#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v27 n SER 2 N 0.00 -6.72 -3.61 1.61 7.64 -1.26 -5.06 113.62 106.22 1v27 n SER 2 Ca 0.00 1.36 0.02 0.00 1.01 0.00 0.00 58.87 61.26 1v27 n SER 2 Cb 0.00 -4.10 -0.06 0.00 -1.01 0.00 0.00 64.21 59.04 1v27 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v27 s SER 3 N -6.01 -0.10 0.00 6.43 0.15 -1.26 -5.16 113.70 107.74 1v27 s SER 3 Ca 0.00 0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1v27 s SER 3 Cb 0.00 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.36 1v27 s SER 3 CO 0.00 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.02 1v27 n GLY 4 N 3.27 4.49 2.53 9.45 0.00 -1.26 -4.96 105.19 118.70 1v27 n GLY 4 Ca -0.16 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 44.95 1v27 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v27 n SER 5 N 0.00 1.78 -3.66 1.61 3.41 -1.26 -5.04 113.62 110.46 1v27 n SER 5 Ca 0.00 -2.96 -0.24 0.00 -0.26 0.00 0.00 58.87 55.41 1v27 n SER 5 Cb 0.00 -0.66 -0.17 0.00 -0.26 0.00 0.00 64.21 63.11 1v27 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1v27 s SER 6 N -1.27 2.01 0.41 4.04 0.01 -1.26 -4.55 113.70 113.10 1v27 s SER 6 Ca 0.32 -0.40 -0.22 0.00 1.31 0.00 0.00 55.95 56.97 1v27 s SER 6 Cb 0.06 -0.28 -0.11 0.00 0.21 0.00 0.00 66.02 65.91 1v27 s SER 6 CO -0.13 -0.30 0.96 -0.83 0.41 0.00 0.00 173.24 173.35 1v27 s GLY 7 N 2.10 2.50 0.00 3.44 0.00 -1.26 -4.68 107.32 109.42 1v27 s GLY 7 Ca 0.03 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.20 1v27 s GLY 7 CO -0.07 0.78 0.00 0.61 0.00 0.00 0.00 173.10 174.42 1v27 n GLY 8 N -0.32 1.43 3.04 0.20 0.00 -1.26 -4.53 105.19 103.76 1v27 n GLY 8 Ca 0.06 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 1v27 n GLY 8 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1v27 s GLN 9 N 4.52 0.19 -0.03 1.61 -0.21 -1.11 -0.29 119.66 124.34 1v27 s GLN 9 Ca 0.00 0.67 0.04 0.00 0.02 0.00 0.00 55.36 56.10 1v27 s GLN 9 Cb 0.00 -0.06 -0.03 0.00 1.00 0.00 0.00 33.01 33.93 1v27 s GLN 9 CO 0.00 -0.23 -0.15 -1.17 -2.12 0.00 0.00 175.29 171.62 1v27 s LEU 10 N 1.93 2.71 -0.26 2.90 2.96 -0.18 -1.29 118.68 127.45 1v27 s LEU 10 Ca -0.03 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 53.54 1v27 s LEU 10 Cb -0.11 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 1v27 s LEU 10 CO -0.09 0.32 0.13 -0.55 -1.32 0.00 0.00 176.35 174.84 1v27 s SER 11 N -0.92 5.58 -0.06 3.68 0.15 -0.01 -0.50 113.70 121.63 1v27 s SER 11 Ca 0.12 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.70 1v27 s SER 11 Cb -0.11 -2.02 0.01 0.00 -1.71 0.00 0.00 66.02 62.20 1v27 s SER 11 CO 0.02 -0.03 -0.11 -0.63 1.20 0.00 0.00 173.24 173.69 1v27 s ILE 12 N 1.59 1.03 -0.30 6.45 1.01 -1.22 -2.24 121.20 127.52 1v27 s ILE 12 Ca 0.06 -0.42 -0.08 0.00 0.00 0.00 0.00 60.65 60.22 1v27 s ILE 12 Cb -0.15 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.37 1v27 s ILE 12 CO 0.07 0.33 0.11 -0.75 0.00 0.00 0.00 174.94 174.69 1v27 s LYS 13 N 0.68 3.21 0.14 2.79 2.20 0.37 -3.88 119.74 125.26 1v27 s LYS 13 Ca -0.14 -0.79 0.07 0.00 -0.36 0.00 0.00 55.97 54.75 1v27 s LYS 13 Cb -0.15 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 1v27 s LYS 13 CO 0.03 -0.42 -0.00 -0.51 -0.36 0.00 0.00 175.35 174.09 1v27 s LEU 14 N 1.55 3.35 0.14 5.43 1.43 -1.26 0.13 118.68 129.44 1v27 s LEU 14 Ca 0.04 -0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 52.59 1v27 s LEU 14 Cb -0.17 -2.04 0.06 0.00 0.03 0.00 0.00 46.19 44.08 1v27 s LEU 14 CO 0.04 0.12 0.55 0.86 0.23 0.00 0.00 176.35 178.15 1v27 s TRP 15 N -1.56 -0.46 -0.09 0.29 -0.11 0.59 -2.68 118.94 114.91 1v27 s TRP 15 Ca 0.26 0.27 0.02 0.00 1.22 0.00 0.00 56.10 57.88 1v27 s TRP 15 Cb -0.10 0.47 0.01 0.00 -1.50 0.00 0.00 33.47 32.35 1v27 s TRP 15 CO 0.18 -0.79 -0.15 0.12 -4.62 0.00 0.00 176.95 171.69 1v27 s PHE 16 N -3.57 1.83 -0.65 5.86 5.36 -1.26 0.18 117.98 125.73 1v27 s PHE 16 Ca 0.01 -0.76 -0.01 0.00 -0.96 0.00 0.00 56.93 55.20 1v27 s PHE 16 Cb -0.00 -1.31 0.17 0.00 -0.34 0.00 0.00 43.02 41.53 1v27 s PHE 16 CO -0.11 -0.37 0.46 -0.51 -1.46 0.00 0.00 175.22 173.23 1v27 s ASP 17 N 0.73 5.17 0.64 6.13 1.01 -0.98 -4.89 116.67 124.48 1v27 s ASP 17 Ca -0.12 -3.03 0.42 0.00 0.71 0.00 0.00 52.55 50.52 1v27 s ASP 17 Cb -0.16 -1.82 2.23 0.00 1.01 0.00 0.00 42.92 44.18 1v27 s ASP 17 CO 0.03 -0.31 2.31 0.07 0.21 0.00 0.00 175.17 177.47 1v27 h LYS 18 N 6.75 0.00 0.00 8.23 -0.00 -1.90 0.40 116.57 130.06 1v27 h LYS 18 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1v27 h LYS 18 Cb 0.92 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.15 1v27 h LYS 18 CO 0.72 0.00 0.00 0.28 -0.00 0.00 0.00 179.45 180.46 1v27 n VAL 19 N -3.16 0.00 1.40 0.07 0.31 -1.26 -2.91 118.33 112.77 1v27 n VAL 19 Ca -0.03 1.30 0.12 0.00 -0.01 0.00 0.00 64.34 65.72 1v27 n VAL 19 Cb 0.11 -2.12 0.47 0.00 -0.91 0.00 0.00 33.84 31.38 1v27 n VAL 19 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1v27 n GLY 20 N -0.87 0.06 3.33 2.92 0.00 -1.17 -4.91 105.19 104.56 1v27 n GLY 20 Ca 0.00 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 1v27 n GLY 20 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1v27 n HIS 21 N 0.16 -2.51 -4.09 1.61 -0.00 0.13 -4.82 115.22 105.71 1v27 n HIS 21 Ca 0.17 0.85 -0.33 0.00 -0.00 0.00 0.00 57.72 58.42 1v27 n HIS 21 Cb 0.32 -4.63 -0.16 0.00 -0.00 0.00 0.00 29.99 25.52 1v27 n HIS 21 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1v27 s GLN 22 N -6.10 3.00 0.34 -0.41 1.11 -0.56 0.20 119.66 117.24 1v27 s GLN 22 Ca 0.49 -0.83 -0.27 0.00 0.01 0.00 0.00 55.36 54.76 1v27 s GLN 22 Cb -0.22 -2.65 -0.09 0.00 -1.01 0.00 0.00 33.01 29.04 1v27 s GLN 22 CO 0.61 -0.23 1.14 -1.17 0.01 0.00 0.00 175.29 175.65 1v27 s LEU 23 N 1.31 4.36 -0.15 2.90 1.98 0.81 -2.32 118.68 127.55 1v27 s LEU 23 Ca 0.04 2.31 -0.02 0.00 -2.89 0.00 0.00 54.13 53.57 1v27 s LEU 23 Cb -0.14 -3.85 -0.02 0.00 0.66 0.00 0.00 46.19 42.85 1v27 s LEU 23 CO -0.11 -0.42 -0.07 -0.63 -1.89 0.00 0.00 176.35 173.23 1v27 s ILE 24 N -1.32 3.54 -0.29 6.68 1.09 0.47 -1.26 121.20 130.11 1v27 s ILE 24 Ca 0.51 -0.48 -0.01 0.00 -1.10 0.00 0.00 60.65 59.57 1v27 s ILE 24 Cb -0.31 -2.53 0.13 0.00 -1.06 0.00 0.00 42.46 38.69 1v27 s ILE 24 CO 0.40 0.50 0.27 0.54 -0.10 0.00 0.00 174.94 176.55 1v27 s VAL 25 N 0.43 -0.34 -0.11 2.92 0.11 -0.61 0.22 120.40 123.02 1v27 s VAL 25 Ca -0.06 -0.56 -0.10 0.00 -2.93 0.00 0.00 61.98 58.33 1v27 s VAL 25 Cb -0.15 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.68 1v27 s VAL 25 CO 0.04 -0.52 0.23 -0.89 -3.33 0.00 0.00 175.10 170.62 1v27 s THR 26 N 2.28 5.35 -0.75 5.04 2.01 0.35 -2.57 115.64 127.34 1v27 s THR 26 Ca 0.10 0.41 -0.16 0.00 0.31 0.00 0.00 61.69 62.35 1v27 s THR 26 Cb -0.14 -3.52 0.18 0.00 0.01 0.00 0.00 72.50 69.03 1v27 s THR 26 CO -0.32 0.55 0.74 -0.63 -0.69 0.00 0.00 174.62 174.27 1v27 s ILE 27 N -0.65 5.34 0.00 1.82 -1.09 -0.91 -0.48 121.20 125.24 1v27 s ILE 27 Ca 0.16 -2.00 0.00 0.00 -2.23 0.00 0.00 60.65 56.58 1v27 s ILE 27 Cb -0.13 -4.48 0.00 0.00 -1.58 0.00 0.00 42.46 36.27 1v27 s ILE 27 CO 0.05 -1.06 0.00 0.18 -1.23 0.00 0.00 174.94 172.89 1v27 n LEU 28 N 4.79 0.00 -3.87 2.97 4.77 -0.95 0.15 117.00 124.87 1v27 n LEU 28 Ca 0.06 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.97 1v27 n LEU 28 Cb 0.45 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1v27 n LEU 28 CO 0.42 0.00 0.45 -0.83 -1.33 0.00 0.00 177.39 176.10 1v27 s GLY 29 N 0.00 0.10 0.43 -0.72 0.00 -1.21 0.48 107.32 106.40 1v27 s GLY 29 Ca 0.00 -0.49 0.08 0.00 0.00 0.00 0.00 44.72 44.31 1v27 s GLY 29 CO 0.00 -0.21 0.42 0.00 0.00 0.00 0.00 173.10 173.31 1v27 s ALA 30 N -3.57 4.17 0.12 3.20 0.00 -0.57 -0.83 121.76 124.28 1v27 s ALA 30 Ca 0.14 -1.84 -0.24 0.00 0.00 0.00 0.00 51.96 50.01 1v27 s ALA 30 Cb -0.05 -1.10 0.07 0.00 0.00 0.00 0.00 23.12 22.04 1v27 s ALA 30 CO 0.08 -0.26 0.63 -1.59 0.00 0.00 0.00 175.76 174.62 1v27 s LYS 31 N -4.18 1.23 -1.45 0.00 0.00 -0.41 -3.83 119.74 111.08 1v27 s LYS 31 Ca 0.49 -0.35 -0.10 0.00 0.00 0.00 0.00 55.97 56.01 1v27 s LYS 31 Cb -0.04 0.57 0.05 0.00 0.00 0.00 0.00 37.83 38.41 1v27 s LYS 31 CO 0.29 -0.52 0.75 -0.25 0.00 0.00 0.00 175.35 175.62 1v27 n ASP 32 N -0.18 -4.97 -4.78 0.03 9.92 -1.26 -2.73 116.55 112.57 1v27 n ASP 32 Ca -0.17 -0.51 -0.36 0.00 -0.53 0.00 0.00 54.79 53.22 1v27 n ASP 32 Cb 0.64 -4.01 -0.05 0.00 -0.64 0.00 0.00 41.12 37.06 1v27 n ASP 32 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1v27 s LEU 33 N -6.88 4.19 -0.68 0.64 1.02 -1.25 -4.47 118.68 111.25 1v27 s LEU 33 Ca 0.48 1.96 -0.27 0.00 0.02 0.00 0.00 54.13 56.33 1v27 s LEU 33 Cb -0.24 -4.15 0.01 0.00 0.02 0.00 0.00 46.19 41.83 1v27 s LEU 33 CO 0.59 -0.36 1.56 -2.16 0.02 0.00 0.00 176.35 176.01 1v27 s PRO 34 N -2.40 2.92 0.00 1.29 0.04 -1.26 -4.99 135.00 130.60 1v27 s PRO 34 Ca 0.56 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1v27 s PRO 34 Cb -0.20 -4.28 0.00 0.00 0.04 0.00 0.00 34.50 30.06 1v27 s PRO 34 CO 0.26 -2.43 0.00 -1.13 0.04 0.00 0.00 177.00 173.74 1v27 n SER 35 N 11.01 -1.36 -4.93 6.66 3.41 -1.26 -5.00 113.62 122.15 1v27 n SER 35 Ca 0.12 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.47 1v27 n SER 35 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1v27 n SER 35 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1v27 s ARG 36 N -2.05 3.51 0.04 4.33 0.52 -1.22 -5.03 118.95 119.06 1v27 s ARG 36 Ca 0.00 -0.16 -0.29 0.00 -0.52 0.00 0.00 55.73 54.76 1v27 s ARG 36 Cb 0.00 -2.58 -0.17 0.00 0.52 0.00 0.00 34.95 32.71 1v27 s ARG 36 CO 0.00 0.06 1.38 0.93 0.02 0.00 0.00 175.30 177.69 1v27 h GLU 37 N 0.69 -0.75 -1.14 3.54 5.08 -1.93 -2.68 114.58 117.40 1v27 h GLU 37 Ca -0.49 0.05 0.39 0.00 -1.00 0.00 0.00 59.36 58.31 1v27 h GLU 37 Cb 1.21 0.17 -0.14 0.00 0.50 0.00 0.00 28.75 30.49 1v27 h GLU 37 CO 0.62 -0.44 0.69 0.22 -1.00 0.00 0.00 179.01 179.09 1v27 h ASP 38 N -0.95 0.36 0.00 1.42 1.82 -2.00 -3.45 116.42 113.61 1v27 h ASP 38 Ca -0.08 0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.74 1v27 h ASP 38 Cb 0.65 0.15 0.00 0.00 0.68 0.00 0.00 39.33 40.81 1v27 h ASP 38 CO 0.13 -0.21 0.00 0.61 -1.61 0.00 0.00 179.24 178.16 1v27 n GLY 39 N -1.39 3.20 3.05 -0.78 0.00 -1.01 -5.11 105.19 103.15 1v27 n GLY 39 Ca 0.35 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 1v27 n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v27 n ARG 40 N 0.00 -0.00 0.00 1.61 5.12 -1.26 -4.33 116.66 117.80 1v27 n ARG 40 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1v27 n ARG 40 Cb 0.00 -1.02 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 1v27 n ARG 40 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1v27 n PRO 41 N 2.24 0.91 -1.44 5.56 -0.04 -1.26 -3.41 135.00 137.55 1v27 n PRO 41 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1v27 n PRO 41 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 1v27 n PRO 41 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1v27 n ARG 42 N -0.08 0.00 -3.86 0.54 1.85 -1.26 -4.69 116.66 109.16 1v27 n ARG 42 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.56 1v27 n ARG 42 Cb 0.00 0.00 -0.13 0.00 -1.05 0.00 0.00 32.46 31.28 1v27 n ARG 42 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 1v27 s ASN 43 N -0.87 4.22 0.62 2.89 0.01 -1.26 0.36 114.94 120.91 1v27 s ASN 43 Ca 0.00 -3.26 -0.14 0.00 -0.71 0.00 0.00 52.86 48.75 1v27 s ASN 43 Cb 0.00 -1.47 -0.03 0.00 0.41 0.00 0.00 41.25 40.17 1v27 s ASN 43 CO 0.00 -0.18 1.05 -2.16 -1.51 0.00 0.00 177.10 174.30 1v27 s PRO 44 N -0.59 3.25 -0.28 -0.60 0.04 -1.19 -0.30 135.00 135.33 1v27 s PRO 44 Ca 0.21 1.10 -0.17 0.00 0.04 0.00 0.00 61.00 62.18 1v27 s PRO 44 Cb -0.16 -2.03 0.09 0.00 0.04 0.00 0.00 34.50 32.44 1v27 s PRO 44 CO -0.07 -0.86 0.73 1.52 0.04 0.00 0.00 177.00 178.36 1v27 s TYR 45 N -2.66 -0.98 0.40 0.56 -0.85 -0.67 -2.13 117.35 111.01 1v27 s TYR 45 Ca 0.61 2.00 -0.09 0.00 -0.52 0.00 0.00 57.07 59.08 1v27 s TYR 45 Cb -0.15 0.57 -0.06 0.00 0.38 0.00 0.00 41.96 42.71 1v27 s TYR 45 CO 0.42 -0.49 0.74 0.08 -1.52 0.00 0.00 175.55 174.79 1v27 s VAL 46 N 1.48 4.85 -0.22 -3.49 1.01 -1.26 -2.91 120.40 119.86 1v27 s VAL 46 Ca -0.09 0.45 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 1v27 s VAL 46 Cb -0.05 -3.76 0.11 0.00 0.00 0.00 0.00 36.38 32.68 1v27 s VAL 46 CO -0.17 -0.56 0.27 -0.75 0.00 0.00 0.00 175.10 173.89 1v27 s LYS 47 N -3.98 0.24 0.21 2.72 2.20 -0.86 -2.55 119.74 117.72 1v27 s LYS 47 Ca 0.49 0.28 -0.09 0.00 -0.36 0.00 0.00 55.97 56.29 1v27 s LYS 47 Cb -0.10 -0.98 -0.07 0.00 -1.51 0.00 0.00 37.83 35.17 1v27 s LYS 47 CO 0.34 -0.67 0.52 0.42 -0.36 0.00 0.00 175.35 175.60 1v27 s ILE 48 N 2.39 4.96 -0.28 5.43 1.01 0.26 -2.63 121.20 132.35 1v27 s ILE 48 Ca 0.09 0.42 0.01 0.00 0.00 0.00 0.00 60.65 61.16 1v27 s ILE 48 Cb -0.16 -3.62 0.16 0.00 0.01 0.00 0.00 42.46 38.85 1v27 s ILE 48 CO -0.14 -0.05 0.40 -0.31 0.00 0.00 0.00 174.94 174.85 1v27 s TYR 49 N -1.79 -0.97 -0.57 3.97 2.02 -0.60 -2.91 117.35 116.50 1v27 s TYR 49 Ca 0.46 0.44 -0.27 0.00 -0.37 0.00 0.00 57.07 57.33 1v27 s TYR 49 Cb -0.11 -0.11 -0.01 0.00 -0.40 0.00 0.00 41.96 41.33 1v27 s TYR 49 CO 0.22 -0.93 1.67 0.12 -1.57 0.00 0.00 175.55 175.06 1v27 s PHE 50 N 2.55 1.92 0.75 2.71 2.19 -0.76 -2.51 117.98 124.82 1v27 s PHE 50 Ca 0.10 0.60 -0.11 0.00 0.33 0.00 0.00 56.93 57.85 1v27 s PHE 50 Cb -0.13 -4.23 0.05 0.00 -1.31 0.00 0.00 43.02 37.39 1v27 s PHE 50 CO -0.27 -2.28 1.10 -0.51 1.83 0.00 0.00 175.22 175.09 1v27 s LEU 51 N 7.61 3.10 0.19 6.12 1.02 -0.82 -1.74 118.68 134.16 1v27 s LEU 51 Ca 0.62 1.87 0.24 0.00 0.02 0.00 0.00 54.13 56.88 1v27 s LEU 51 Cb -0.13 -4.53 0.91 0.00 0.02 0.00 0.00 46.19 42.46 1v27 s LEU 51 CO 0.23 -1.97 1.74 -0.81 0.02 0.00 0.00 176.35 175.56 1v27 n PRO 52 N -3.30 0.18 -1.27 1.29 -0.04 -1.26 -4.11 135.00 126.50 1v27 n PRO 52 Ca 0.09 0.28 -0.59 0.00 -0.04 0.00 0.00 63.50 63.25 1v27 n PRO 52 Cb 0.53 -1.77 -0.12 0.00 -0.04 0.00 0.00 33.50 32.10 1v27 n PRO 52 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1v27 n ASP 53 N -2.10 0.75 -3.31 3.54 2.03 -0.71 -4.83 116.55 111.93 1v27 n ASP 53 Ca 0.04 0.65 -0.25 0.00 0.52 0.00 0.00 54.79 55.74 1v27 n ASP 53 Cb 0.31 -0.91 -0.08 0.00 -0.72 0.00 0.00 41.12 39.72 1v27 n ASP 53 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1v27 n ARG 54 N 7.57 0.80 0.00 -0.67 1.74 -1.26 -4.18 116.66 120.66 1v27 n ARG 54 Ca 0.55 -3.42 0.00 0.00 -0.77 0.00 0.00 57.85 54.21 1v27 n ARG 54 Cb -0.03 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 1v27 n ARG 54 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1v27 n SER 55 N 1.80 0.00 0.00 0.55 2.88 -1.26 -5.16 113.62 112.43 1v27 n SER 55 Ca 0.24 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 1v27 n SER 55 Cb 0.49 0.11 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1v27 n SER 55 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1v27 n ASP 56 N -1.68 0.00 0.00 -3.46 -0.08 -1.26 -4.99 116.55 105.08 1v27 n ASP 56 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1v27 n ASP 56 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1v27 n ASP 56 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1v27 n LYS 57 N 0.00 0.00 -1.34 -0.67 5.02 -1.26 -3.51 118.16 116.40 1v27 n LYS 57 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 1v27 n LYS 57 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.03 1v27 n LYS 57 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1v27 n ASN 58 N 2.70 6.95 -3.96 4.39 3.02 -1.26 -4.82 115.26 122.27 1v27 n ASN 58 Ca 0.00 -3.41 -0.30 0.00 -0.03 0.00 0.00 54.58 50.84 1v27 n ASN 58 Cb 0.00 -1.09 -0.16 0.00 -0.61 0.00 0.00 39.78 37.92 1v27 n ASN 58 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1v27 s LYS 59 N -2.64 1.79 0.09 3.52 2.20 -1.23 -1.83 119.74 121.64 1v27 s LYS 59 Ca 0.51 -0.90 0.08 0.00 -0.36 0.00 0.00 55.97 55.30 1v27 s LYS 59 Cb 0.38 -2.47 -0.03 0.00 -1.51 0.00 0.00 37.83 34.19 1v27 s LYS 59 CO -0.14 -0.51 -0.22 0.50 -0.36 0.00 0.00 175.35 174.62 1v27 s ARG 60 N 1.41 1.28 0.01 4.03 6.06 -1.14 -4.97 118.95 125.62 1v27 s ARG 60 Ca -0.03 -1.13 0.01 0.00 -2.50 0.00 0.00 55.73 52.07 1v27 s ARG 60 Cb -0.17 -1.54 -0.01 0.00 0.06 0.00 0.00 34.95 33.29 1v27 s ARG 60 CO -0.07 0.37 -0.03 0.50 -2.50 0.00 0.00 175.30 173.57 1v27 s ARG 61 N -1.70 0.22 0.58 5.12 3.52 -1.26 -0.57 118.95 124.85 1v27 s ARG 61 Ca 0.08 -0.20 -0.09 0.00 -0.13 0.00 0.00 55.73 55.38 1v27 s ARG 61 Cb -0.10 -0.13 -0.04 0.00 -1.56 0.00 0.00 34.95 33.12 1v27 s ARG 61 CO 0.04 0.03 0.97 0.95 -0.81 0.00 0.00 175.30 176.48 1v27 s THR 62 N -0.35 4.75 0.50 4.11 -4.23 -1.06 -5.01 115.64 114.35 1v27 s THR 62 Ca -0.02 0.70 -0.23 0.00 -1.18 0.00 0.00 61.69 60.95 1v27 s THR 62 Cb -0.03 -3.86 -0.07 0.00 1.34 0.00 0.00 72.50 69.88 1v27 s THR 62 CO -0.00 -1.07 1.35 2.29 -0.54 0.00 0.00 174.62 176.65 1v27 n LYS 63 N -2.62 1.87 -2.62 3.99 2.85 -1.26 -4.60 118.16 115.78 1v27 n LYS 63 Ca 0.05 0.68 -0.43 0.00 -1.05 0.00 0.00 58.31 57.55 1v27 n LYS 63 Cb 0.54 -2.54 -0.02 0.00 -0.65 0.00 0.00 35.03 32.36 1v27 n LYS 63 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1v27 s THR 64 N -1.25 4.20 0.39 0.58 2.01 -1.26 -4.73 115.64 115.57 1v27 s THR 64 Ca 0.67 1.11 -0.24 0.00 0.31 0.00 0.00 61.69 63.54 1v27 s THR 64 Cb -0.44 -4.61 -0.09 0.00 0.01 0.00 0.00 72.50 67.36 1v27 s THR 64 CO 0.53 -1.06 1.02 -0.69 -0.69 0.00 0.00 174.62 173.73 1v27 s VAL 65 N 4.48 3.89 -0.11 3.82 1.01 -0.91 -4.99 120.40 127.60 1v27 s VAL 65 Ca 0.46 1.43 0.01 0.00 0.00 0.00 0.00 61.98 63.88 1v27 s VAL 65 Cb -0.07 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 1v27 s VAL 65 CO 0.30 -0.01 -0.12 -0.54 0.00 0.00 0.00 175.10 174.73 1v27 s LYS 66 N -2.50 3.16 -0.06 2.72 -0.14 -1.26 -3.20 119.74 118.46 1v27 s LYS 66 Ca 0.57 -0.67 -0.00 0.00 -1.36 0.00 0.00 55.97 54.51 1v27 s LYS 66 Cb -0.20 -2.59 0.00 0.00 -1.68 0.00 0.00 37.83 33.37 1v27 s LYS 66 CO 0.25 0.34 0.01 1.63 -0.76 0.00 0.00 175.35 176.82 1v27 n LYS 67 N 3.16 -1.05 -3.15 1.68 5.02 0.16 -4.94 118.16 119.03 1v27 n LYS 67 Ca -0.18 1.25 0.05 0.00 -2.02 0.00 0.00 58.31 57.41 1v27 n LYS 67 Cb 0.53 -1.89 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 1v27 n LYS 67 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1v27 s THR 68 N -1.04 -0.04 -0.19 -0.18 -1.32 -1.03 -4.91 115.64 106.94 1v27 s THR 68 Ca -0.01 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.76 1v27 s THR 68 Cb 0.00 -1.00 0.35 0.00 -1.51 0.00 0.00 72.50 70.34 1v27 s THR 68 CO 0.17 0.00 1.82 -0.07 -2.21 0.00 0.00 174.62 174.33 1v27 h LEU 69 N 7.81 0.00 -6.99 9.08 4.07 -1.95 -3.37 115.31 123.96 1v27 h LEU 69 Ca -0.10 0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.25 1v27 h LEU 69 Cb 1.17 0.00 -0.40 0.00 1.08 0.00 0.00 40.66 42.51 1v27 h LEU 69 CO -0.19 0.00 -0.73 -1.61 -1.08 0.00 0.00 178.44 174.83 1v27 s GLU 70 N -3.45 1.34 0.48 1.13 2.02 -1.26 -3.93 118.70 115.04 1v27 s GLU 70 Ca 0.04 -2.07 -0.20 0.00 0.02 0.00 0.00 54.97 52.75 1v27 s GLU 70 Cb 0.08 -2.38 -0.09 0.00 0.10 0.00 0.00 34.13 31.84 1v27 s GLU 70 CO 0.57 -1.17 1.04 -1.25 0.02 0.00 0.00 175.26 174.47 1v27 s PRO 71 N 0.26 3.81 -0.35 0.39 0.04 -1.25 -4.82 135.00 133.08 1v27 s PRO 71 Ca 0.18 1.36 -0.00 0.00 0.04 0.00 0.00 61.00 62.58 1v27 s PRO 71 Cb -0.23 -2.11 0.12 0.00 0.04 0.00 0.00 34.50 32.33 1v27 s PRO 71 CO -0.01 -0.42 0.17 0.15 0.04 0.00 0.00 177.00 176.93 1v27 s LYS 72 N -3.21 0.73 -0.12 4.56 1.02 -1.26 -1.51 119.74 119.95 1v27 s LYS 72 Ca 0.67 -1.30 -0.09 0.00 0.02 0.00 0.00 55.97 55.26 1v27 s LYS 72 Cb -0.16 -1.74 -0.26 0.00 -0.52 0.00 0.00 37.83 35.14 1v27 s LYS 72 CO 0.20 -1.10 0.41 -1.49 -0.92 0.00 0.00 175.35 172.45 1v27 h TRP 73 N 7.47 0.47 -6.08 3.18 6.55 -0.06 -3.47 115.95 124.01 1v27 h TRP 73 Ca -0.06 -0.34 -0.37 0.00 0.95 0.00 0.00 58.89 59.07 1v27 h TRP 73 Cb 0.98 -0.02 -0.23 0.00 -0.86 0.00 0.00 29.16 29.03 1v27 h TRP 73 CO 0.40 1.73 -0.54 0.09 -1.05 0.00 0.00 178.44 179.07 1v27 n ASN 74 N -3.63 -1.41 -4.64 -3.49 3.02 0.41 -4.86 115.26 100.67 1v27 n ASN 74 Ca -0.30 -0.58 -0.26 0.00 -0.03 0.00 0.00 54.58 53.40 1v27 n ASN 74 Cb 1.01 -1.27 0.11 0.00 -0.61 0.00 0.00 39.78 39.02 1v27 n ASN 74 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1v27 s GLN 75 N -5.97 1.61 0.08 3.52 -1.52 -1.08 -4.83 119.66 111.48 1v27 s GLN 75 Ca 0.50 -0.50 0.09 0.00 -1.95 0.00 0.00 55.36 53.50 1v27 s GLN 75 Cb -0.29 -2.11 -0.03 0.00 -0.22 0.00 0.00 33.01 30.36 1v27 s GLN 75 CO 0.61 -1.64 -0.23 0.99 -0.25 0.00 0.00 175.29 174.77 1v27 s THR 76 N -3.42 1.87 -0.18 -0.19 2.01 -1.26 -2.13 115.64 112.34 1v27 s THR 76 Ca 0.66 -1.46 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 1v27 s THR 76 Cb -0.07 -1.65 0.09 0.00 0.01 0.00 0.00 72.50 70.87 1v27 s THR 76 CO 0.47 0.11 0.25 -0.36 -0.69 0.00 0.00 174.62 174.40 1v27 s PHE 77 N -0.98 -0.38 -0.12 4.92 0.08 -1.06 -4.96 117.98 115.47 1v27 s PHE 77 Ca 0.09 0.52 -0.06 0.00 0.12 0.00 0.00 56.93 57.60 1v27 s PHE 77 Cb -0.10 -0.22 -0.04 0.00 -0.57 0.00 0.00 43.02 42.10 1v27 s PHE 77 CO 0.04 -0.54 0.09 0.42 -0.10 0.00 0.00 175.22 175.13 1v27 s ILE 78 N 2.38 5.09 -0.09 0.64 1.01 -1.26 -1.57 121.20 127.40 1v27 s ILE 78 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.75 1v27 s ILE 78 Cb -0.14 -3.21 0.03 0.00 0.01 0.00 0.00 42.46 39.14 1v27 s ILE 78 CO -0.11 0.59 -0.04 -0.31 0.00 0.00 0.00 174.94 175.07 1v27 s TYR 79 N -0.74 1.04 0.07 3.97 2.02 -0.39 -4.93 117.35 118.39 1v27 s TYR 79 Ca 0.13 -0.43 -0.09 0.00 -0.37 0.00 0.00 57.07 56.31 1v27 s TYR 79 Cb -0.12 -0.99 0.00 0.00 -0.40 0.00 0.00 41.96 40.45 1v27 s TYR 79 CO 0.03 -0.41 0.20 -1.54 -1.57 0.00 0.00 175.55 172.26 1v27 s SER 80 N 1.82 0.07 0.25 2.29 1.04 -1.26 -0.14 113.70 117.77 1v27 s SER 80 Ca 0.04 -0.51 -0.30 0.00 0.48 0.00 0.00 55.95 55.67 1v27 s SER 80 Cb -0.12 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.22 1v27 s SER 80 CO -0.06 -0.65 1.09 -2.16 0.98 0.00 0.00 173.24 172.44 1v27 s PRO 81 N -3.26 4.64 -0.21 4.02 0.04 -1.26 -5.07 135.00 133.90 1v27 s PRO 81 Ca 0.00 1.76 -0.02 0.00 0.04 0.00 0.00 61.00 62.78 1v27 s PRO 81 Cb 0.02 -3.22 0.06 0.00 0.04 0.00 0.00 34.50 31.41 1v27 s PRO 81 CO -0.08 0.19 0.03 0.08 0.04 0.00 0.00 177.00 177.26 1v27 s VAL 82 N -0.89 0.68 0.40 -0.36 1.01 0.54 -5.00 120.40 116.77 1v27 s VAL 82 Ca 0.46 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.79 1v27 s VAL 82 Cb -0.31 -1.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1v27 s VAL 82 CO 0.39 -0.25 0.46 -1.00 0.00 0.00 0.00 175.10 174.70 1v27 s HIS 83 N 1.78 2.83 -0.77 5.22 3.76 -1.26 -4.14 115.29 122.72 1v27 s HIS 83 Ca -0.01 -0.39 0.26 0.00 -0.15 0.00 0.00 55.06 54.78 1v27 s HIS 83 Cb -0.17 -2.18 0.85 0.00 1.11 0.00 0.00 32.58 32.19 1v27 s HIS 83 CO -0.10 -0.19 1.78 -2.13 -0.85 0.00 0.00 174.74 173.26 1v27 n ARG 84 N -1.66 0.23 0.00 1.40 3.00 -1.26 -2.78 116.66 115.59 1v27 n ARG 84 Ca 0.04 0.18 0.12 0.00 -0.00 0.00 0.00 57.85 58.19 1v27 n ARG 84 Cb 0.60 -1.76 0.25 0.00 0.00 0.00 0.00 32.46 31.55 1v27 n ARG 84 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 1v27 n ARG 85 N -2.15 0.68 -0.01 -0.14 -4.01 -1.26 -3.98 116.66 105.80 1v27 n ARG 85 Ca 0.06 -0.46 -0.17 0.00 -1.04 0.00 0.00 57.85 56.24 1v27 n ARG 85 Cb 0.42 -1.49 -0.14 0.00 -3.04 0.00 0.00 32.46 28.21 1v27 n ARG 85 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 1v27 n GLU 86 N -0.76 0.72 -0.34 2.89 1.02 -1.12 -4.28 120.64 118.78 1v27 n GLU 86 Ca 0.10 0.27 0.02 0.00 -0.02 0.00 0.00 57.16 57.53 1v27 n GLU 86 Cb 0.37 -1.73 0.08 0.00 -0.02 0.00 0.00 31.44 30.14 1v27 n GLU 86 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1v27 n PHE 87 N -3.33 0.18 -0.32 -0.32 3.01 -1.22 0.11 117.46 115.58 1v27 n PHE 87 Ca -0.27 1.11 0.08 0.00 1.01 0.00 0.00 57.45 59.37 1v27 n PHE 87 Cb 1.05 -0.93 0.18 0.00 -0.01 0.00 0.00 39.48 39.77 1v27 n PHE 87 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1v27 h ARG 88 N 0.00 0.02 -0.69 -1.08 2.43 -1.80 1.37 114.38 114.63 1v27 h ARG 88 Ca 0.38 -0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.28 1v27 h ARG 88 Cb 0.60 -0.01 -0.16 0.00 -0.42 0.00 0.00 29.97 29.99 1v27 h ARG 88 CO -0.92 0.02 0.28 0.39 -1.51 0.00 0.00 179.97 178.23 1v27 n GLU 89 N -5.51 3.01 -3.50 0.20 1.02 0.31 -4.84 120.64 111.33 1v27 n GLU 89 Ca 0.17 -3.07 -0.10 0.00 -0.02 0.00 0.00 57.16 54.14 1v27 n GLU 89 Cb 0.55 -2.11 -0.09 0.00 -0.02 0.00 0.00 31.44 29.77 1v27 n GLU 89 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1v27 s ARG 90 N -3.09 0.31 0.10 3.49 3.00 0.47 -4.77 118.95 118.46 1v27 s ARG 90 Ca 0.53 0.74 0.08 0.00 0.00 0.00 0.00 55.73 57.07 1v27 s ARG 90 Cb 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 34.95 35.20 1v27 s ARG 90 CO 0.10 -0.46 -0.20 1.41 0.00 0.00 0.00 175.30 176.15 1v27 s MET 91 N 2.55 1.11 0.10 3.54 -2.45 -1.26 -3.65 119.30 119.24 1v27 s MET 91 Ca 0.06 -1.13 -0.07 0.00 -1.25 0.00 0.00 55.69 53.29 1v27 s MET 91 Cb -0.14 -1.35 -0.06 0.00 1.25 0.00 0.00 34.83 34.54 1v27 s MET 91 CO -0.14 0.31 0.38 -0.51 1.05 0.00 0.00 175.02 176.11 1v27 s LEU 92 N -1.86 4.32 -0.23 4.11 1.43 -0.53 -1.95 118.68 123.96 1v27 s LEU 92 Ca 0.06 0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 53.84 1v27 s LEU 92 Cb -0.10 -3.08 0.07 0.00 0.03 0.00 0.00 46.19 43.11 1v27 s LEU 92 CO 0.04 0.13 0.01 -0.70 0.23 0.00 0.00 176.35 176.06 1v27 s GLU 93 N -2.18 1.09 -0.10 1.70 2.12 -1.04 -2.32 118.70 117.96 1v27 s GLU 93 Ca 0.36 -0.79 -0.02 0.00 0.36 0.00 0.00 54.97 54.88 1v27 s GLU 93 Cb -0.13 -2.33 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 1v27 s GLU 93 CO 0.20 -0.68 -0.02 0.42 -0.54 0.00 0.00 175.26 174.64 1v27 s ILE 94 N 1.61 4.11 0.02 -3.70 1.09 0.77 -1.56 121.20 123.54 1v27 s ILE 94 Ca -0.01 -0.31 0.01 0.00 -1.10 0.00 0.00 60.65 59.23 1v27 s ILE 94 Cb -0.18 -2.74 -0.01 0.00 -1.06 0.00 0.00 42.46 38.47 1v27 s ILE 94 CO -0.10 0.58 -0.04 0.42 -0.10 0.00 0.00 174.94 175.71 1v27 s THR 95 N -0.61 0.22 -0.07 2.92 -4.23 -1.08 0.19 115.64 112.98 1v27 s THR 95 Ca 0.10 -0.63 0.04 0.00 -1.18 0.00 0.00 61.69 60.02 1v27 s THR 95 Cb -0.12 -0.29 -0.01 0.00 1.34 0.00 0.00 72.50 73.42 1v27 s THR 95 CO 0.02 -0.26 -0.21 -0.22 -0.54 0.00 0.00 174.62 173.41 1v27 s LEU 96 N -0.94 2.30 0.11 4.79 2.96 -0.83 -2.03 118.68 125.04 1v27 s LEU 96 Ca -0.08 -0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1v27 s LEU 96 Cb -0.06 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 1v27 s LEU 96 CO -0.00 0.24 0.02 0.26 -1.32 0.00 0.00 176.35 175.54 1v27 s TRP 97 N -0.12 0.81 -0.28 5.38 0.52 -1.14 -0.88 118.94 123.23 1v27 s TRP 97 Ca -0.04 -1.15 0.03 0.00 0.02 0.00 0.00 56.10 54.97 1v27 s TRP 97 Cb -0.14 -0.48 0.07 0.00 -1.15 0.00 0.00 33.47 31.77 1v27 s TRP 97 CO 0.04 -0.42 -0.07 0.34 0.02 0.00 0.00 176.95 176.86 1v27 s ASP 98 N -3.03 4.50 -1.09 2.95 2.15 -1.26 -1.67 116.67 119.22 1v27 s ASP 98 Ca 0.19 -1.57 -0.26 0.00 0.43 0.00 0.00 52.55 51.34 1v27 s ASP 98 Cb 0.07 -1.55 -0.18 0.00 -0.30 0.00 0.00 42.92 40.96 1v27 s ASP 98 CO -0.02 -0.24 2.08 -1.58 -0.17 0.00 0.00 175.17 175.25 1v27 s GLN 99 N 1.07 1.57 1.14 4.34 -0.44 0.59 -3.96 119.66 123.97 1v27 s GLN 99 Ca -0.04 -0.57 -0.19 0.00 -2.50 0.00 0.00 55.36 52.06 1v27 s GLN 99 Cb -0.20 -5.04 0.27 0.00 -1.64 0.00 0.00 33.01 26.41 1v27 s GLN 99 CO -0.06 -5.01 1.22 0.00 0.50 0.00 0.00 175.29 171.94 1v27 s ALA 100 N 15.21 1.26 0.47 1.58 0.00 -1.21 -4.29 121.76 134.78 1v27 s ALA 100 Ca 0.78 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1v27 s ALA 100 Cb -0.04 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.29 1v27 s ALA 100 CO 0.16 -3.24 0.00 0.54 0.00 0.00 0.00 175.76 173.21 1v27 n ARG 101 N -4.44 -4.93 -0.03 0.00 5.12 -1.26 -4.43 116.66 106.70 1v27 n ARG 101 Ca 0.16 3.62 -0.10 0.00 -1.93 0.00 0.00 57.85 59.60 1v27 n ARG 101 Cb 0.60 -4.04 -0.04 0.00 -1.16 0.00 0.00 32.46 27.82 1v27 n ARG 101 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 1v27 h VAL 102 N 2.28 0.24 -2.44 1.55 3.04 -2.02 -3.36 116.25 115.53 1v27 h VAL 102 Ca 0.00 0.00 -0.54 0.00 -1.01 0.00 0.00 66.70 65.15 1v27 h VAL 102 Cb 0.00 0.24 -0.37 0.00 -2.01 0.00 0.00 31.29 29.14 1v27 h VAL 102 CO 0.00 0.00 -0.84 -0.13 -1.01 0.00 0.00 177.57 175.59 1v27 s ARG 103 N -5.97 0.60 0.00 4.17 0.52 -1.26 -5.10 118.95 111.91 1v27 s ARG 103 Ca -0.15 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 53.73 1v27 s ARG 103 Cb 0.11 -1.20 0.00 0.00 0.52 0.00 0.00 34.95 34.37 1v27 s ARG 103 CO 0.66 -1.23 0.00 -1.91 0.02 0.00 0.00 175.30 172.84 1v27 n GLU 104 N 3.94 0.00 -2.65 3.54 2.13 -1.26 -5.08 120.64 121.27 1v27 n GLU 104 Ca 0.14 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.53 1v27 n GLU 104 Cb 0.40 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.09 1v27 n GLU 104 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1v27 s GLU 105 N -1.75 3.79 -0.55 5.31 2.12 -1.26 -4.66 118.70 121.70 1v27 s GLU 105 Ca 0.00 -1.66 0.06 0.00 0.36 0.00 0.00 54.97 53.73 1v27 s GLU 105 Cb 0.00 -5.34 0.22 0.00 0.26 0.00 0.00 34.13 29.27 1v27 s GLU 105 CO 0.00 -2.13 0.57 0.39 -0.54 0.00 0.00 175.26 173.55 1v27 n GLU 106 N 8.12 1.55 -2.70 4.30 1.02 -1.26 -5.09 120.64 126.58 1v27 n GLU 106 Ca 0.38 -4.03 -0.41 0.00 -0.02 0.00 0.00 57.16 53.09 1v27 n GLU 106 Cb 0.48 -1.90 -0.05 0.00 -0.02 0.00 0.00 31.44 29.96 1v27 n GLU 106 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1v27 s SER 107 N -1.54 7.50 0.00 1.62 0.01 -1.26 -3.32 113.70 116.70 1v27 s SER 107 Ca 0.34 1.88 0.21 0.00 1.31 0.00 0.00 55.95 59.70 1v27 s SER 107 Cb 0.10 -2.60 0.60 0.00 0.21 0.00 0.00 66.02 64.34 1v27 s SER 107 CO -0.10 -0.04 1.50 -1.84 0.41 0.00 0.00 173.24 173.18 1v27 n GLU 108 N 2.39 2.73 -3.04 12.44 0.28 -1.25 -4.97 120.64 129.22 1v27 n GLU 108 Ca 0.01 -2.59 0.00 0.00 -0.16 0.00 0.00 57.16 54.42 1v27 n GLU 108 Cb 0.48 -1.54 0.00 0.00 1.43 0.00 0.00 31.44 31.81 1v27 n GLU 108 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1v27 n PHE 109 N 1.53 0.00 0.28 -1.84 7.35 -1.26 -4.78 117.46 118.74 1v27 n PHE 109 Ca 0.23 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 57.09 1v27 n PHE 109 Cb 0.60 -0.96 0.73 0.00 0.35 0.00 0.00 39.48 40.20 1v27 n PHE 109 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1v27 h LEU 110 N 4.01 0.00 0.00 -2.13 3.38 -1.34 -3.48 115.31 115.75 1v27 h LEU 110 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1v27 h LEU 110 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1v27 h LEU 110 CO 0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1v27 n GLY 111 N -0.11 -0.28 3.01 0.83 0.00 -1.07 -4.47 105.19 103.10 1v27 n GLY 111 Ca 0.00 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 1v27 n GLY 111 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1v27 s GLU 112 N -1.87 0.16 -0.25 1.61 -1.05 -1.23 -1.96 118.70 114.11 1v27 s GLU 112 Ca 0.00 0.34 -0.01 0.00 -0.15 0.00 0.00 54.97 55.15 1v27 s GLU 112 Cb 0.00 -0.04 0.03 0.00 -0.44 0.00 0.00 34.13 33.68 1v27 s GLU 112 CO 0.00 -0.10 -0.08 0.42 0.95 0.00 0.00 175.26 176.45 1v27 s ILE 113 N 0.68 2.71 -0.12 1.83 1.01 0.50 -3.79 121.20 124.03 1v27 s ILE 113 Ca -0.05 -1.11 -0.04 0.00 0.00 0.00 0.00 60.65 59.45 1v27 s ILE 113 Cb -0.06 -2.39 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1v27 s ILE 113 CO -0.04 0.19 0.02 -0.76 0.00 0.00 0.00 174.94 174.36 1v27 s LEU 114 N 1.29 3.66 -0.04 2.97 2.01 -1.26 -0.16 118.68 127.14 1v27 s LEU 114 Ca -0.01 0.12 -0.00 0.00 0.01 0.00 0.00 54.13 54.25 1v27 s LEU 114 Cb -0.17 -1.87 0.03 0.00 0.01 0.00 0.00 46.19 44.19 1v27 s LEU 114 CO -0.05 0.30 0.01 -0.63 1.01 0.00 0.00 176.35 176.99 1v27 s ILE 115 N -0.41 0.20 -0.24 -0.59 1.01 -0.98 -5.00 121.20 115.19 1v27 s ILE 115 Ca 0.08 0.14 -0.21 0.00 0.00 0.00 0.00 60.65 60.66 1v27 s ILE 115 Cb -0.12 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 1v27 s ILE 115 CO 0.02 0.19 0.67 -1.61 0.00 0.00 0.00 174.94 174.21 1v27 s GLU 116 N 1.47 4.15 0.54 2.79 2.02 -1.26 -1.46 118.70 126.94 1v27 s GLU 116 Ca -0.03 0.64 0.24 0.00 0.02 0.00 0.00 54.97 55.84 1v27 s GLU 116 Cb -0.13 -3.63 1.42 0.00 0.10 0.00 0.00 34.13 31.89 1v27 s GLU 116 CO -0.03 -0.40 2.04 -0.07 0.02 0.00 0.00 175.26 176.82 1v27 h LEU 117 N 8.83 0.00 -0.00 1.80 3.38 -1.79 1.19 115.31 128.72 1v27 h LEU 117 Ca -0.27 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.73 1v27 h LEU 117 Cb 1.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 1v27 h LEU 117 CO 0.79 0.00 -0.16 -0.08 0.09 0.00 0.00 178.44 179.08 1v27 h GLU 118 N 0.00 -0.26 -0.30 1.13 4.81 -1.78 -2.83 114.58 115.35 1v27 h GLU 118 Ca 0.18 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.30 1v27 h GLU 118 Cb 0.76 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.12 1v27 h GLU 118 CO -0.00 -0.17 -0.06 0.25 -0.73 0.00 0.00 179.01 178.30 1v27 n THR 119 N -5.30 2.45 -2.37 0.32 -2.24 -0.46 -4.96 114.28 101.72 1v27 n THR 119 Ca -0.05 -2.51 -0.40 0.00 -2.27 0.00 0.00 64.05 58.82 1v27 n THR 119 Cb 0.21 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1v27 n THR 119 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v27 s ALA 120 N -3.12 3.37 -0.97 6.98 0.00 0.40 -4.87 121.76 123.55 1v27 s ALA 120 Ca 0.43 0.98 -0.21 0.00 0.00 0.00 0.00 51.96 53.16 1v27 s ALA 120 Cb 0.38 -3.36 0.08 0.00 0.00 0.00 0.00 23.12 20.22 1v27 s ALA 120 CO 0.02 -0.32 1.31 -0.51 0.00 0.00 0.00 175.76 176.26 1v27 s LEU 121 N -1.74 4.12 -0.48 0.00 1.43 -1.26 -4.95 118.68 115.80 1v27 s LEU 121 Ca 0.48 -1.66 -0.13 0.00 -1.03 0.00 0.00 54.13 51.79 1v27 s LEU 121 Cb -0.33 -2.50 0.09 0.00 0.03 0.00 0.00 46.19 43.49 1v27 s LEU 121 CO 0.43 -1.34 0.38 -0.76 0.23 0.00 0.00 176.35 175.29 1v27 s LEU 122 N 4.07 5.67 -0.05 1.79 1.43 -1.26 -4.48 118.68 125.85 1v27 s LEU 122 Ca 0.40 -1.57 0.02 0.00 -1.03 0.00 0.00 54.13 51.95 1v27 s LEU 122 Cb -0.02 -2.12 0.06 0.00 0.03 0.00 0.00 46.19 44.14 1v27 s LEU 122 CO -0.09 -0.68 1.00 -0.67 0.23 0.00 0.00 176.35 176.14 1v27 n ASP 123 N 5.11 -0.98 -2.18 2.29 -0.08 -1.19 -4.79 116.55 114.73 1v27 n ASP 123 Ca -0.12 -1.87 -0.08 0.00 -1.51 0.00 0.00 54.79 51.22 1v27 n ASP 123 Cb 0.42 0.33 -0.01 0.00 2.34 0.00 0.00 41.12 44.20 1v27 n ASP 123 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1v27 n ASP 124 N -0.23 -2.64 -4.48 1.67 2.03 -1.09 -4.89 116.55 106.93 1v27 n ASP 124 Ca -0.24 0.28 -0.36 0.00 0.52 0.00 0.00 54.79 54.99 1v27 n ASP 124 Cb 0.69 -2.37 -0.12 0.00 -0.72 0.00 0.00 41.12 38.59 1v27 n ASP 124 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1v27 s GLU 125 N -4.47 3.70 -0.05 -0.67 2.02 -1.26 -4.99 118.70 112.98 1v27 s GLU 125 Ca 0.00 -0.46 -0.30 0.00 0.02 0.00 0.00 54.97 54.23 1v27 s GLU 125 Cb 0.00 -3.30 -0.03 0.00 0.10 0.00 0.00 34.13 30.90 1v27 s GLU 125 CO 0.00 -0.11 1.22 -1.25 0.02 0.00 0.00 175.26 175.14 1v27 s PRO 126 N 1.40 4.35 0.45 0.39 0.04 -1.26 -4.60 135.00 135.77 1v27 s PRO 126 Ca 0.05 1.70 0.05 0.00 0.04 0.00 0.00 61.00 62.84 1v27 s PRO 126 Cb -0.15 -3.56 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 1v27 s PRO 126 CO 0.04 -0.46 0.03 -1.01 0.04 0.00 0.00 177.00 175.63 1v27 s HIS 127 N 2.23 2.24 -0.27 0.56 3.76 -1.25 -5.02 115.29 117.54 1v27 s HIS 127 Ca 0.57 -0.78 0.03 0.00 -0.15 0.00 0.00 55.06 54.72 1v27 s HIS 127 Cb -0.25 -1.73 0.07 0.00 1.11 0.00 0.00 32.58 31.78 1v27 s HIS 127 CO 0.22 0.32 -0.05 -1.58 -0.85 0.00 0.00 174.74 172.80 1v27 s TRP 128 N -2.77 3.15 -0.34 1.40 0.52 -1.26 -3.38 118.94 116.26 1v27 s TRP 128 Ca 0.24 -2.35 -0.13 0.00 0.02 0.00 0.00 56.10 53.88 1v27 s TRP 128 Cb 0.06 -2.08 -0.02 0.00 -1.15 0.00 0.00 33.47 30.28 1v27 s TRP 128 CO 0.12 -0.87 0.23 0.71 0.02 0.00 0.00 176.95 177.16 1v27 s TYR 129 N 1.13 3.23 0.78 -1.98 2.02 0.35 -4.88 117.35 118.00 1v27 s TYR 129 Ca -0.03 -0.23 -0.13 0.00 -0.37 0.00 0.00 57.07 56.31 1v27 s TYR 129 Cb -0.19 -2.46 0.07 0.00 -0.40 0.00 0.00 41.96 38.97 1v27 s TYR 129 CO -0.07 -0.36 1.16 0.15 -1.57 0.00 0.00 175.55 174.87 1v27 s LYS 130 N 1.72 1.90 0.42 -0.62 1.02 -1.26 -1.01 119.74 121.90 1v27 s LYS 130 Ca 0.06 1.58 -0.01 0.00 0.02 0.00 0.00 55.97 57.62 1v27 s LYS 130 Cb -0.17 -1.82 -0.02 0.00 -0.52 0.00 0.00 37.83 35.29 1v27 s LYS 130 CO 0.10 -1.98 0.65 -0.51 -0.92 0.00 0.00 175.35 172.69 1v27 s LEU 131 N -5.65 3.79 -0.17 3.17 2.01 0.60 -4.84 118.68 117.58 1v27 s LEU 131 Ca 0.70 0.52 -0.00 0.00 0.01 0.00 0.00 54.13 55.35 1v27 s LEU 131 Cb -0.25 -3.41 0.04 0.00 0.01 0.00 0.00 46.19 42.59 1v27 s LEU 131 CO 0.50 -0.51 -0.06 0.00 1.01 0.00 0.00 176.35 177.29 1v27 s GLN 132 N -4.51 1.53 -0.02 1.70 -2.07 -1.25 -4.40 119.66 110.64 1v27 s GLN 132 Ca 0.45 -0.58 -0.08 0.00 -1.82 0.00 0.00 55.36 53.33 1v27 s GLN 132 Cb -0.10 -2.09 -0.03 0.00 -1.09 0.00 0.00 33.01 29.71 1v27 s GLN 132 CO 0.39 -0.44 -0.15 0.25 -1.32 0.00 0.00 175.29 174.02 1v27 n THR 133 N 4.84 1.35 -2.51 3.63 -2.24 -1.26 -3.48 114.28 114.61 1v27 n THR 133 Ca -0.12 0.29 -0.35 0.00 -2.27 0.00 0.00 64.05 61.60 1v27 n THR 133 Cb 0.47 -1.92 -0.03 0.00 -2.10 0.00 0.00 70.33 66.75 1v27 n THR 133 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1v27 s HIS 134 N -2.39 3.04 -0.05 4.78 5.65 -1.26 -4.59 115.29 120.46 1v27 s HIS 134 Ca -0.13 1.59 -0.04 0.00 0.25 0.00 0.00 55.06 56.73 1v27 s HIS 134 Cb 0.02 -3.11 0.02 0.00 -1.18 0.00 0.00 32.58 28.32 1v27 s HIS 134 CO 0.19 -0.86 0.09 -3.47 -0.65 0.00 0.00 174.74 170.03 1v27 n ASP 135 N -0.74 -5.99 -4.84 9.88 2.03 -1.26 -4.96 116.55 110.67 1v27 n ASP 135 Ca 0.08 1.65 -0.31 0.00 0.52 0.00 0.00 54.79 56.73 1v27 n ASP 135 Cb 0.51 -5.02 0.03 0.00 -0.72 0.00 0.00 41.12 35.92 1v27 n ASP 135 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1v27 s SER 136 N -0.59 5.75 0.39 1.67 0.01 -1.26 -5.07 113.70 114.61 1v27 s SER 136 Ca -0.10 1.55 0.08 0.00 1.31 0.00 0.00 55.95 58.78 1v27 s SER 136 Cb 0.01 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 1v27 s SER 136 CO 0.27 -1.19 0.25 -0.83 0.41 0.00 0.00 173.24 172.15 1v27 s GLY 137 N -3.90 2.14 1.06 3.44 0.00 -1.26 -5.13 107.32 103.67 1v27 s GLY 137 Ca 0.57 -1.93 -0.17 0.00 0.00 0.00 0.00 44.72 43.19 1v27 s GLY 137 CO 0.54 -1.77 1.21 2.56 0.00 0.00 0.00 173.10 175.63 1v27 s PRO 138 N -3.98 -0.14 0.19 2.90 0.04 -1.26 -5.04 135.00 127.71 1v27 s PRO 138 Ca 0.43 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.28 1v27 s PRO 138 Cb -0.01 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.80 1v27 s PRO 138 CO 0.25 -2.97 0.00 0.43 0.04 0.00 0.00 177.00 174.75 1v27 n SER 139 N -4.21 0.25 -4.88 6.66 7.64 -1.26 -5.10 113.62 112.73 1v27 n SER 139 Ca 0.13 0.32 -0.30 0.00 1.01 0.00 0.00 58.87 60.04 1v27 n SER 139 Cb 0.59 0.12 -0.03 0.00 -1.01 0.00 0.00 64.21 63.89 1v27 n SER 139 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v27 s SER 140 N -5.32 6.48 0.00 6.43 0.01 -1.26 -5.23 113.70 114.81 1v27 s SER 140 Ca 0.00 1.07 0.00 0.00 1.31 0.00 0.00 55.95 58.33 1v27 s SER 140 Cb 0.00 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1v27 s SER 140 CO 0.00 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.86