 -1.28 -0.01 0.00 0.00 0.00 0.00 53.44 52.19 1v6g n ALA 45 Cb 0.58 -0.20 -0.00 0.00 0.00 0.00 0.00 19.45 19.83 1v6g n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1v6g h VAL 46 N 0.00 0.00 0.00 0.00 2.07 -1.93 -3.39 116.25 113.00 1v6g h VAL 46 Ca -0.52 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 1v6g h VAL 46 Cb 2.17 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1v6g h VAL 46 CO 0.03 0.00 -0.07 0.00 0.02 0.00 0.00 177.57 177.55 1v6g n ARG 48 N -3.14 -7.04 -4.39 0.00 5.12 -1.23 -4.98 116.66 100.99 1v6g n ARG 48 Ca 0.02 0.79 -0.29 0.00 -1.93 0.00 0.00 57.85 56.45 1v6g n ARG 48 Cb 0.45 -5.70 -0.13 0.00 -1.16 0.00 0.00 32.46 25.93 1v6g n ARG 48 CO 0.00 0.00 0.00 -0.48 -1.93 0.00 0.00 177.63 175.22 1v6g s LEU 49 N -6.63 2.34 -0.19 0.55 0.05 -1.26 -4.71 118.68 108.84 1v6g s LEU 49 Ca 0.33 -0.77 -0.29 0.00 0.05 0.00 0.00 54.13 53.46 1v6g s LEU 49 Cb -0.15 -1.22 -0.03 0.00 -2.05 0.00 0.00 46.19 42.75 1v6g s LEU 49 CO 0.69 0.17 1.59 -2.16 -0.55 0.00 0.00 176.35 176.09 1v6g s PRO 50 N -2.16 3.89 0.33 1.48 0.04 -1.26 -0.91 135.00 136.42 1v6g s PRO 50 Ca 0.15 1.74 -0.27 0.00 0.04 0.00 0.00 61.00 62.66 1v6g s PRO 50 Cb -0.10 -4.00 -0.13 0.00 0.04 0.00 0.00 34.50 30.31 1v6g s PRO 50 CO 0.07 -1.18 1.06 1.19 0.04 0.00 0.00 177.00 178.18 1v6g n PHE 51 N 8.08 1.42 -1.57 0.56 3.72 -1.26 -4.94 117.46 123.46 1v6g n PHE 51 Ca 0.18 0.64 -0.32 0.00 -0.05 0.00 0.00 57.45 57.90 1v6g n PHE 51 Cb 0.45 -2.27 0.06 0.00 -0.94 0.00 0.00 39.48 36.78 1v6g n PHE 51 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1v6g s PRO 52 N -1.73 2.60 0.00 -1.08 0.04 -1.26 -4.90 135.00 128.67 1v6g s PRO 52 Ca 0.59 1.31 0.12 0.00 0.04 0.00 0.00 61.00 63.06 1v6g s PRO 52 Cb -0.64 -1.93 0.73 0.00 0.04 0.00 0.00 34.50 32.70 1v6g s PRO 52 CO 0.60 -1.40 1.16 -0.35 0.04 0.00 0.00 177.00 177.05 1v6g n PRO 53 N -2.82 0.49 -0.02 0.56 -0.04 -1.26 -3.52 135.00 128.39 1v6g n PRO 53 Ca 0.10 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.50 1v6g n PRO 53 Cb 0.52 -1.39 -0.02 0.00 -0.04 0.00 0.00 33.50 32.57 1v6g n PRO 53 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1v6g n GLY 54 N -0.03 -0.14 3.74 0.55 0.00 -1.26 -5.05 105.19 103.01 1v6g n GLY 54 Ca 0.09 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1v6g n GLY 54 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1v6g s ASP 55 N -5.78 4.56 -0.02 1.61 2.15 -1.23 -5.03 116.67 112.93 1v6g s ASP 55 Ca -0.09 2.24 -0.01 0.00 0.43 0.00 0.00 52.55 55.12 1v6g s ASP 55 Cb 0.03 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.03 1v6g s ASP 55 CO 0.12 -2.01 0.07 -0.13 -0.17 0.00 0.00 175.17 173.05 1v6g s ARG 56 N -3.93 3.05 0.59 4.34 0.52 -1.26 -4.64 118.95 117.62 1v6g s ARG 56 Ca 0.72 -0.47 -0.13 0.00 -0.52 0.00 0.00 55.73 55.33 1v6g s ARG 56 Cb -0.26 -2.85 -0.05 0.00 0.52 0.00 0.00 34.95 32.31 1v6g s ARG 56 CO 0.43 0.66 1.02 0.14 0.02 0.00 0.00 175.30 177.57 1v6g s VAL 57 N -1.15 4.59 -0.26 3.52 -7.23 -1.26 -4.14 120.40 114.47 1v6g s VAL 57 Ca 0.21 0.97 0.01 0.00 -1.81 0.00 0.00 61.98 61.37 1v6g s VAL 57 Cb -0.12 -3.78 0.07 0.00 0.56 0.00 0.00 36.38 33.11 1v6g s VAL 57 CO 0.12 -0.97 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.01 1v6g s THR 58 N -2.98 1.65 -0.47 5.32 2.01 -0.68 -4.98 115.64 115.51 1v6g s THR 58 Ca 0.57 -1.45 -0.29 0.00 0.31 0.00 0.00 61.69 60.83 1v6g s THR 58 Cb -0.11 -1.97 0.02 0.00 0.01 0.00 0.00 72.50 70.46 1v6g s THR 58 CO 0.47 -0.22 1.22 -0.36 -0.69 0.00 0.00 174.62 175.03 1v6g s PHE 59 N 1.31 2.69 -0.40 4.92 0.08 -1.26 -2.20 117.98 123.12 1v6g s PHE 59 Ca -0.02 0.68 0.03 0.00 0.12 0.00 0.00 56.93 57.74 1v6g s PHE 59 Cb -0.19 -4.42 0.11 0.00 -0.57 0.00 0.00 43.02 37.96 1v6g s PHE 59 CO -0.08 -1.48 0.14 1.21 -0.10 0.00 0.00 175.22 174.90 1v6g s ASN 60 N 2.90 4.38 0.14 1.36 2.47 -1.11 -4.99 114.94 120.08 1v6g s ASN 60 Ca 0.51 -2.36 0.00 0.00 0.42 0.00 0.00 52.86 51.43 1v6g s ASN 60 Cb -0.09 -1.42 0.00 0.00 -1.45 0.00 0.00 41.25 38.29 1v6g s ASN 60 CO 0.32 -0.33 0.00 0.61 -3.72 0.00 0.00 177.10 173.98 1v6g n GLY 61 N 3.95 1.46 0.36 1.21 0.00 -1.26 -4.07 105.19 106.84 1v6g n GLY 61 Ca 0.04 -0.48 -0.06 0.00 0.00 0.00 0.00 46.02 45.52 1v6g n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1v6g n LYS 62 N 0.00 0.16 -3.19 1.61 5.02 -1.26 -5.06 118.16 115.44 1v6g n LYS 62 Ca 0.00 0.05 -0.22 0.00 -2.02 0.00 0.00 58.31 56.12 1v6g n LYS 62 Cb 0.00 -0.97 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1v6g n LYS 62 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1v6g s GLU 63 N -2.13 3.11 0.36 1.97 4.04 -1.26 -5.11 118.70 119.68 1v6g s GLU 63 Ca -0.09 -0.66 0.08 0.00 0.04 0.00 0.00 54.97 54.34 1v6g s GLU 63 Cb 0.03 -2.66 -0.03 0.00 0.02 0.00 0.00 34.13 31.49 1v6g s GLU 63 CO 0.14 -0.13 0.28 0.00 -1.84 0.00 0.00 175.26 173.71 1v6g s MET 65 N -4.00 0.76 0.20 0.00 -1.94 -0.94 -2.10 119.30 111.29 1v6g s MET 65 Ca 0.42 -0.32 -0.29 0.00 -1.71 0.00 0.00 55.69 53.80 1v6g s MET 65 Cb -0.04 0.33 -0.08 0.00 2.01 0.00 0.00 34.83 37.05 1v6g s MET 65 CO 0.26 -0.23 0.89 0.00 -0.01 0.00 0.00 175.02 175.93 1v6g n GLN 67 N 1.68 -0.05 -0.03 0.00 6.02 -1.26 0.13 117.38 123.87 1v6g n GLN 67 Ca -0.03 1.11 -0.08 0.00 -0.01 0.00 0.00 57.00 57.99 1v6g n GLN 67 Cb 0.48 -1.84 -0.02 0.00 1.02 0.00 0.00 30.24 29.88 1v6g n GLN 67 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1v6g h LYS 68 N 0.00 -0.20 -0.07 -1.09 1.63 -1.94 -2.34 116.57 112.55 1v6g h LYS 68 Ca 0.53 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 60.32 1v6g h LYS 68 Cb 1.25 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.92 1v6g h LYS 68 CO -0.67 -0.14 -0.08 0.00 -3.45 0.00 0.00 179.45 175.12 1v6g n SER 70 N -4.70 -0.45 -4.68 0.00 2.88 0.18 -4.45 113.62 102.40 1v6g n SER 70 Ca -0.08 1.59 -0.31 0.00 -1.33 0.00 0.00 58.87 58.74 1v6g n SER 70 Cb 0.32 -0.43 0.16 0.00 -0.75 0.00 0.00 64.21 63.51 1v6g n SER 70 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1v6g s LEU 71 N -10.87 2.89 -0.41 2.46 1.02 -0.91 -4.88 118.68 107.98 1v6g s LEU 71 Ca -0.13 2.20 -0.28 0.00 0.02 0.00 0.00 54.13 55.94 1v6g s LEU 71 Cb 0.22 -4.57 -0.01 0.00 0.02 0.00 0.00 46.19 41.85 1v6g s LEU 71 CO 0.69 -3.03 1.74 -2.16 0.02 0.00 0.00 176.35 173.61 1v6g s PRO 72 N -4.60 3.21 0.70 1.29 0.04 -1.26 -4.99 135.00 129.39 1v6g s PRO 72 Ca 0.67 1.13 -0.11 0.00 0.04 0.00 0.00 61.00 62.73 1v6g s PRO 72 Cb -0.23 -4.21 0.01 0.00 0.04 0.00 0.00 34.50 30.11 1v6g s PRO 72 CO 0.57 -2.01 1.07 0.54 0.04 0.00 0.00 177.00 177.21 1v6g s VAL 73 N 7.13 3.84 0.45 -0.36 0.11 -1.26 -4.93 120.40 125.39 1v6g s VAL 73 Ca 0.73 0.60 0.21 0.00 -2.93 0.00 0.00 61.98 60.59 1v6g s VAL 73 Cb -0.18 -3.50 0.41 0.00 -1.53 0.00 0.00 36.38 31.57 1v6g s VAL 73 CO 0.30 -0.78 1.86 0.28 -3.33 0.00 0.00 175.10 173.43 1v6g h SER 74 N -0.66 0.30 -3.52 3.54 0.02 -2.00 -3.40 113.55 107.83 1v6g h SER 74 Ca -0.45 0.03 -0.52 0.00 -0.84 0.00 0.00 61.79 60.01 1v6g h SER 74 Cb 1.23 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.72 1v6g h SER 74 CO 0.61 0.11 -0.05 0.68 -1.14 0.00 0.00 176.83 177.05 1v6g s VAL 75 N -5.31 4.84 0.25 2.27 -7.23 -1.26 -5.09 120.40 108.88 1v6g s VAL 75 Ca -0.07 0.65 -0.17 0.00 -1.81 0.00 0.00 61.98 60.58 1v6g s VAL 75 Cb 0.22 -3.63 0.01 0.00 0.56 0.00 0.00 36.38 33.55 1v6g s VAL 75 CO 0.78 -0.08 0.58 -0.44 -0.31 0.00 0.00 175.10 175.63 1v6g s SER 76 N -2.28 -0.18 0.16 4.85 0.01 -1.26 -5.07 113.70 109.92 1v6g s SER 76 Ca 0.49 -0.73 -0.03 0.00 1.31 0.00 0.00 55.95 56.98 1v6g s SER 76 Cb -0.11 0.64 -0.03 0.00 0.21 0.00 0.00 66.02 66.73 1v6g s SER 76 CO 0.20 -1.20 0.14 -0.83 0.41 0.00 0.00 173.24 171.96 1v6g s GLY 77 N -2.96 0.92 1.09 3.44 0.00 -1.26 -5.17 107.32 103.38 1v6g s GLY 77 Ca 0.16 -1.34 -0.15 0.00 0.00 0.00 0.00 44.72 43.39 1v6g s GLY 77 CO 0.06 -1.21 1.10 2.56 0.00 0.00 0.00 173.10 175.62 1v6g s PRO 78 N -4.05 -0.31 -0.05 2.90 0.04 -1.26 -5.09 135.00 127.18 1v6g s PRO 78 Ca 0.25 0.26 -0.15 0.00 0.04 0.00 0.00 61.00 61.39 1v6g s PRO 78 Cb 0.06 -1.67 0.03 0.00 0.04 0.00 0.00 34.50 32.96 1v6g s PRO 78 CO 0.03 -3.17 0.35 -1.54 0.04 0.00 0.00 177.00 172.71 1v6g s SER 79 N -3.63 -0.27 -0.27 6.66 1.04 -1.26 -5.14 113.70 110.83 1v6g s SER 79 Ca 0.68 0.30 0.00 0.00 0.48 0.00 0.00 55.95 57.41 1v6g s SER 79 Cb -0.15 0.44 0.08 0.00 0.10 0.00 0.00 66.02 66.49 1v6g s SER 79 CO 0.57 -0.38 0.02 -0.55 0.98 0.00 0.00 173.24 173.88 1v6g s SER 80 N -0.92 3.96 0.00 7.02 0.15 -1.26 -5.38 113.70 117.26 1v6g s SER 80 Ca -0.10 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.11 1v6g s SER 80 Cb -0.04 -1.10 0.00 0.00 -1.71 0.00 0.00 66.02 63.17 1v6g s SER 80 CO 0.04 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.77