#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vh8 n LEU 1 N 0.00 0.40 -3.71 -3.43 4.77 -1.26 -4.57 117.00 109.20 1vh8 n LEU 1 Ca 0.00 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 56.01 1vh8 n LEU 1 Cb 0.00 0.08 -0.14 0.00 -2.33 0.00 0.00 43.42 41.04 1vh8 n LEU 1 CO 0.00 0.07 -0.15 -0.51 -1.33 0.00 0.00 177.39 175.47 1vh8 s ILE 2 N -3.18 -0.13 -0.03 -0.08 2.07 -1.26 -2.70 121.20 115.88 1vh8 s ILE 2 Ca -0.05 0.20 0.05 0.00 -1.41 0.00 0.00 60.65 59.44 1vh8 s ILE 2 Cb 0.10 -0.36 -0.01 0.00 0.13 0.00 0.00 42.46 42.32 1vh8 s ILE 2 CO 0.85 0.08 -0.19 -0.13 -1.91 0.00 0.00 174.94 173.64 1vh8 s ARG 3 N 1.56 1.76 -0.10 3.50 1.81 -0.24 -4.97 118.95 122.27 1vh8 s ARG 3 Ca -0.06 -0.68 -0.03 0.00 -1.72 0.00 0.00 55.73 53.23 1vh8 s ARG 3 Cb -0.11 -1.60 -0.03 0.00 -0.45 0.00 0.00 34.95 32.75 1vh8 s ARG 3 CO -0.08 0.35 0.02 -1.50 -0.68 0.00 0.00 175.30 173.41 1vh8 s ILE 4 N -0.23 4.48 0.07 1.52 2.07 -1.26 -0.05 121.20 127.81 1vh8 s ILE 4 Ca 0.02 -0.18 0.02 0.00 -1.41 0.00 0.00 60.65 59.10 1vh8 s ILE 4 Cb -0.10 -2.91 -0.03 0.00 0.13 0.00 0.00 42.46 39.55 1vh8 s ILE 4 CO 0.01 0.59 -0.07 -0.83 -1.91 0.00 0.00 174.94 172.73 1vh8 s GLY 5 N -0.71 0.65 0.00 1.50 0.00 0.20 -4.22 107.32 104.75 1vh8 s GLY 5 Ca 0.11 -1.12 0.01 0.00 0.00 0.00 0.00 44.72 43.73 1vh8 s GLY 5 CO 0.02 -1.20 -0.03 -1.58 0.00 0.00 0.00 173.10 170.32 1vh8 s HIS 6 N -2.75 0.22 0.03 1.90 5.04 -1.25 -1.04 115.29 117.44 1vh8 s HIS 6 Ca 0.03 -0.14 0.01 0.00 -1.54 0.00 0.00 55.06 53.42 1vh8 s HIS 6 Cb -0.01 -0.14 -0.02 0.00 0.04 0.00 0.00 32.58 32.45 1vh8 s HIS 6 CO -0.03 -0.04 -0.05 0.20 -2.34 0.00 0.00 174.74 172.48 1vh8 s GLY 7 N -0.36 0.34 -0.14 1.59 0.00 0.16 -3.73 107.32 105.19 1vh8 s GLY 7 Ca -0.02 -0.57 -0.07 0.00 0.00 0.00 0.00 44.72 44.05 1vh8 s GLY 7 CO -0.00 -0.61 0.33 -0.12 0.00 0.00 0.00 173.10 172.70 1vh8 s PHE 8 N -1.12 -0.50 0.15 1.90 5.36 -1.26 -0.46 117.98 122.05 1vh8 s PHE 8 Ca -0.09 1.09 -0.08 0.00 -0.96 0.00 0.00 56.93 56.88 1vh8 s PHE 8 Cb -0.08 0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.74 1vh8 s PHE 8 CO -0.00 -0.32 0.25 -0.51 -1.46 0.00 0.00 175.22 173.18 1vh8 s ASP 9 N 1.57 0.07 0.00 6.13 1.01 -0.89 -4.87 116.67 119.70 1vh8 s ASP 9 Ca -0.08 -0.86 -0.01 0.00 0.71 0.00 0.00 52.55 52.32 1vh8 s ASP 9 Cb -0.10 0.41 -0.00 0.00 1.01 0.00 0.00 42.92 44.24 1vh8 s ASP 9 CO -0.11 -0.85 0.01 -0.69 0.21 0.00 0.00 175.17 173.74 1vh8 s VAL 10 N -3.96 0.03 -0.23 -1.27 1.01 -1.26 -1.91 120.40 112.82 1vh8 s VAL 10 Ca 0.16 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.88 1vh8 s VAL 10 Cb 0.04 -0.11 0.05 0.00 0.00 0.00 0.00 36.38 36.36 1vh8 s VAL 10 CO -0.02 -0.15 -0.10 -2.28 0.00 0.00 0.00 175.10 172.56 1vh8 s HIS 11 N -0.43 2.71 0.13 5.22 2.46 -0.39 -5.00 115.29 119.99 1vh8 s HIS 11 Ca -0.05 -1.88 -0.24 0.00 0.47 0.00 0.00 55.06 53.36 1vh8 s HIS 11 Cb -0.03 -1.74 -0.07 0.00 -0.13 0.00 0.00 32.58 30.61 1vh8 s HIS 11 CO -0.00 -0.80 0.73 0.00 -2.47 0.00 0.00 174.74 172.20 1vh8 s ALA 12 N 1.29 3.47 0.42 1.58 0.00 -1.26 -1.92 121.76 125.33 1vh8 s ALA 12 Ca -0.04 0.28 -0.24 0.00 0.00 0.00 0.00 51.96 51.96 1vh8 s ALA 12 Cb -0.18 -2.90 -0.08 0.00 0.00 0.00 0.00 23.12 19.96 1vh8 s ALA 12 CO -0.07 0.28 1.13 -0.06 0.00 0.00 0.00 175.76 177.04 1vh8 s PHE 13 N -0.99 3.08 0.06 0.00 0.08 -0.64 -4.73 117.98 114.84 1vh8 s PHE 13 Ca 0.35 1.58 -0.08 0.00 0.12 0.00 0.00 56.93 58.89 1vh8 s PHE 13 Cb -0.22 -3.30 -0.00 0.00 -0.57 0.00 0.00 43.02 38.92 1vh8 s PHE 13 CO 0.24 -1.15 0.17 0.20 -0.10 0.00 0.00 175.22 174.59 1vh8 s GLY 14 N -1.34 0.08 0.14 4.36 0.00 -1.26 -4.14 107.32 105.16 1vh8 s GLY 14 Ca 0.59 -0.46 0.02 0.00 0.00 0.00 0.00 44.72 44.87 1vh8 s GLY 14 CO 0.34 -0.63 -0.03 -1.83 0.00 0.00 0.00 173.10 170.94 1vh8 s GLU 15 N -3.06 0.98 0.11 2.90 1.03 0.53 -4.96 118.70 116.23 1vh8 s GLU 15 Ca -0.01 -1.44 0.10 0.00 0.03 0.00 0.00 54.97 53.65 1vh8 s GLU 15 Cb 0.01 -0.25 -0.04 0.00 -0.80 0.00 0.00 34.13 33.06 1vh8 s GLU 15 CO -0.07 -0.07 -0.25 -0.51 -1.33 0.00 0.00 175.26 173.03 1vh8 s ASP 16 N -3.11 3.06 -0.20 0.83 1.01 -1.26 -0.02 116.67 116.97 1vh8 s ASP 16 Ca 0.18 -0.70 -0.18 0.00 0.71 0.00 0.00 52.55 52.56 1vh8 s ASP 16 Cb 0.06 -0.21 0.06 0.00 1.01 0.00 0.00 42.92 43.83 1vh8 s ASP 16 CO -0.00 0.16 0.54 -0.60 0.21 0.00 0.00 175.17 175.47 1vh8 s ARG 17 N -1.88 0.61 0.16 8.23 3.52 -0.52 -4.99 118.95 124.08 1vh8 s ARG 17 Ca 0.11 0.79 -0.24 0.00 -0.13 0.00 0.00 55.73 56.27 1vh8 s ARG 17 Cb -0.10 0.26 -0.08 0.00 -1.56 0.00 0.00 34.95 33.47 1vh8 s ARG 17 CO 0.05 -0.09 0.73 -1.25 -0.81 0.00 0.00 175.30 173.93 1vh8 s PRO 18 N 0.50 4.47 0.15 5.12 0.04 -1.26 0.28 135.00 144.30 1vh8 s PRO 18 Ca -0.02 1.05 0.06 0.00 0.04 0.00 0.00 61.00 62.13 1vh8 s PRO 18 Cb -0.04 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 1vh8 s PRO 18 CO -0.02 0.57 -0.13 -0.51 0.04 0.00 0.00 177.00 176.95 1vh8 s LEU 19 N -1.23 2.49 -0.37 -3.56 1.43 0.50 -4.91 118.68 113.03 1vh8 s LEU 19 Ca 0.35 -0.93 -0.08 0.00 -1.03 0.00 0.00 54.13 52.44 1vh8 s LEU 19 Cb -0.22 -0.50 0.05 0.00 0.03 0.00 0.00 46.19 45.55 1vh8 s LEU 19 CO 0.24 -0.22 0.16 -0.63 0.23 0.00 0.00 176.35 176.13 1vh8 s ILE 20 N -2.78 3.99 -0.09 -0.59 1.01 -1.26 -0.35 121.20 121.13 1vh8 s ILE 20 Ca 0.15 -1.19 0.04 0.00 0.00 0.00 0.00 60.65 59.65 1vh8 s ILE 20 Cb -0.01 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.14 1vh8 s ILE 20 CO 0.03 -0.29 -0.22 -0.63 0.00 0.00 0.00 174.94 173.83 1vh8 s ILE 21 N 1.42 1.89 -1.43 2.92 -1.09 0.12 -4.69 121.20 120.33 1vh8 s ILE 21 Ca 0.00 -0.93 -0.06 0.00 -2.23 0.00 0.00 60.65 57.44 1vh8 s ILE 21 Cb -0.20 -1.63 0.03 0.00 -1.58 0.00 0.00 42.46 39.07 1vh8 s ILE 21 CO 0.03 0.52 0.49 0.61 -1.23 0.00 0.00 174.94 175.36 1vh8 n GLY 22 N 3.48 -0.51 2.43 6.18 0.00 -1.26 -0.30 105.19 115.21 1vh8 n GLY 22 Ca -0.19 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1vh8 n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vh8 n GLY 23 N -1.32 0.35 3.29 -0.02 0.00 -1.26 -5.00 105.19 101.23 1vh8 n GLY 23 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1vh8 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vh8 s VAL 24 N -1.76 1.98 0.01 1.61 1.01 0.59 -5.10 120.40 118.74 1vh8 s VAL 24 Ca 0.00 -1.06 -0.29 0.00 0.00 0.00 0.00 61.98 60.63 1vh8 s VAL 24 Cb 0.00 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1vh8 s VAL 24 CO 0.00 0.56 0.92 -0.70 0.00 0.00 0.00 175.10 175.88 1vh8 s GLU 25 N -0.52 4.56 0.02 2.72 2.12 -1.26 0.11 118.70 126.45 1vh8 s GLU 25 Ca 0.08 1.31 0.01 0.00 0.36 0.00 0.00 54.97 56.73 1vh8 s GLU 25 Cb -0.10 -3.44 -0.02 0.00 0.26 0.00 0.00 34.13 30.83 1vh8 s GLU 25 CO -0.00 0.03 -0.05 0.14 -0.54 0.00 0.00 175.26 174.84 1vh8 s VAL 26 N 0.74 0.28 0.16 3.70 -7.23 0.52 -4.94 120.40 113.63 1vh8 s VAL 26 Ca 0.48 -0.75 -0.27 0.00 -1.81 0.00 0.00 61.98 59.62 1vh8 s VAL 26 Cb -0.21 -0.36 -0.07 0.00 0.56 0.00 0.00 36.38 36.30 1vh8 s VAL 26 CO 0.26 -0.31 0.86 -2.16 -0.31 0.00 0.00 175.10 173.44 1vh8 s PRO 27 N -1.12 4.67 -0.14 4.82 0.04 -1.26 -0.37 135.00 141.63 1vh8 s PRO 27 Ca -0.09 1.29 0.01 0.00 0.04 0.00 0.00 61.00 62.25 1vh8 s PRO 27 Cb -0.08 -3.31 0.02 0.00 0.04 0.00 0.00 34.50 31.18 1vh8 s PRO 27 CO -0.00 0.44 -0.17 -0.47 0.04 0.00 0.00 177.00 176.84 1vh8 s TYR 28 N -0.76 2.35 -0.16 0.56 6.14 0.14 -4.91 117.35 120.71 1vh8 s TYR 28 Ca 0.40 -1.26 -0.08 0.00 0.64 0.00 0.00 57.07 56.76 1vh8 s TYR 28 Cb -0.24 -1.67 -0.04 0.00 0.42 0.00 0.00 41.96 40.43 1vh8 s TYR 28 CO 0.28 -0.64 0.13 -1.58 0.64 0.00 0.00 175.55 174.38 1vh8 s HIS 29 N 1.18 3.47 -0.09 4.97 5.65 -1.26 -1.43 115.29 127.78 1vh8 s HIS 29 Ca -0.00 0.39 0.01 0.00 0.25 0.00 0.00 55.06 55.71 1vh8 s HIS 29 Cb -0.14 -2.06 -0.02 0.00 -1.18 0.00 0.00 32.58 29.18 1vh8 s HIS 29 CO -0.07 0.47 -0.11 0.99 -0.65 0.00 0.00 174.74 175.37 1vh8 s THR 30 N -0.24 3.34 0.00 0.89 2.01 0.97 -4.97 115.64 117.65 1vh8 s THR 30 Ca 0.11 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.52 1vh8 s THR 30 Cb -0.11 -2.37 0.00 0.00 0.01 0.00 0.00 72.50 70.02 1vh8 s THR 30 CO 0.01 0.56 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 1vh8 n GLY 31 N 2.81 -2.30 3.71 4.40 0.00 -1.26 -0.35 105.19 112.20 1vh8 n GLY 31 Ca -0.18 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.43 1vh8 n GLY 31 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1vh8 n PHE 32 N -0.04 2.66 -1.67 1.61 -0.00 -1.26 -4.87 117.46 113.90 1vh8 n PHE 32 Ca 0.00 0.09 -0.47 0.00 -0.00 0.00 0.00 57.45 57.07 1vh8 n PHE 32 Cb 0.00 -2.65 -0.04 0.00 -0.00 0.00 0.00 39.48 36.79 1vh8 n PHE 32 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 1vh8 n ILE 33 N 3.80 0.21 -2.13 -2.13 2.08 -1.26 -4.72 119.36 115.21 1vh8 n ILE 33 Ca 0.16 -0.04 -0.38 0.00 0.56 0.00 0.00 62.75 63.05 1vh8 n ILE 33 Cb 0.34 -1.67 0.00 0.00 -0.75 0.00 0.00 39.64 37.56 1vh8 n ILE 33 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1vh8 s ALA 34 N 2.01 3.00 0.00 -1.39 0.00 -1.26 -4.91 121.76 119.20 1vh8 s ALA 34 Ca 0.83 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1vh8 s ALA 34 Cb -0.67 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1vh8 s ALA 34 CO 0.42 -0.83 0.37 -2.39 0.00 0.00 0.00 175.76 173.34 1vh8 n HIS 35 N -0.47 0.00 -3.74 0.00 1.44 -1.26 -5.13 115.22 106.06 1vh8 n HIS 35 Ca 0.07 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.77 1vh8 n HIS 35 Cb 0.47 0.09 0.01 0.00 0.12 0.00 0.00 29.99 30.68 1vh8 n HIS 35 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 1vh8 n SER 36 N 0.00 -0.86 -0.06 4.39 3.41 -1.26 -4.90 113.62 114.34 1vh8 n SER 36 Ca 0.00 -1.40 0.12 0.00 -0.26 0.00 0.00 58.87 57.32 1vh8 n SER 36 Cb 0.53 1.39 0.66 0.00 -0.26 0.00 0.00 64.21 66.53 1vh8 n SER 36 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1vh8 n ASP 37 N -0.89 0.17 0.00 4.04 5.68 -1.18 -4.88 116.55 119.49 1vh8 n ASP 37 Ca -0.00 -1.32 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 1vh8 n ASP 37 Cb 0.31 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 1vh8 n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vh8 n GLY 38 N 0.89 0.40 3.56 6.12 0.00 -1.26 -4.93 105.19 109.97 1vh8 n GLY 38 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 1vh8 n GLY 38 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vh8 s ASP 39 N -2.12 5.15 0.43 1.61 3.68 -1.26 -4.79 116.67 119.37 1vh8 s ASP 39 Ca 0.00 -0.87 0.19 0.00 2.13 0.00 0.00 52.55 54.00 1vh8 s ASP 39 Cb 0.00 -2.57 0.98 0.00 -1.45 0.00 0.00 42.92 39.89 1vh8 s ASP 39 CO 0.00 -2.78 1.91 1.62 0.13 0.00 0.00 175.17 176.05 1vh8 h VAL 40 N 7.06 0.94 -0.01 1.11 3.04 -1.93 -2.28 116.25 124.18 1vh8 h VAL 40 Ca 0.12 -1.01 -0.00 0.00 -1.01 0.00 0.00 66.70 64.80 1vh8 h VAL 40 Cb 0.99 1.58 -0.00 0.00 -2.01 0.00 0.00 31.29 31.86 1vh8 h VAL 40 CO 1.22 0.26 -0.01 0.00 -1.01 0.00 0.00 177.57 178.03 1vh8 h ALA 41 N 1.73 0.01 0.00 3.17 0.00 -1.91 -2.12 119.26 120.14 1vh8 h ALA 41 Ca -0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1vh8 h ALA 41 Cb 0.56 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1vh8 h ALA 41 CO 0.03 -0.23 -0.30 -0.07 0.00 0.00 0.00 179.25 178.69 1vh8 h LEU 42 N -0.47 0.00 -0.09 0.00 3.38 -1.97 -2.54 115.31 113.62 1vh8 h LEU 42 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1vh8 h LEU 42 Cb 0.51 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1vh8 h LEU 42 CO 0.00 0.30 -0.10 0.45 0.09 0.00 0.00 178.44 179.18 1vh8 h HIS 43 N 0.00 0.28 -0.70 1.13 3.86 -1.34 -0.16 115.15 118.22 1vh8 h HIS 43 Ca -0.00 -0.09 -0.05 0.00 -1.16 0.00 0.00 60.37 59.08 1vh8 h HIS 43 Cb 0.69 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.08 1vh8 h HIS 43 CO 0.00 0.67 0.25 0.00 0.86 0.00 0.00 177.93 179.71 1vh8 h ALA 44 N 0.57 1.13 -0.51 2.45 0.00 -1.33 -1.51 119.26 120.06 1vh8 h ALA 44 Ca 0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1vh8 h ALA 44 Cb 0.62 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1vh8 h ALA 44 CO 0.02 0.61 0.18 1.25 0.00 0.00 0.00 179.25 181.31 1vh8 h LEU 45 N 1.02 0.72 -0.91 0.00 5.85 -1.39 -0.52 115.31 120.08 1vh8 h LEU 45 Ca 0.23 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1vh8 h LEU 45 Cb 0.23 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1vh8 h LEU 45 CO -0.02 0.71 0.60 0.74 -0.34 0.00 0.00 178.44 180.14 1vh8 h THR 46 N 0.68 1.21 -0.22 1.05 2.02 -0.64 -0.75 112.91 116.27 1vh8 h THR 46 Ca 0.17 -0.41 -0.11 0.00 0.77 0.00 0.00 66.41 66.82 1vh8 h THR 46 Cb 0.24 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 1vh8 h THR 46 CO -0.01 0.22 -0.34 0.44 0.37 0.00 0.00 175.52 176.20 1vh8 h ASP 47 N 1.21 0.48 -0.29 4.18 3.32 -0.86 -1.53 116.42 122.92 1vh8 h ASP 47 Ca 0.34 -0.19 -0.13 0.00 0.02 0.00 0.00 57.03 57.07 1vh8 h ASP 47 Cb -0.10 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 1vh8 h ASP 47 CO -0.08 0.79 -0.30 0.00 -1.72 0.00 0.00 179.24 177.93 1vh8 h ALA 48 N 1.24 0.77 -0.05 3.45 0.00 -0.36 0.14 119.26 124.45 1vh8 h ALA 48 Ca 0.05 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1vh8 h ALA 48 Cb 0.79 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1vh8 h ALA 48 CO 0.06 0.65 -0.10 0.82 0.00 0.00 0.00 179.25 180.69 1vh8 h ILE 49 N 0.68 1.41 -0.49 0.00 2.04 -1.05 -1.63 117.51 118.49 1vh8 h ILE 49 Ca 0.08 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 1vh8 h ILE 49 Cb 0.84 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 39.10 1vh8 h ILE 49 CO 0.07 0.38 0.21 -0.07 0.00 0.00 0.00 178.15 178.75 1vh8 h LEU 50 N -0.33 0.65 -1.20 1.44 3.38 -1.29 -2.92 115.31 115.04 1vh8 h LEU 50 Ca 0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1vh8 h LEU 50 Cb 0.66 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1vh8 h LEU 50 CO 0.02 0.62 0.43 1.23 0.09 0.00 0.00 178.44 180.84 1vh8 h GLY 51 N 0.64 1.05 1.25 0.83 0.00 -0.71 0.26 103.07 106.40 1vh8 h GLY 51 Ca 0.16 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 1vh8 h GLY 51 CO -0.02 0.42 0.09 0.00 0.00 0.00 0.00 176.54 177.03 1vh8 h ALA 52 N 1.48 1.08 -0.08 3.60 0.00 -1.12 -1.75 119.26 122.48 1vh8 h ALA 52 Ca 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1vh8 h ALA 52 Cb -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1vh8 h ALA 52 CO -0.05 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1vh8 n ALA 53 N -2.47 2.57 -3.37 0.00 0.00 -0.92 -4.62 120.51 111.70 1vh8 n ALA 53 Ca 0.04 -0.38 -0.23 0.00 0.00 0.00 0.00 53.44 52.87 1vh8 n ALA 53 Cb 0.27 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.58 1vh8 n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vh8 n ALA 54 N -0.10 -1.16 -0.82 0.00 0.00 -0.47 -4.89 120.51 113.07 1vh8 n ALA 54 Ca 0.17 0.36 -0.03 0.00 0.00 0.00 0.00 53.44 53.94 1vh8 n ALA 54 Cb 0.25 -4.86 0.30 0.00 0.00 0.00 0.00 19.45 15.15 1vh8 n ALA 54 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vh8 n LEU 55 N -4.54 5.68 0.00 0.00 4.77 0.80 -4.99 117.00 118.72 1vh8 n LEU 55 Ca -0.03 -2.94 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 1vh8 n LEU 55 Cb 0.58 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1vh8 n LEU 55 CO 0.57 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.97 1vh8 n GLY 56 N 0.05 1.77 3.83 -0.72 0.00 -1.26 -4.87 105.19 103.99 1vh8 n GLY 56 Ca 0.35 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 46.13 1vh8 n GLY 56 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1vh8 s ASP 57 N -4.00 -0.13 0.55 1.61 1.47 -1.26 -4.04 116.67 110.87 1vh8 s ASP 57 Ca 0.00 -0.86 0.32 0.00 1.18 0.00 0.00 52.55 53.20 1vh8 s ASP 57 Cb 0.00 0.78 1.49 0.00 -0.34 0.00 0.00 42.92 44.85 1vh8 s ASP 57 CO 0.00 -1.49 1.85 -0.29 0.68 0.00 0.00 175.17 175.92 1vh8 h ILE 58 N 2.01 0.47 0.00 2.11 2.10 -1.89 -1.39 117.51 120.91 1vh8 h ILE 58 Ca -0.25 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.69 1vh8 h ILE 58 Cb 1.25 0.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.49 1vh8 h ILE 58 CO 0.31 0.00 0.03 1.23 -1.08 0.00 0.00 178.15 178.64 1vh8 h GLY 59 N 0.00 0.00 -1.95 8.18 0.00 -1.96 -1.58 103.07 105.76 1vh8 h GLY 59 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1vh8 h GLY 59 CO -0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 1vh8 n LYS 60 N -2.61 2.35 0.21 4.80 4.01 -0.52 -4.51 118.16 121.89 1vh8 n LYS 60 Ca -0.02 -2.14 0.05 0.00 -0.51 0.00 0.00 58.31 55.69 1vh8 n LYS 60 Cb 0.08 -1.43 0.46 0.00 -0.51 0.00 0.00 35.03 33.63 1vh8 n LYS 60 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1vh8 h LEU 61 N 3.60 0.00 -6.96 -0.35 3.38 -1.44 -3.41 115.31 110.13 1vh8 h LEU 61 Ca 0.00 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.56 1vh8 h LEU 61 Cb 0.86 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.22 1vh8 h LEU 61 CO 0.00 0.27 -0.71 -0.36 0.09 0.00 0.00 178.44 177.73 1vh8 s PHE 62 N -4.34 0.03 -1.06 1.13 0.08 -1.26 -5.04 117.98 107.52 1vh8 s PHE 62 Ca -0.03 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 56.90 1vh8 s PHE 62 Cb 0.15 -0.58 0.00 0.00 -0.57 0.00 0.00 43.02 42.02 1vh8 s PHE 62 CO 0.69 -0.54 0.27 -0.35 -0.10 0.00 0.00 175.22 175.20 1vh8 n PRO 63 N 5.29 0.52 0.00 0.24 -0.04 -1.26 -5.10 135.00 134.65 1vh8 n PRO 63 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1vh8 n PRO 63 Cb 0.49 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 1vh8 n PRO 63 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1vh8 n ASN 71 N 0.20 0.00 -0.04 3.54 4.05 -1.26 -5.24 115.26 116.50 1vh8 n ASN 71 Ca 0.00 0.00 -0.10 0.00 0.45 0.00 0.00 54.58 54.93 1vh8 n ASN 71 Cb 0.12 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.10 1vh8 n ASN 71 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1vh8 n ALA 72 N 0.00 2.11 -2.11 5.20 0.00 -1.26 -4.89 120.51 119.55 1vh8 n ALA 72 Ca 0.00 -0.46 -0.42 0.00 0.00 0.00 0.00 53.44 52.56 1vh8 n ALA 72 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.68 1vh8 n ALA 72 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1vh8 s ASP 73 N -6.07 6.74 0.27 0.00 2.15 -1.26 -3.13 116.67 115.37 1vh8 s ASP 73 Ca -0.16 2.13 -0.03 0.00 0.43 0.00 0.00 52.55 54.92 1vh8 s ASP 73 Cb 0.05 -2.54 0.36 0.00 -0.30 0.00 0.00 42.92 40.49 1vh8 s ASP 73 CO 0.21 -0.87 1.89 0.28 -0.17 0.00 0.00 175.17 176.52 1vh8 h SER 74 N 9.04 0.95 -0.94 -0.34 0.02 -1.94 -2.46 113.55 117.87 1vh8 h SER 74 Ca -0.37 -0.09 0.17 0.00 -0.84 0.00 0.00 61.79 60.66 1vh8 h SER 74 Cb 1.16 -0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.38 1vh8 h SER 74 CO 0.95 0.78 0.60 0.03 -1.14 0.00 0.00 176.83 178.05 1vh8 h ARG 75 N 1.07 0.67 -0.39 3.45 3.08 -1.96 0.58 114.38 120.88 1vh8 h ARG 75 Ca 0.27 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 1vh8 h ARG 75 Cb 0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1vh8 h ARG 75 CO -0.04 0.44 0.12 0.78 -1.07 0.00 0.00 179.97 180.21 1vh8 h GLY 76 N 0.69 0.66 1.17 0.04 0.00 -1.84 -0.36 103.07 103.43 1vh8 h GLY 76 Ca 0.50 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 1vh8 h GLY 76 CO -0.26 0.36 0.16 1.41 0.00 0.00 0.00 176.54 178.22 1vh8 h LEU 77 N 0.49 0.97 0.22 3.11 3.38 -0.44 -1.19 115.31 121.85 1vh8 h LEU 77 Ca 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1vh8 h LEU 77 Cb 0.26 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1vh8 h LEU 77 CO -0.00 0.93 -0.11 0.25 0.09 0.00 0.00 178.44 179.60 1vh8 h LEU 78 N 0.98 -0.25 -0.03 1.67 5.85 0.33 -0.68 115.31 123.17 1vh8 h LEU 78 Ca 0.21 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.93 1vh8 h LEU 78 Cb 0.35 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1vh8 h LEU 78 CO 0.00 -0.16 -0.06 0.03 -0.34 0.00 0.00 178.44 177.92 1vh8 h ARG 79 N -0.33 -0.08 -0.61 1.25 3.08 -0.91 0.03 114.38 116.82 1vh8 h ARG 79 Ca -0.03 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.15 1vh8 h ARG 79 Cb 0.25 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.22 1vh8 h ARG 79 CO 0.05 -0.06 0.01 1.49 -1.07 0.00 0.00 179.97 180.40 1vh8 h GLU 80 N -0.09 0.13 -0.52 0.04 4.57 -1.11 0.51 114.58 118.12 1vh8 h GLU 80 Ca 0.04 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1vh8 h GLU 80 Cb 0.14 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 1vh8 h GLU 80 CO -0.09 0.08 0.16 0.00 -1.18 0.00 0.00 179.01 177.98 1vh8 h ALA 81 N 1.55 1.30 -0.34 2.92 0.00 -0.55 -1.76 119.26 122.38 1vh8 h ALA 81 Ca 0.32 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 1vh8 h ALA 81 Cb 0.51 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1vh8 h ALA 81 CO -0.51 0.50 -0.33 0.35 0.00 0.00 0.00 179.25 179.27 1vh8 h PHE 82 N 0.75 0.87 -0.44 0.00 3.04 0.14 -1.54 116.94 119.77 1vh8 h PHE 82 Ca 0.17 -0.23 0.02 0.00 3.98 0.00 0.00 57.97 61.91 1vh8 h PHE 82 Cb 0.23 -0.19 -0.03 0.00 2.56 0.00 0.00 35.95 38.52 1vh8 h PHE 82 CO 0.01 0.97 0.26 -0.09 -2.02 0.00 0.00 178.31 177.44 1vh8 h ARG 83 N 0.63 0.50 0.00 1.11 2.43 0.44 -0.34 114.38 119.15 1vh8 h ARG 83 Ca 0.07 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1vh8 h ARG 83 Cb 0.86 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 1vh8 h ARG 83 CO 0.07 0.33 -0.24 1.96 -1.51 0.00 0.00 179.97 180.59 1vh8 h GLN 84 N 0.52 0.00 -0.07 0.20 4.20 -1.16 -2.14 115.11 116.66 1vh8 h GLN 84 Ca 0.18 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.67 1vh8 h GLN 84 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1vh8 h GLN 84 CO -0.08 0.24 -0.84 0.28 -0.67 0.00 0.00 178.83 177.76 1vh8 h VAL 85 N 0.00 1.34 -0.62 -0.54 2.07 -0.44 -3.13 116.25 114.94 1vh8 h VAL 85 Ca -0.00 -2.19 -0.03 0.00 0.82 0.00 0.00 66.70 65.30 1vh8 h VAL 85 Cb 0.66 2.19 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 1vh8 h VAL 85 CO 0.03 0.67 0.28 1.56 0.02 0.00 0.00 177.57 180.13 1vh8 h GLN 86 N 0.35 0.89 -0.94 1.57 1.08 -0.61 -1.68 115.11 115.78 1vh8 h GLN 86 Ca -0.06 -0.14 0.21 0.00 -1.45 0.00 0.00 58.65 57.21 1vh8 h GLN 86 Cb 1.45 -0.16 -0.08 0.00 -0.05 0.00 0.00 27.48 28.65 1vh8 h GLN 86 CO 0.15 0.73 0.62 0.93 -0.95 0.00 0.00 178.83 180.31 1vh8 h GLU 87 N 0.85 0.43 -0.37 1.46 5.08 -1.34 0.52 114.58 121.21 1vh8 h GLU 87 Ca 0.21 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1vh8 h GLU 87 Cb 0.14 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1vh8 h GLU 87 CO -0.02 0.29 0.00 1.63 -1.00 0.00 0.00 179.01 179.90 1vh8 n LYS 88 N -4.55 1.81 -0.72 2.33 5.02 -1.03 -4.88 118.16 116.14 1vh8 n LYS 88 Ca 0.21 -1.12 0.00 0.00 -2.02 0.00 0.00 58.31 55.38 1vh8 n LYS 88 Cb 0.72 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 1vh8 n LYS 88 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vh8 n GLY 89 N 0.89 0.59 3.90 0.72 0.00 0.18 -5.02 105.19 106.46 1vh8 n GLY 89 Ca 0.10 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 1vh8 n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vh8 s TYR 90 N -2.00 3.48 0.22 1.61 1.51 -0.66 0.26 117.35 121.77 1vh8 s TYR 90 Ca 0.00 0.50 0.03 0.00 -1.01 0.00 0.00 57.07 56.59 1vh8 s TYR 90 Cb 0.00 -1.96 -0.05 0.00 -0.11 0.00 0.00 41.96 39.84 1vh8 s TYR 90 CO 0.00 0.45 0.01 0.21 -1.11 0.00 0.00 175.55 175.12 1vh8 s LYS 91 N -2.67 1.29 0.15 -0.62 2.20 0.19 -3.79 119.74 116.49 1vh8 s LYS 91 Ca 0.40 -1.65 -0.25 0.00 -0.36 0.00 0.00 55.97 54.11 1vh8 s LYS 91 Cb -0.12 -0.47 -0.08 0.00 -1.51 0.00 0.00 37.83 35.65 1vh8 s LYS 91 CO 0.25 -0.14 0.76 0.42 -0.36 0.00 0.00 175.35 176.29 1vh8 s ILE 92 N -3.54 4.43 -0.06 5.43 1.09 -1.26 -0.15 121.20 127.14 1vh8 s ILE 92 Ca 0.29 1.66 -0.05 0.00 -1.10 0.00 0.00 60.65 61.45 1vh8 s ILE 92 Cb 0.06 -4.12 -0.02 0.00 -1.06 0.00 0.00 42.46 37.32 1vh8 s ILE 92 CO 0.08 0.51 -0.09 0.61 -0.10 0.00 0.00 174.94 175.95 1vh8 n GLY 93 N 1.68 -0.65 3.54 6.18 0.00 0.27 -4.68 105.19 111.52 1vh8 n GLY 93 Ca -0.06 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 1vh8 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vh8 s ASN 94 N -4.52 -0.38 0.00 1.61 4.22 -1.16 -4.87 114.94 109.84 1vh8 s ASN 94 Ca -0.08 0.21 0.04 0.00 -2.14 0.00 0.00 52.86 50.90 1vh8 s ASN 94 Cb 0.01 0.36 -0.01 0.00 1.28 0.00 0.00 41.25 42.89 1vh8 s ASN 94 CO 0.11 -0.50 -0.14 0.68 -2.04 0.00 0.00 177.10 175.21 1vh8 s VAL 95 N -2.16 1.12 -0.12 3.54 -7.23 0.61 -1.67 120.40 114.50 1vh8 s VAL 95 Ca 0.01 -0.69 0.01 0.00 -1.81 0.00 0.00 61.98 59.50 1vh8 s VAL 95 Cb -0.01 -0.95 0.02 0.00 0.56 0.00 0.00 36.38 36.00 1vh8 s VAL 95 CO -0.03 0.25 -0.13 -0.62 -0.31 0.00 0.00 175.10 174.25 1vh8 s ASP 96 N -0.51 2.43 -0.08 4.85 3.68 -0.66 -0.47 116.67 125.91 1vh8 s ASP 96 Ca 0.05 -0.42 0.04 0.00 2.13 0.00 0.00 52.55 54.35 1vh8 s ASP 96 Cb -0.06 -1.06 0.00 0.00 -1.45 0.00 0.00 42.92 40.35 1vh8 s ASP 96 CO -0.00 -0.03 -0.20 -0.63 0.13 0.00 0.00 175.17 174.44 1vh8 s ILE 97 N 1.24 1.75 -0.30 4.11 1.01 0.25 -1.57 121.20 127.69 1vh8 s ILE 97 Ca -0.02 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 59.79 1vh8 s ILE 97 Cb -0.14 -1.52 0.07 0.00 0.01 0.00 0.00 42.46 40.89 1vh8 s ILE 97 CO -0.05 0.49 -0.02 -0.89 0.00 0.00 0.00 174.94 174.47 1vh8 s THR 98 N 0.27 2.47 -0.30 2.92 2.01 0.10 -1.03 115.64 122.08 1vh8 s THR 98 Ca -0.13 -1.82 -0.25 0.00 0.31 0.00 0.00 61.69 59.81 1vh8 s THR 98 Cb -0.16 -2.57 0.00 0.00 0.01 0.00 0.00 72.50 69.79 1vh8 s THR 98 CO 0.06 -0.26 0.84 -0.63 -0.69 0.00 0.00 174.62 173.94 1vh8 s ILE 99 N 1.08 4.75 -0.57 1.82 1.01 -0.30 -0.76 121.20 128.23 1vh8 s ILE 99 Ca -0.01 1.32 -0.17 0.00 0.00 0.00 0.00 60.65 61.79 1vh8 s ILE 99 Cb -0.20 -4.19 0.12 0.00 0.01 0.00 0.00 42.46 38.20 1vh8 s ILE 99 CO -0.05 -0.27 0.60 -0.63 0.00 0.00 0.00 174.94 174.59 1vh8 s ILE 100 N 3.07 5.04 -0.00 2.92 1.01 -0.46 -0.94 121.20 131.83 1vh8 s ILE 100 Ca 0.35 -1.29 -0.05 0.00 0.00 0.00 0.00 60.65 59.66 1vh8 s ILE 100 Cb -0.14 -4.41 -0.00 0.00 0.01 0.00 0.00 42.46 37.92 1vh8 s ILE 100 CO 0.12 -0.99 0.10 0.00 0.00 0.00 0.00 174.94 174.17 1vh8 s ALA 101 N 2.07 -0.23 -1.26 9.38 0.00 -0.45 -1.79 121.76 129.48 1vh8 s ALA 101 Ca 0.07 -0.16 -0.07 0.00 0.00 0.00 0.00 51.96 51.79 1vh8 s ALA 101 Cb -0.27 0.08 0.18 0.00 0.00 0.00 0.00 23.12 23.10 1vh8 s ALA 101 CO 0.04 -0.18 1.97 0.94 0.00 0.00 0.00 175.76 178.53 1vh8 n GLN 102 N 1.70 4.03 -3.90 0.00 -0.06 -1.26 -4.12 117.38 113.77 1vh8 n GLN 102 Ca -0.22 -3.66 -0.08 0.00 -2.00 0.00 0.00 57.00 51.04 1vh8 n GLN 102 Cb 0.56 -2.79 -0.08 0.00 -4.06 0.00 0.00 30.24 23.87 1vh8 n GLN 102 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1vh8 s ALA 103 N -0.53 -0.09 -0.00 1.69 0.00 -1.26 -4.99 121.76 116.58 1vh8 s ALA 103 Ca 0.42 -0.71 -0.00 0.00 0.00 0.00 0.00 51.96 51.67 1vh8 s ALA 103 Cb 0.12 0.43 -0.00 0.00 0.00 0.00 0.00 23.12 23.67 1vh8 s ALA 103 CO -0.01 -0.47 -0.00 -0.35 0.00 0.00 0.00 175.76 174.92 1vh8 n PRO 104 N 0.02 0.00 -1.36 0.00 -0.04 -1.26 -4.94 135.00 127.42 1vh8 n PRO 104 Ca -0.15 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.05 1vh8 n PRO 104 Cb 0.62 -0.56 -0.11 0.00 -0.04 0.00 0.00 33.50 33.41 1vh8 n PRO 104 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1vh8 n LYS 105 N -2.94 0.40 0.00 0.54 4.01 -1.26 -4.81 118.16 114.10 1vh8 n LYS 105 Ca -0.00 -1.67 0.00 0.00 -0.51 0.00 0.00 58.31 56.13 1vh8 n LYS 105 Cb 0.50 -3.50 0.00 0.00 -0.51 0.00 0.00 35.03 31.52 1vh8 n LYS 105 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1vh8 n ARG 107 N 8.05 0.00 -0.08 1.97 3.00 -1.26 -4.71 116.66 123.64 1vh8 n ARG 107 Ca 0.44 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 58.26 1vh8 n ARG 107 Cb 0.45 -0.04 0.21 0.00 0.00 0.00 0.00 32.46 33.09 1vh8 n ARG 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1vh8 h PRO 108 N 0.00 0.71 -0.01 -0.14 0.11 -2.05 -3.11 132.00 127.51 1vh8 h PRO 108 Ca 0.00 -0.16 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1vh8 h PRO 108 Cb 0.00 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.01 1vh8 h PRO 108 CO 0.00 0.70 -0.05 0.72 -0.21 0.00 0.00 178.00 179.16 1vh8 n HIS 109 N -4.25 0.00 -0.13 0.65 8.25 -1.26 -4.30 115.22 114.18 1vh8 n HIS 109 Ca 0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.44 1vh8 n HIS 109 Cb 0.26 -0.07 0.04 0.00 1.12 0.00 0.00 29.99 31.34 1vh8 n HIS 109 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1vh8 h ILE 110 N 1.04 0.76 -0.75 1.59 1.08 -1.93 -2.69 117.51 116.60 1vh8 h ILE 110 Ca 0.00 -0.07 -0.03 0.00 -0.39 0.00 0.00 64.86 64.37 1vh8 h ILE 110 Cb 0.31 0.55 -0.03 0.00 -3.07 0.00 0.00 36.82 34.57 1vh8 h ILE 110 CO 0.00 0.04 0.35 0.44 -0.69 0.00 0.00 178.15 178.28 1vh8 h ASP 111 N 0.20 0.98 0.00 1.72 3.45 -1.82 -1.47 116.42 119.47 1vh8 h ASP 111 Ca 0.21 -0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.55 1vh8 h ASP 111 Cb 0.26 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 1vh8 h ASP 111 CO -0.28 0.84 0.00 0.00 -1.57 0.00 0.00 179.24 178.23 1vh8 n ALA 112 N -2.43 1.22 0.00 3.45 0.00 -1.02 -1.61 120.51 120.12 1vh8 n ALA 112 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1vh8 n ALA 112 Cb 0.15 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1vh8 n ALA 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vh8 n ARG 114 N 0.68 0.00 0.09 0.00 1.74 -0.56 -2.43 116.66 116.18 1vh8 n ARG 114 Ca 0.00 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.96 1vh8 n ARG 114 Cb 0.01 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1vh8 n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vh8 h ALA 115 N 0.00 -0.45 -0.21 7.54 0.00 -1.58 0.35 119.26 124.91 1vh8 h ALA 115 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1vh8 h ALA 115 Cb 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1vh8 h ALA 115 CO 0.00 -0.81 0.14 0.87 0.00 0.00 0.00 179.25 179.45 1vh8 h LYS 116 N -0.47 0.20 0.05 0.00 1.57 -1.74 -0.76 116.57 115.41 1vh8 h LYS 116 Ca 0.05 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.56 1vh8 h LYS 116 Cb 0.53 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.80 1vh8 h LYS 116 CO -0.21 0.13 -1.06 0.82 -0.57 0.00 0.00 179.45 178.57 1vh8 h ILE 117 N 0.20 1.39 -0.65 1.86 2.04 -1.65 -2.71 117.51 118.00 1vh8 h ILE 117 Ca 0.08 -2.54 -0.03 0.00 1.00 0.00 0.00 64.86 63.37 1vh8 h ILE 117 Cb 0.09 2.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 1vh8 h ILE 117 CO -0.02 0.76 0.27 0.00 0.00 0.00 0.00 178.15 179.16 1vh8 h ALA 118 N 0.60 1.25 -0.21 1.87 0.00 0.71 -1.37 119.26 122.11 1vh8 h ALA 118 Ca -0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1vh8 h ALA 118 Cb 1.72 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1vh8 h ALA 118 CO 0.19 0.56 -0.02 1.49 0.00 0.00 0.00 179.25 181.46 1vh8 h GLU 119 N 0.93 0.39 0.00 0.00 4.81 -1.14 0.98 114.58 120.54 1vh8 h GLU 119 Ca 0.22 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1vh8 h GLU 119 Cb 0.17 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1vh8 h GLU 119 CO -0.02 0.60 -0.03 -0.44 -0.73 0.00 0.00 179.01 178.39 1vh8 h ASP 120 N 0.13 0.00 -0.37 1.04 3.32 -1.29 -2.59 116.42 116.66 1vh8 h ASP 120 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1vh8 h ASP 120 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1vh8 h ASP 120 CO 0.02 0.03 0.00 0.18 -1.72 0.00 0.00 179.24 177.75 1vh8 n LEU 121 N -3.15 3.14 -4.26 1.55 4.77 -0.53 -4.59 117.00 113.93 1vh8 n LEU 121 Ca 0.00 -1.64 -0.37 0.00 -0.03 0.00 0.00 56.01 53.98 1vh8 n LEU 121 Cb 0.32 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1vh8 n LEU 121 CO 0.28 0.72 -0.05 0.00 -1.33 0.00 0.00 177.39 177.01 1vh8 n GLN 122 N 1.10 -2.86 -3.81 3.23 6.02 0.25 -4.76 117.38 116.55 1vh8 n GLN 122 Ca 0.16 0.34 -0.21 0.00 -0.01 0.00 0.00 57.00 57.28 1vh8 n GLN 122 Cb 0.50 -5.03 -0.05 0.00 1.02 0.00 0.00 30.24 26.69 1vh8 n GLN 122 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vh8 s ASP 124 N -2.89 6.79 0.63 0.00 2.15 -1.26 -4.60 116.67 117.49 1vh8 s ASP 124 Ca 0.07 1.13 0.32 0.00 0.43 0.00 0.00 52.55 54.51 1vh8 s ASP 124 Cb 0.00 -2.31 1.78 0.00 -0.30 0.00 0.00 42.92 42.10 1vh8 s ASP 124 CO 0.05 -0.04 2.07 -0.29 -0.17 0.00 0.00 175.17 176.80 1vh8 h ILE 125 N 2.33 0.21 0.00 4.11 2.10 -1.92 0.32 117.51 124.66 1vh8 h ILE 125 Ca -0.48 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.46 1vh8 h ILE 125 Cb 1.18 0.79 0.00 0.00 -1.09 0.00 0.00 36.82 37.70 1vh8 h ILE 125 CO 0.67 0.00 0.00 1.21 -1.08 0.00 0.00 178.15 178.95 1vh8 n GLU 126 N -3.35 0.47 -0.06 2.19 0.00 -1.26 -2.25 120.64 116.37 1vh8 n GLU 126 Ca 0.00 0.05 0.10 0.00 0.00 0.00 0.00 57.16 57.31 1vh8 n GLU 126 Cb 0.33 -1.50 0.12 0.00 0.00 0.00 0.00 31.44 30.39 1vh8 n GLU 126 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1vh8 n GLN 127 N -1.18 1.99 -4.04 5.31 6.02 0.11 -4.91 117.38 120.68 1vh8 n GLN 127 Ca 0.13 -1.85 -0.30 0.00 -0.01 0.00 0.00 57.00 54.97 1vh8 n GLN 127 Cb 0.14 -1.41 -0.16 0.00 1.02 0.00 0.00 30.24 29.83 1vh8 n GLN 127 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vh8 s VAL 128 N -1.55 1.54 -0.08 5.09 1.01 -0.95 -0.28 120.40 125.17 1vh8 s VAL 128 Ca 0.27 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1vh8 s VAL 128 Cb 0.18 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 1vh8 s VAL 128 CO 0.26 0.45 -0.16 0.21 0.00 0.00 0.00 175.10 175.87 1vh8 s ASN 129 N 1.47 3.85 -0.09 3.32 2.47 0.38 -4.95 114.94 121.40 1vh8 s ASN 129 Ca 0.04 -0.30 -0.01 0.00 0.42 0.00 0.00 52.86 53.01 1vh8 s ASN 129 Cb -0.13 -1.15 0.03 0.00 -1.45 0.00 0.00 41.25 38.54 1vh8 s ASN 129 CO -0.10 0.26 -0.04 -0.69 -3.72 0.00 0.00 177.10 172.81 1vh8 s VAL 130 N -0.20 0.67 0.24 -5.21 1.01 -1.26 -0.58 120.40 115.06 1vh8 s VAL 130 Ca -0.00 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1vh8 s VAL 130 Cb -0.13 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 1vh8 s VAL 130 CO 0.03 0.30 -0.09 -1.59 0.00 0.00 0.00 175.10 173.75 1vh8 s LYS 131 N 1.74 1.43 -0.03 2.72 -2.85 -0.20 -4.99 119.74 117.56 1vh8 s LYS 131 Ca 0.03 -1.69 0.03 0.00 -1.00 0.00 0.00 55.97 53.34 1vh8 s LYS 131 Cb -0.13 -1.09 0.00 0.00 -2.06 0.00 0.00 37.83 34.56 1vh8 s LYS 131 CO -0.06 0.09 -0.10 0.00 0.10 0.00 0.00 175.35 175.38 1vh8 s ALA 132 N -3.03 0.98 0.17 0.59 0.00 -1.26 -1.14 121.76 118.06 1vh8 s ALA 132 Ca 0.26 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.81 1vh8 s ALA 132 Cb 0.02 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1vh8 s ALA 132 CO 0.09 0.16 0.11 -0.08 0.00 0.00 0.00 175.76 176.05 1vh8 s THR 133 N 0.15 0.04 0.31 0.00 -1.32 -0.12 -4.95 115.64 109.76 1vh8 s THR 133 Ca -0.03 -1.94 0.05 0.00 -1.21 0.00 0.00 61.69 58.56 1vh8 s THR 133 Cb -0.09 -2.29 -0.06 0.00 -1.51 0.00 0.00 72.50 68.55 1vh8 s THR 133 CO 0.01 -0.20 0.02 0.42 -2.21 0.00 0.00 174.62 172.65 1vh8 s THR 134 N -4.11 1.35 -0.65 5.08 -4.23 -1.26 -1.33 115.64 110.49 1vh8 s THR 134 Ca 0.32 -2.04 0.16 0.00 -1.18 0.00 0.00 61.69 58.95 1vh8 s THR 134 Cb 0.07 -2.66 0.78 0.00 1.34 0.00 0.00 72.50 72.03 1vh8 s THR 134 CO 0.07 -0.12 1.69 0.35 -0.54 0.00 0.00 174.62 176.07 1vh8 n THR 135 N -0.64 2.34 -3.71 3.99 -2.24 -1.26 -4.95 114.28 107.81 1vh8 n THR 135 Ca -0.04 -1.29 -0.24 0.00 -2.27 0.00 0.00 64.05 60.21 1vh8 n THR 135 Cb 0.65 -0.11 0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1vh8 n THR 135 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vh8 n GLU 136 N 0.85 -3.55 -0.92 -0.78 1.02 -1.26 -1.94 120.64 114.07 1vh8 n GLU 136 Ca 0.27 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.97 1vh8 n GLU 136 Cb 1.06 -4.86 0.00 0.00 -0.02 0.00 0.00 31.44 27.63 1vh8 n GLU 136 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1vh8 n LYS 137 N -4.20 -0.75 -3.92 3.49 4.76 -1.26 -5.00 118.16 111.27 1vh8 n LYS 137 Ca -0.24 0.19 -0.21 0.00 -2.87 0.00 0.00 58.31 55.18 1vh8 n LYS 137 Cb 0.66 -3.93 -0.02 0.00 -1.84 0.00 0.00 35.03 29.90 1vh8 n LYS 137 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1vh8 s LEU 138 N 0.00 4.09 0.00 -0.35 1.43 -0.82 -4.20 118.68 118.83 1vh8 s LEU 138 Ca 0.00 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1vh8 s LEU 138 Cb 0.00 -2.67 0.00 0.00 0.03 0.00 0.00 46.19 43.55 1vh8 s LEU 138 CO 0.00 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.06 1vh8 n GLY 139 N -1.38 -1.98 0.24 -3.19 0.00 -1.26 -1.22 105.19 96.40 1vh8 n GLY 139 Ca -0.07 -1.27 0.08 0.00 0.00 0.00 0.00 46.02 44.76 1vh8 n GLY 139 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1vh8 h PHE 140 N -0.82 0.00 0.07 1.61 -5.15 -1.96 -0.39 116.94 110.29 1vh8 h PHE 140 Ca 0.02 0.00 -0.24 0.00 -0.20 0.00 0.00 57.97 57.55 1vh8 h PHE 140 Cb 0.81 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.97 1vh8 h PHE 140 CO 0.00 0.16 -1.09 1.79 -2.00 0.00 0.00 178.31 177.16 1vh8 h THR 141 N 0.00 1.53 -0.52 0.88 1.35 -1.75 0.84 112.91 115.25 1vh8 h THR 141 Ca -0.00 -2.98 -0.07 0.00 -0.55 0.00 0.00 66.41 62.81 1vh8 h THR 141 Cb 0.31 2.78 -0.02 0.00 -1.73 0.00 0.00 68.15 69.49 1vh8 h THR 141 CO 0.02 0.87 0.02 1.23 -0.25 0.00 0.00 175.52 177.41 1vh8 h GLY 142 N 1.87 0.92 -0.22 5.82 0.00 0.08 -1.11 103.07 110.43 1vh8 h GLY 142 Ca -0.09 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1vh8 h GLY 142 CO 0.17 0.57 0.00 0.54 0.00 0.00 0.00 176.54 177.82 1vh8 n ARG 143 N -4.21 1.35 -3.65 4.80 1.74 -0.28 -4.52 116.66 111.88 1vh8 n ARG 143 Ca 0.03 -0.53 -0.25 0.00 -0.77 0.00 0.00 57.85 56.33 1vh8 n ARG 143 Cb 0.30 -1.28 0.07 0.00 -1.02 0.00 0.00 32.46 30.53 1vh8 n ARG 143 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1vh8 n GLN 144 N -0.20 -7.37 0.02 5.56 6.02 -0.42 -4.87 117.38 116.11 1vh8 n GLN 144 Ca 0.12 0.78 0.12 0.00 -0.01 0.00 0.00 57.00 58.01 1vh8 n GLN 144 Cb 0.17 -5.80 0.12 0.00 1.02 0.00 0.00 30.24 25.76 1vh8 n GLN 144 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1vh8 n GLU 145 N -4.88 0.13 -3.11 -1.09 1.02 0.27 -4.95 120.64 108.02 1vh8 n GLU 145 Ca -0.01 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1vh8 n GLU 145 Cb 0.56 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1vh8 n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vh8 n GLY 146 N 1.44 -1.27 3.03 0.62 0.00 -1.23 -1.61 105.19 106.17 1vh8 n GLY 146 Ca 0.04 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 1vh8 n GLY 146 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vh8 s ILE 147 N -2.69 0.53 0.49 -0.61 -4.36 -0.81 -4.31 121.20 109.43 1vh8 s ILE 147 Ca 0.00 -0.79 0.02 0.00 -0.26 0.00 0.00 60.65 59.62 1vh8 s ILE 147 Cb 0.00 -0.54 -0.02 0.00 1.25 0.00 0.00 42.46 43.15 1vh8 s ILE 147 CO 0.00 -0.20 0.02 0.00 0.24 0.00 0.00 174.94 175.00 1vh8 s ALA 148 N -0.94 3.86 -0.28 2.27 0.00 -0.74 -1.26 121.76 124.67 1vh8 s ALA 148 Ca -0.05 -0.69 -0.19 0.00 0.00 0.00 0.00 51.96 51.03 1vh8 s ALA 148 Cb -0.07 0.14 0.10 0.00 0.00 0.00 0.00 23.12 23.29 1vh8 s ALA 148 CO 0.00 -0.07 0.83 0.00 0.00 0.00 0.00 175.76 176.52 1vh8 s GLU 150 N 1.14 2.80 0.00 0.00 2.56 0.06 -2.09 118.70 123.17 1vh8 s GLU 150 Ca -0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 54.97 54.24 1vh8 s GLU 150 Cb -0.05 -2.51 -0.01 0.00 2.00 0.00 0.00 34.13 33.57 1vh8 s GLU 150 CO -0.13 0.54 0.04 0.00 -0.56 0.00 0.00 175.26 175.15 1vh8 s ALA 151 N -0.49 -0.08 0.03 6.30 0.00 0.40 0.02 121.76 127.93 1vh8 s ALA 151 Ca 0.07 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.81 1vh8 s ALA 151 Cb -0.12 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1vh8 s ALA 151 CO 0.02 -0.14 -0.11 0.14 0.00 0.00 0.00 175.76 175.67 1vh8 s VAL 152 N -1.03 0.82 0.05 0.00 -7.23 -0.61 0.39 120.40 112.79 1vh8 s VAL 152 Ca -0.11 -0.83 0.01 0.00 -1.81 0.00 0.00 61.98 59.24 1vh8 s VAL 152 Cb -0.07 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 36.08 1vh8 s VAL 152 CO 0.00 -0.05 -0.06 0.00 -0.31 0.00 0.00 175.10 174.68 1vh8 s ALA 153 N -0.80 0.52 -0.17 1.32 0.00 -0.21 -1.65 121.76 120.77 1vh8 s ALA 153 Ca -0.01 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1vh8 s ALA 153 Cb -0.07 0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.18 1vh8 s ALA 153 CO 0.01 -0.11 -0.16 -1.17 0.00 0.00 0.00 175.76 174.33 1vh8 s LEU 154 N -1.85 2.01 0.02 0.00 2.96 -0.67 -0.63 118.68 120.52 1vh8 s LEU 154 Ca -0.07 -0.65 -0.01 0.00 -0.22 0.00 0.00 54.13 53.18 1vh8 s LEU 154 Cb -0.07 -1.31 -0.04 0.00 0.50 0.00 0.00 46.19 45.27 1vh8 s LEU 154 CO -0.01 -0.06 0.17 -0.76 -1.32 0.00 0.00 176.35 174.37 1vh8 s LEU 155 N 1.39 4.27 -0.01 -0.68 1.43 0.93 0.94 118.68 126.95 1vh8 s LEU 155 Ca 0.03 0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.43 1vh8 s LEU 155 Cb -0.14 -2.66 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 1vh8 s LEU 155 CO -0.11 0.23 -0.07 -0.63 0.23 0.00 0.00 176.35 176.00 1vh8 s ILE 156 N -1.37 0.55 0.08 -0.59 1.01 0.79 -1.08 121.20 120.60 1vh8 s ILE 156 Ca 0.29 -0.29 -0.34 0.00 0.00 0.00 0.00 60.65 60.32 1vh8 s ILE 156 Cb -0.13 -0.47 -0.13 0.00 0.01 0.00 0.00 42.46 41.74 1vh8 s ILE 156 CO 0.21 0.16 1.69 0.54 0.00 0.00 0.00 174.94 177.54 1vh8 n ARG 157 N 2.98 2.20 0.00 2.79 5.12 -1.10 0.56 116.66 129.21 1vh8 n ARG 157 Ca -0.14 0.80 0.13 0.00 -1.93 0.00 0.00 57.85 56.71 1vh8 n ARG 157 Cb 0.57 -2.60 0.38 0.00 -1.16 0.00 0.00 32.46 29.66 1vh8 n ARG 157 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64