#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 0.00 -1.38 1.61 2.88 -1.26 -5.16 113.62 110.31 1v27 n SER 2 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1v27 n SER 2 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1v27 n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1v27 n SER 3 N 0.00 -7.60 0.00 -3.46 3.41 -1.26 -5.07 113.62 99.64 1v27 n SER 3 Ca 0.00 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.76 1v27 n SER 3 Cb 0.00 -4.60 0.00 0.00 -0.26 0.00 0.00 64.21 59.35 1v27 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v27 n GLY 4 N -4.19 3.98 2.72 5.00 0.00 -1.26 -4.94 105.19 106.49 1v27 n GLY 4 Ca -0.06 -1.34 -0.03 0.00 0.00 0.00 0.00 46.02 44.58 1v27 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v27 s SER 5 N 0.00 -0.72 -0.16 1.61 0.01 -1.26 -4.97 113.70 108.20 1v27 s SER 5 Ca 0.00 -0.83 -0.29 0.00 1.31 0.00 0.00 55.95 56.14 1v27 s SER 5 Cb 0.00 0.94 0.12 0.00 0.21 0.00 0.00 66.02 67.29 1v27 s SER 5 CO 0.00 -0.03 0.94 -0.44 0.41 0.00 0.00 173.24 174.13 1v27 s SER 6 N 1.00 -0.44 -0.08 2.44 0.01 -1.26 -5.13 113.70 110.24 1v27 s SER 6 Ca 0.25 0.54 -0.30 0.00 1.31 0.00 0.00 55.95 57.76 1v27 s SER 6 Cb 0.08 0.45 0.11 0.00 0.21 0.00 0.00 66.02 66.86 1v27 s SER 6 CO -0.09 -0.36 0.89 -0.83 0.41 0.00 0.00 173.24 173.27 1v27 s GLY 7 N -0.90 -0.39 0.00 3.44 0.00 -1.26 -4.58 107.32 103.63 1v27 s GLY 7 Ca -0.03 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.24 1v27 s GLY 7 CO 0.02 0.78 0.00 0.61 0.00 0.00 0.00 173.10 174.51 1v27 n GLY 8 N 0.43 2.01 3.05 0.20 0.00 -1.26 -4.80 105.19 104.82 1v27 n GLY 8 Ca -0.12 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 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 4.15 0.95 0.00 1.61 -0.21 -0.85 -3.13 119.66 122.17 1v27 s GLN 9 Ca 0.00 -0.39 0.07 0.00 0.02 0.00 0.00 55.36 55.06 1v27 s GLN 9 Cb 0.00 -0.90 -0.02 0.00 1.00 0.00 0.00 33.01 33.09 1v27 s GLN 9 CO 0.00 0.22 -0.23 -1.17 -2.12 0.00 0.00 175.29 171.99 1v27 s LEU 10 N -0.17 2.08 -0.27 2.90 0.20 -0.41 -1.51 118.68 121.50 1v27 s LEU 10 Ca 0.03 -0.45 -0.05 0.00 0.69 0.00 0.00 54.13 54.34 1v27 s LEU 10 Cb -0.05 -1.16 0.01 0.00 -0.43 0.00 0.00 46.19 44.56 1v27 s LEU 10 CO -0.00 0.26 0.03 -0.94 -0.29 0.00 0.00 176.35 175.41 1v27 s SER 11 N -0.73 4.82 -0.08 3.68 1.04 -0.98 0.52 113.70 121.97 1v27 s SER 11 Ca 0.09 -0.69 0.02 0.00 0.48 0.00 0.00 55.95 55.85 1v27 s SER 11 Cb -0.09 -1.81 0.01 0.00 0.10 0.00 0.00 66.02 64.23 1v27 s SER 11 CO -0.00 -0.15 -0.15 -0.63 0.98 0.00 0.00 173.24 173.30 1v27 s ILE 12 N 1.45 1.35 -0.24 -1.02 1.01 -1.15 -2.20 121.20 120.40 1v27 s ILE 12 Ca 0.02 -0.59 -0.08 0.00 0.00 0.00 0.00 60.65 60.00 1v27 s ILE 12 Cb -0.17 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 1v27 s ILE 12 CO 0.00 0.40 0.09 -0.75 0.00 0.00 0.00 174.94 174.69 1v27 s LYS 13 N 0.69 3.78 0.16 2.79 2.20 0.31 -3.92 119.74 125.76 1v27 s LYS 13 Ca -0.14 -0.42 0.09 0.00 -0.36 0.00 0.00 55.97 55.14 1v27 s LYS 13 Cb -0.16 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.74 1v27 s LYS 13 CO 0.04 -0.10 -0.10 -0.51 -0.36 0.00 0.00 175.35 174.32 1v27 s LEU 14 N 1.40 2.96 -0.03 5.43 1.43 -1.26 0.11 118.68 128.72 1v27 s LEU 14 Ca 0.06 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.33 1v27 s LEU 14 Cb -0.15 -1.67 0.06 0.00 0.03 0.00 0.00 46.19 44.46 1v27 s LEU 14 CO 0.05 0.12 0.61 0.86 0.23 0.00 0.00 176.35 178.22 1v27 s TRP 15 N -1.57 -0.57 -0.14 0.29 -0.11 0.42 -2.37 118.94 114.89 1v27 s TRP 15 Ca 0.24 0.92 0.00 0.00 1.22 0.00 0.00 56.10 58.48 1v27 s TRP 15 Cb -0.09 0.37 -0.01 0.00 -1.50 0.00 0.00 33.47 32.24 1v27 s TRP 15 CO 0.14 -0.59 -0.15 0.12 -4.62 0.00 0.00 176.95 171.85 1v27 s PHE 16 N -1.44 2.78 -0.99 5.86 5.36 -1.26 0.19 117.98 128.48 1v27 s PHE 16 Ca -0.10 -0.86 -0.07 0.00 -0.96 0.00 0.00 56.93 54.94 1v27 s PHE 16 Cb -0.01 -1.86 0.25 0.00 -0.34 0.00 0.00 43.02 41.06 1v27 s PHE 16 CO 0.07 -0.35 0.94 -0.51 -1.46 0.00 0.00 175.22 173.90 1v27 s ASP 17 N 0.58 6.71 0.56 6.13 1.11 0.23 -4.84 116.67 127.15 1v27 s ASP 17 Ca -0.09 -3.55 0.35 0.00 0.18 0.00 0.00 52.55 49.44 1v27 s ASP 17 Cb -0.16 -2.08 1.91 0.00 1.07 0.00 0.00 42.92 43.66 1v27 s ASP 17 CO 0.03 -0.27 2.07 0.07 1.18 0.00 0.00 175.17 178.25 1v27 h LYS 18 N 6.52 0.00 0.00 8.23 -0.00 -1.92 0.81 116.57 130.22 1v27 h LYS 18 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.81 1v27 h LYS 18 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.10 1v27 h LYS 18 CO 0.92 0.00 0.00 0.28 -0.00 0.00 0.00 179.45 180.65 1v27 n VAL 19 N -2.78 0.00 0.04 0.07 0.31 -1.26 -3.36 118.33 111.35 1v27 n VAL 19 Ca -0.02 1.37 0.11 0.00 -0.01 0.00 0.00 64.34 65.79 1v27 n VAL 19 Cb 0.12 -2.26 0.28 0.00 -0.91 0.00 0.00 33.84 31.06 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 -0.90 1.92 3.20 2.92 0.00 -1.10 -4.96 105.19 106.28 1v27 n GLY 20 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 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 1.37 -2.62 -4.31 1.61 -0.00 0.27 -4.71 115.22 106.83 1v27 n HIS 21 Ca 0.21 0.94 -0.18 0.00 -0.00 0.00 0.00 57.72 58.69 1v27 n HIS 21 Cb 0.55 -4.10 -0.14 0.00 -0.00 0.00 0.00 29.99 26.30 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 -3.98 0.75 -0.31 -0.41 -0.21 -0.25 0.20 119.66 115.46 1v27 s GLN 22 Ca 0.31 -0.52 -0.15 0.00 0.02 0.00 0.00 55.36 55.02 1v27 s GLN 22 Cb -0.04 -0.70 -0.02 0.00 1.00 0.00 0.00 33.01 33.24 1v27 s GLN 22 CO 0.75 0.18 0.38 -1.17 -2.12 0.00 0.00 175.29 173.31 1v27 s LEU 23 N -0.71 4.22 -0.20 2.90 2.96 0.26 0.76 118.68 128.87 1v27 s LEU 23 Ca 0.01 0.05 -0.17 0.00 -0.22 0.00 0.00 54.13 53.79 1v27 s LEU 23 Cb -0.06 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 1v27 s LEU 23 CO 0.00 -0.28 0.46 -0.63 -1.32 0.00 0.00 176.35 174.58 1v27 s ILE 24 N 2.09 5.15 -0.21 6.68 1.09 0.51 0.06 121.20 136.56 1v27 s ILE 24 Ca 0.14 0.83 -0.03 0.00 -1.10 0.00 0.00 60.65 60.49 1v27 s ILE 24 Cb -0.16 -3.78 0.07 0.00 -1.06 0.00 0.00 42.46 37.52 1v27 s ILE 24 CO 0.11 0.22 0.07 0.54 -0.10 0.00 0.00 174.94 175.77 1v27 s VAL 25 N 1.47 0.32 -0.23 2.92 0.11 0.63 0.16 120.40 125.77 1v27 s VAL 25 Ca 0.22 -0.56 -0.07 0.00 -2.93 0.00 0.00 61.98 58.63 1v27 s VAL 25 Cb -0.15 -0.96 -0.03 0.00 -1.53 0.00 0.00 36.38 33.70 1v27 s VAL 25 CO 0.09 -0.34 0.07 -0.89 -3.33 0.00 0.00 175.10 170.71 1v27 s THR 26 N 1.94 4.49 -0.77 5.04 2.01 0.30 -1.17 115.64 127.48 1v27 s THR 26 Ca 0.02 -0.12 -0.22 0.00 0.31 0.00 0.00 61.69 61.68 1v27 s THR 26 Cb -0.17 -3.08 0.08 0.00 0.01 0.00 0.00 72.50 69.34 1v27 s THR 26 CO -0.13 0.37 1.10 -0.63 -0.69 0.00 0.00 174.62 174.63 1v27 s ILE 27 N 1.28 4.28 0.00 1.82 -1.09 -0.84 -0.53 121.20 126.13 1v27 s ILE 27 Ca 0.05 -0.57 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 1v27 s ILE 27 Cb -0.15 -4.78 0.00 0.00 -1.58 0.00 0.00 42.46 35.95 1v27 s ILE 27 CO 0.04 -1.58 0.00 0.18 -1.23 0.00 0.00 174.94 172.35 1v27 n LEU 28 N 7.81 0.00 -3.47 2.97 4.77 -0.93 0.15 117.00 128.29 1v27 n LEU 28 Ca 0.07 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.94 1v27 n LEU 28 Cb 0.47 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 1v27 n LEU 28 CO 0.62 0.00 0.45 -0.83 -1.33 0.00 0.00 177.39 176.30 1v27 s GLY 29 N 0.00 -0.55 0.26 -0.72 0.00 -1.22 0.85 107.32 105.94 1v27 s GLY 29 Ca 0.00 0.48 0.04 0.00 0.00 0.00 0.00 44.72 45.24 1v27 s GLY 29 CO 0.00 0.16 0.40 0.00 0.00 0.00 0.00 173.10 173.66 1v27 s ALA 30 N -3.68 3.88 0.19 3.20 0.00 -0.40 -2.33 121.76 122.62 1v27 s ALA 30 Ca 0.03 -1.14 -0.17 0.00 0.00 0.00 0.00 51.96 50.68 1v27 s ALA 30 Cb -0.01 -1.83 0.03 0.00 0.00 0.00 0.00 23.12 21.31 1v27 s ALA 30 CO -0.10 0.20 0.51 -1.59 0.00 0.00 0.00 175.76 174.78 1v27 s LYS 31 N -4.00 1.36 -1.86 0.00 0.00 -0.57 -3.26 119.74 111.41 1v27 s LYS 31 Ca 0.35 -0.87 0.00 0.00 0.00 0.00 0.00 55.97 55.46 1v27 s LYS 31 Cb -0.09 0.51 0.00 0.00 0.00 0.00 0.00 37.83 38.25 1v27 s LYS 31 CO 0.31 -0.57 0.00 -0.25 0.00 0.00 0.00 175.35 174.83 1v27 n ASP 32 N -0.33 -5.73 -4.61 0.03 8.00 -1.26 -2.01 116.55 110.63 1v27 n ASP 32 Ca -0.10 0.12 -0.32 0.00 0.71 0.00 0.00 54.79 55.20 1v27 n ASP 32 Cb 0.63 -4.84 0.14 0.00 -0.02 0.00 0.00 41.12 37.02 1v27 n ASP 32 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1v27 n LEU 33 N -2.84 2.71 0.16 0.64 4.32 -1.26 -4.24 117.00 116.49 1v27 n LEU 33 Ca -0.23 0.46 0.03 0.00 -0.02 0.00 0.00 56.01 56.25 1v27 n LEU 33 Cb 0.68 -1.41 0.21 0.00 -1.62 0.00 0.00 43.42 41.28 1v27 n LEU 33 CO 0.29 -2.41 0.57 1.55 -1.22 0.00 0.00 177.39 176.17 1v27 h PRO 34 N -1.46 0.00 0.00 3.23 0.13 -1.91 -3.47 132.00 128.51 1v27 h PRO 34 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1v27 h PRO 34 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1v27 h PRO 34 CO 0.41 0.47 0.00 0.45 -0.23 0.00 0.00 178.00 179.10 1v27 n SER 35 N -3.44 0.00 -1.56 1.44 2.88 -1.26 -4.93 113.62 106.75 1v27 n SER 35 Ca 0.00 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.57 1v27 n SER 35 Cb 0.61 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.05 1v27 n SER 35 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1v27 n ARG 36 N 0.00 -3.91 0.00 -1.46 1.74 -1.26 -5.05 116.66 106.72 1v27 n ARG 36 Ca 0.00 3.06 0.00 0.00 -0.77 0.00 0.00 57.85 60.14 1v27 n ARG 36 Cb 0.00 -3.94 0.00 0.00 -1.02 0.00 0.00 32.46 27.50 1v27 n ARG 36 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1v27 n GLU 37 N -2.93 0.00 -0.60 5.56 2.13 -1.26 -4.94 120.64 118.59 1v27 n GLU 37 Ca -0.02 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.85 1v27 n GLU 37 Cb 0.51 0.00 0.08 0.00 0.27 0.00 0.00 31.44 32.30 1v27 n GLU 37 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1v27 n ASP 38 N 0.00 1.19 0.00 4.31 8.00 -1.26 -4.98 116.55 123.81 1v27 n ASP 38 Ca 0.00 -2.66 0.00 0.00 0.71 0.00 0.00 54.79 52.84 1v27 n ASP 38 Cb 0.00 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1v27 n ASP 38 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1v27 n GLY 39 N -0.52 3.23 3.78 0.44 0.00 -1.26 -5.06 105.19 105.80 1v27 n GLY 39 Ca 0.09 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1v27 n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1v27 s ARG 40 N 0.00 1.25 0.00 1.61 3.00 -1.26 -4.94 118.95 118.61 1v27 s ARG 40 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 55.73 56.11 1v27 s ARG 40 Cb 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 34.95 33.11 1v27 s ARG 40 CO 0.00 -2.14 0.00 -0.35 0.00 0.00 0.00 175.30 172.81 1v27 n PRO 41 N -3.74 0.00 0.00 3.54 -0.04 -1.26 -4.28 135.00 129.22 1v27 n PRO 41 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1v27 n PRO 41 Cb 0.59 -0.07 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 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 0.00 -2.64 -3.93 0.54 1.85 -1.26 -4.48 116.66 106.74 1v27 n ARG 42 Ca 0.00 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.55 1v27 n ARG 42 Cb 0.00 0.00 -0.14 0.00 -1.05 0.00 0.00 32.46 31.27 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 0.00 4.35 0.61 2.89 0.01 -1.26 -1.17 114.94 120.37 1v27 s ASN 43 Ca 0.00 -3.14 -0.15 0.00 -0.71 0.00 0.00 52.86 48.87 1v27 s ASN 43 Cb 0.00 -1.60 -0.03 0.00 0.41 0.00 0.00 41.25 40.02 1v27 s ASN 43 CO 0.00 -0.21 1.05 -2.16 -1.51 0.00 0.00 177.10 174.27 1v27 s PRO 44 N -0.45 3.31 -0.30 -0.60 0.04 -1.25 0.17 135.00 135.93 1v27 s PRO 44 Ca 0.18 1.13 -0.15 0.00 0.04 0.00 0.00 61.00 62.20 1v27 s PRO 44 Cb -0.22 -2.03 0.15 0.00 0.04 0.00 0.00 34.50 32.43 1v27 s PRO 44 CO -0.03 -0.81 0.91 1.52 0.04 0.00 0.00 177.00 178.63 1v27 s TYR 45 N -2.59 -0.79 0.49 0.56 -0.85 -0.98 -2.64 117.35 110.55 1v27 s TYR 45 Ca 0.62 1.43 -0.16 0.00 -0.52 0.00 0.00 57.07 58.44 1v27 s TYR 45 Cb -0.15 0.47 -0.08 0.00 0.38 0.00 0.00 41.96 42.58 1v27 s TYR 45 CO 0.40 -0.39 0.94 0.08 -1.52 0.00 0.00 175.55 175.06 1v27 s VAL 46 N 2.15 4.57 -0.19 -3.49 1.01 -1.26 -3.05 120.40 120.13 1v27 s VAL 46 Ca -0.06 1.14 -0.04 0.00 0.00 0.00 0.00 61.98 63.02 1v27 s VAL 46 Cb -0.06 -3.71 0.08 0.00 0.00 0.00 0.00 36.38 32.69 1v27 s VAL 46 CO -0.17 -0.63 0.19 -0.75 0.00 0.00 0.00 175.10 173.75 1v27 s LYS 47 N -3.95 0.16 0.35 2.72 2.20 0.65 -2.80 119.74 119.07 1v27 s LYS 47 Ca 0.58 0.18 -0.03 0.00 -0.36 0.00 0.00 55.97 56.34 1v27 s LYS 47 Cb -0.10 -1.25 -0.04 0.00 -1.51 0.00 0.00 37.83 34.93 1v27 s LYS 47 CO 0.30 -0.63 0.60 0.42 -0.36 0.00 0.00 175.35 175.68 1v27 s ILE 48 N 2.29 5.03 -0.30 5.43 1.01 0.20 -0.83 121.20 134.03 1v27 s ILE 48 Ca 0.06 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.62 1v27 s ILE 48 Cb -0.15 -3.81 0.17 0.00 0.01 0.00 0.00 42.46 38.67 1v27 s ILE 48 CO -0.11 -0.53 0.47 -0.31 0.00 0.00 0.00 174.94 174.46 1v27 s TYR 49 N -2.32 -1.27 -0.95 3.97 2.02 -1.10 -3.11 117.35 114.59 1v27 s TYR 49 Ca 0.43 0.50 -0.25 0.00 -0.37 0.00 0.00 57.07 57.39 1v27 s TYR 49 Cb -0.10 -0.00 -0.10 0.00 -0.40 0.00 0.00 41.96 41.36 1v27 s TYR 49 CO 0.36 -1.03 2.08 0.12 -1.57 0.00 0.00 175.55 175.51 1v27 s PHE 50 N 2.56 1.59 0.97 2.71 5.36 -1.25 -2.75 117.98 127.17 1v27 s PHE 50 Ca 0.10 1.15 -0.12 0.00 -0.96 0.00 0.00 56.93 57.10 1v27 s PHE 50 Cb -0.11 -3.80 0.10 0.00 -0.34 0.00 0.00 43.02 38.87 1v27 s PHE 50 CO -0.27 -1.48 0.63 1.28 -1.46 0.00 0.00 175.22 173.92 1v27 n LEU 51 N 15.93 0.54 0.22 6.12 4.32 -0.84 -2.97 117.00 140.32 1v27 n LEU 51 Ca 0.43 0.28 0.10 0.00 -0.02 0.00 0.00 56.01 56.80 1v27 n LEU 51 Cb 0.46 -1.27 0.35 0.00 -1.62 0.00 0.00 43.42 41.34 1v27 n LEU 51 CO 0.60 -3.12 0.77 1.55 -1.22 0.00 0.00 177.39 175.97 1v27 h PRO 52 N -1.80 0.00 -6.07 3.23 0.13 -1.89 -3.37 132.00 122.23 1v27 h PRO 52 Ca -0.46 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.02 1v27 h PRO 52 Cb 1.29 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.54 1v27 h PRO 52 CO 0.38 0.19 -0.48 -0.25 -0.23 0.00 0.00 178.00 177.60 1v27 n ASP 53 N -3.23 -1.06 -3.00 1.44 8.00 -1.16 -4.95 116.55 112.59 1v27 n ASP 53 Ca 0.01 1.10 0.02 0.00 0.71 0.00 0.00 54.79 56.63 1v27 n ASP 53 Cb 0.49 -0.99 -0.00 0.00 -0.02 0.00 0.00 41.12 40.60 1v27 n ASP 53 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1v27 s ARG 54 N -1.09 0.44 0.00 -1.24 3.52 -1.26 -4.37 118.95 114.96 1v27 s ARG 54 Ca 0.63 -0.08 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 1v27 s ARG 54 Cb -0.86 0.07 0.00 0.00 -1.56 0.00 0.00 34.95 32.60 1v27 s ARG 54 CO 0.57 -0.67 0.00 0.43 -0.81 0.00 0.00 175.30 174.83 1v27 n SER 55 N 4.21 0.00 0.00 -2.12 7.64 -1.26 -5.16 113.62 116.93 1v27 n SER 55 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1v27 n SER 55 Cb 0.60 0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.93 1v27 n SER 55 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1v27 n ASP 56 N -1.98 0.00 0.00 6.43 2.03 -1.26 -4.95 116.55 116.82 1v27 n ASP 56 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1v27 n ASP 56 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1v27 n ASP 56 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1v27 n LYS 57 N -0.01 0.00 -0.39 -0.67 5.02 -1.26 -3.44 118.16 117.42 1v27 n LYS 57 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1v27 n LYS 57 Cb 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.21 1v27 n LYS 57 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1v27 n ASN 58 N 1.78 3.04 -4.60 4.39 6.94 -1.26 -4.83 115.26 120.73 1v27 n ASN 58 Ca 0.00 -2.33 -0.41 0.00 -0.02 0.00 0.00 54.58 51.81 1v27 n ASN 58 Cb 0.00 -0.49 -0.06 0.00 -2.36 0.00 0.00 39.78 36.87 1v27 n ASN 58 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1v27 s LYS 59 N -1.78 3.88 -0.21 -3.83 2.20 -1.22 -3.88 119.74 114.90 1v27 s LYS 59 Ca 0.28 0.34 -0.03 0.00 -0.36 0.00 0.00 55.97 56.20 1v27 s LYS 59 Cb 0.19 -3.74 -0.00 0.00 -1.51 0.00 0.00 37.83 32.77 1v27 s LYS 59 CO 0.11 -0.63 -0.07 1.03 -0.36 0.00 0.00 175.35 175.43 1v27 s ARG 60 N 2.72 3.32 -0.00 4.03 1.81 -1.18 -5.00 118.95 124.64 1v27 s ARG 60 Ca 0.27 -0.66 0.02 0.00 -1.72 0.00 0.00 55.73 53.64 1v27 s ARG 60 Cb -0.15 -2.92 -0.01 0.00 -0.45 0.00 0.00 34.95 31.43 1v27 s ARG 60 CO 0.12 -0.17 -0.07 0.50 -0.68 0.00 0.00 175.30 175.00 1v27 s ARG 61 N 1.38 0.53 0.77 3.54 3.52 -1.26 0.60 118.95 128.03 1v27 s ARG 61 Ca 0.05 -0.27 -0.10 0.00 -0.13 0.00 0.00 55.73 55.28 1v27 s ARG 61 Cb -0.14 -0.50 0.08 0.00 -1.56 0.00 0.00 34.95 32.84 1v27 s ARG 61 CO -0.04 0.13 1.11 0.95 -0.81 0.00 0.00 175.30 176.64 1v27 s THR 62 N -0.24 2.13 0.41 4.11 -4.23 -1.12 -5.02 115.64 111.68 1v27 s THR 62 Ca 0.02 -0.14 -0.25 0.00 -1.18 0.00 0.00 61.69 60.14 1v27 s THR 62 Cb -0.03 -2.99 -0.08 0.00 1.34 0.00 0.00 72.50 70.74 1v27 s THR 62 CO -0.00 0.00 1.18 -1.59 -0.54 0.00 0.00 174.62 173.67 1v27 s LYS 63 N -5.44 3.98 -0.41 3.99 -2.85 -1.26 -4.75 119.74 113.00 1v27 s LYS 63 Ca 0.62 1.85 -0.29 0.00 -1.00 0.00 0.00 55.97 57.15 1v27 s LYS 63 Cb -0.10 -2.62 0.02 0.00 -2.06 0.00 0.00 37.83 33.07 1v27 s LYS 63 CO 0.47 -0.39 1.11 0.99 0.10 0.00 0.00 175.35 177.63 1v27 s THR 64 N -1.43 4.35 0.48 3.79 2.01 -1.26 -4.81 115.64 118.77 1v27 s THR 64 Ca 0.59 1.45 -0.19 0.00 0.31 0.00 0.00 61.69 63.85 1v27 s THR 64 Cb -0.31 -4.52 -0.09 0.00 0.01 0.00 0.00 72.50 67.60 1v27 s THR 64 CO 0.38 -0.77 0.98 -0.69 -0.69 0.00 0.00 174.62 173.84 1v27 s VAL 65 N 4.08 4.37 -0.17 3.82 1.01 -1.08 -5.01 120.40 127.42 1v27 s VAL 65 Ca 0.47 1.30 -0.02 0.00 0.00 0.00 0.00 61.98 63.73 1v27 s VAL 65 Cb -0.09 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1v27 s VAL 65 CO 0.24 -0.49 -0.09 -0.54 0.00 0.00 0.00 175.10 174.22 1v27 s LYS 66 N -3.64 3.40 -0.06 2.72 -0.14 -1.26 -3.77 119.74 116.99 1v27 s LYS 66 Ca 0.61 -0.65 -0.01 0.00 -1.36 0.00 0.00 55.97 54.56 1v27 s LYS 66 Cb -0.10 -2.79 0.00 0.00 -1.68 0.00 0.00 37.83 33.26 1v27 s LYS 66 CO 0.23 0.06 0.02 1.63 -0.76 0.00 0.00 175.35 176.53 1v27 n LYS 67 N 4.01 -1.36 -3.22 1.68 5.02 -0.32 -5.00 118.16 118.98 1v27 n LYS 67 Ca -0.18 1.40 0.04 0.00 -2.02 0.00 0.00 58.31 57.54 1v27 n LYS 67 Cb 0.52 -1.87 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 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 -0.77 -0.18 -0.36 -0.18 -1.32 -1.22 -4.95 115.64 106.66 1v27 s THR 68 Ca -0.02 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.70 1v27 s THR 68 Cb 0.00 -1.00 0.33 0.00 -1.51 0.00 0.00 72.50 70.33 1v27 s THR 68 CO 0.17 0.00 1.65 -0.07 -2.21 0.00 0.00 174.62 174.16 1v27 h LEU 69 N 7.37 0.00 -6.96 9.08 3.38 -1.94 -3.38 115.31 122.86 1v27 h LEU 69 Ca -0.13 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.22 1v27 h LEU 69 Cb 1.14 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.48 1v27 h LEU 69 CO 0.01 0.02 -0.70 -1.61 0.09 0.00 0.00 178.44 176.26 1v27 s GLU 70 N -3.26 1.81 0.13 1.13 2.02 -1.26 -4.11 118.70 115.16 1v27 s GLU 70 Ca 0.06 -2.69 -0.30 0.00 0.02 0.00 0.00 54.97 52.06 1v27 s GLU 70 Cb 0.06 -2.75 -0.07 0.00 0.10 0.00 0.00 34.13 31.47 1v27 s GLU 70 CO 0.66 -1.25 1.14 -1.25 0.02 0.00 0.00 175.26 174.57 1v27 s PRO 71 N -0.58 4.52 -0.38 0.39 0.04 -1.20 -4.83 135.00 132.96 1v27 s PRO 71 Ca 0.24 1.74 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1v27 s PRO 71 Cb -0.10 -3.31 0.11 0.00 0.04 0.00 0.00 34.50 31.24 1v27 s PRO 71 CO -0.11 -0.07 0.13 0.15 0.04 0.00 0.00 177.00 177.14 1v27 s LYS 72 N 0.23 1.72 -0.17 4.56 1.02 -1.26 -1.28 119.74 124.56 1v27 s LYS 72 Ca 0.53 -1.92 -0.09 0.00 0.02 0.00 0.00 55.97 54.52 1v27 s LYS 72 Cb -0.29 -3.36 -0.23 0.00 -0.52 0.00 0.00 37.83 33.43 1v27 s LYS 72 CO 0.33 -1.00 0.21 0.91 -0.92 0.00 0.00 175.35 174.87 1v27 n TRP 73 N 4.28 0.96 -3.50 3.18 8.01 0.25 -4.93 117.44 125.69 1v27 n TRP 73 Ca 0.02 0.24 -0.24 0.00 -1.31 0.00 0.00 57.50 56.22 1v27 n TRP 73 Cb 0.41 -1.12 -0.04 0.00 -2.01 0.00 0.00 31.31 28.55 1v27 n TRP 73 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1v27 n ASN 74 N -3.67 -1.36 -4.67 -0.99 3.02 0.39 -4.85 115.26 103.13 1v27 n ASN 74 Ca -0.35 -0.52 -0.26 0.00 -0.03 0.00 0.00 54.58 53.42 1v27 n ASN 74 Cb 0.96 -1.23 0.11 0.00 -0.61 0.00 0.00 39.78 39.01 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 -5.81 1.69 0.05 3.52 -1.52 -0.94 -4.84 119.66 111.81 1v27 s GLN 75 Ca 0.46 -0.50 0.07 0.00 -1.95 0.00 0.00 55.36 53.44 1v27 s GLN 75 Cb -0.27 -2.13 -0.03 0.00 -0.22 0.00 0.00 33.01 30.36 1v27 s GLN 75 CO 0.57 -1.57 -0.19 0.99 -0.25 0.00 0.00 175.29 174.83 1v27 s THR 76 N -3.38 1.57 -0.18 -0.19 2.01 -1.26 -1.98 115.64 112.24 1v27 s THR 76 Ca 0.65 -1.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.39 1v27 s THR 76 Cb -0.08 -1.38 0.09 0.00 0.01 0.00 0.00 72.50 71.14 1v27 s THR 76 CO 0.47 0.13 0.26 -0.36 -0.69 0.00 0.00 174.62 174.42 1v27 s PHE 77 N -0.87 -0.41 -0.12 4.92 0.08 -0.31 -4.95 117.98 116.32 1v27 s PHE 77 Ca 0.06 0.62 -0.10 0.00 0.12 0.00 0.00 56.93 57.64 1v27 s PHE 77 Cb -0.09 -0.17 -0.05 0.00 -0.57 0.00 0.00 43.02 42.14 1v27 s PHE 77 CO 0.02 -0.51 0.21 0.42 -0.10 0.00 0.00 175.22 175.26 1v27 s ILE 78 N 2.40 5.37 -0.21 0.64 1.01 -1.26 -0.27 121.20 128.88 1v27 s ILE 78 Ca 0.05 0.38 0.00 0.00 0.00 0.00 0.00 60.65 61.09 1v27 s ILE 78 Cb -0.14 -3.51 0.05 0.00 0.01 0.00 0.00 42.46 38.87 1v27 s ILE 78 CO -0.11 0.55 -0.06 -0.31 0.00 0.00 0.00 174.94 175.01 1v27 s TYR 79 N -0.58 2.18 0.10 3.97 2.02 0.11 -4.89 117.35 120.25 1v27 s TYR 79 Ca 0.16 -1.54 -0.08 0.00 -0.37 0.00 0.00 57.07 55.24 1v27 s TYR 79 Cb -0.13 -1.51 -0.01 0.00 -0.40 0.00 0.00 41.96 39.92 1v27 s TYR 79 CO 0.05 -0.73 0.18 -1.54 -1.57 0.00 0.00 175.55 171.93 1v27 s SER 80 N 1.47 0.15 0.30 2.29 1.04 -1.26 0.89 113.70 118.58 1v27 s SER 80 Ca -0.03 -0.74 -0.28 0.00 0.48 0.00 0.00 55.95 55.37 1v27 s SER 80 Cb -0.18 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.19 1v27 s SER 80 CO -0.07 -0.74 1.08 -2.16 0.98 0.00 0.00 173.24 172.33 1v27 s PRO 81 N -3.89 4.57 -0.13 4.02 0.04 -1.26 -5.06 135.00 133.29 1v27 s PRO 81 Ca 0.08 1.72 -0.02 0.00 0.04 0.00 0.00 61.00 62.82 1v27 s PRO 81 Cb 0.05 -3.07 0.04 0.00 0.04 0.00 0.00 34.50 31.56 1v27 s PRO 81 CO -0.09 0.17 0.02 0.08 0.04 0.00 0.00 177.00 177.22 1v27 s VAL 82 N -1.26 0.43 0.18 -0.36 1.01 0.54 -4.97 120.40 115.97 1v27 s VAL 82 Ca 0.47 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.30 1v27 s VAL 82 Cb -0.30 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1v27 s VAL 82 CO 0.38 0.05 0.31 -1.00 0.00 0.00 0.00 175.10 174.84 1v27 s HIS 83 N 1.93 3.48 0.11 5.22 3.76 -1.26 -3.59 115.29 124.93 1v27 s HIS 83 Ca 0.02 0.09 0.32 0.00 -0.15 0.00 0.00 55.06 55.35 1v27 s HIS 83 Cb -0.14 -1.65 1.31 0.00 1.11 0.00 0.00 32.58 33.21 1v27 s HIS 83 CO -0.07 0.48 1.97 -0.09 -0.85 0.00 0.00 174.74 176.19 1v27 h ARG 84 N 1.86 0.00 0.00 1.40 9.65 -2.00 -1.85 114.38 123.44 1v27 h ARG 84 Ca -0.49 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 1v27 h ARG 84 Cb 1.20 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.78 1v27 h ARG 84 CO 0.66 0.03 -0.46 2.89 2.80 0.00 0.00 179.97 185.89 1v27 n ARG 85 N -3.14 0.12 0.00 0.20 -4.01 -1.26 -3.38 116.66 105.20 1v27 n ARG 85 Ca 0.00 0.04 0.13 0.00 -1.04 0.00 0.00 57.85 56.98 1v27 n ARG 85 Cb 0.32 -1.58 0.34 0.00 -3.04 0.00 0.00 32.46 28.50 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 -1.76 1.10 -0.20 2.89 -0.58 -0.70 -4.08 120.64 117.32 1v27 n GLU 86 Ca 0.05 -0.71 -0.08 0.00 -0.42 0.00 0.00 57.16 56.00 1v27 n GLU 86 Cb 0.38 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.78 1v27 n GLU 86 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 1v27 h PHE 87 N 1.72 0.89 0.00 -0.32 -1.00 -1.55 0.36 116.94 117.04 1v27 h PHE 87 Ca 0.00 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1v27 h PHE 87 Cb 0.56 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 39.86 1v27 h PHE 87 CO 0.00 0.76 0.00 2.89 -1.61 0.00 0.00 178.31 180.35 1v27 n ARG 88 N -4.44 0.92 0.00 1.51 1.85 -1.26 -2.43 116.66 112.80 1v27 n ARG 88 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 1v27 n ARG 88 Cb 0.20 -1.41 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 1v27 n ARG 88 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1v27 n GLU 89 N -0.91 -0.43 -3.73 2.89 1.02 -0.53 -5.01 120.64 113.95 1v27 n GLU 89 Ca 0.18 -0.42 -0.12 0.00 -0.02 0.00 0.00 57.16 56.78 1v27 n GLU 89 Cb 0.08 -0.92 -0.12 0.00 -0.02 0.00 0.00 31.44 30.47 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 -0.06 0.31 0.13 3.49 3.00 0.12 -4.85 118.95 121.08 1v27 s ARG 90 Ca 0.00 0.59 0.06 0.00 0.00 0.00 0.00 55.73 56.38 1v27 s ARG 90 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 34.95 34.90 1v27 s ARG 90 CO 0.00 -0.13 -0.14 1.41 0.00 0.00 0.00 175.30 176.44 1v27 s MET 91 N 1.04 1.05 0.20 3.54 -2.45 -1.26 -3.99 119.30 117.44 1v27 s MET 91 Ca -0.07 -1.26 -0.03 0.00 -1.25 0.00 0.00 55.69 53.08 1v27 s MET 91 Cb -0.08 -0.92 -0.05 0.00 1.25 0.00 0.00 34.83 35.03 1v27 s MET 91 CO -0.08 0.18 0.42 -0.51 1.05 0.00 0.00 175.02 176.08 1v27 s LEU 92 N -2.51 4.20 -0.35 4.11 2.01 -0.52 -1.98 118.68 123.64 1v27 s LEU 92 Ca 0.10 0.53 -0.00 0.00 0.01 0.00 0.00 54.13 54.76 1v27 s LEU 92 Cb -0.05 -3.30 0.13 0.00 0.01 0.00 0.00 46.19 42.99 1v27 s LEU 92 CO 0.03 -0.05 0.20 -0.70 1.01 0.00 0.00 176.35 176.84 1v27 s GLU 93 N -3.16 0.58 0.11 1.70 2.12 -1.11 -2.42 118.70 116.52 1v27 s GLU 93 Ca 0.40 -1.27 -0.22 0.00 0.36 0.00 0.00 54.97 54.24 1v27 s GLU 93 Cb -0.11 -1.43 -0.07 0.00 0.26 0.00 0.00 34.13 32.78 1v27 s GLU 93 CO 0.28 -1.16 0.67 0.42 -0.54 0.00 0.00 175.26 174.92 1v27 s ILE 94 N 1.17 4.58 0.02 -3.70 1.09 -0.53 -2.72 121.20 121.12 1v27 s ILE 94 Ca 0.16 1.45 0.03 0.00 -1.10 0.00 0.00 60.65 61.19 1v27 s ILE 94 Cb -0.22 -4.01 -0.02 0.00 -1.06 0.00 0.00 42.46 37.15 1v27 s ILE 94 CO -0.06 0.53 -0.10 0.42 -0.10 0.00 0.00 174.94 175.62 1v27 s THR 95 N -1.03 0.78 -0.07 2.92 -4.23 -0.01 0.13 115.64 114.12 1v27 s THR 95 Ca 0.32 -0.76 0.04 0.00 -1.18 0.00 0.00 61.69 60.11 1v27 s THR 95 Cb -0.21 -0.72 -0.00 0.00 1.34 0.00 0.00 72.50 72.91 1v27 s THR 95 CO 0.22 -0.03 -0.21 -0.22 -0.54 0.00 0.00 174.62 173.84 1v27 s LEU 96 N -0.88 1.98 0.00 4.79 2.96 -0.18 -0.26 118.68 127.09 1v27 s LEU 96 Ca -0.01 -0.47 0.07 0.00 -0.22 0.00 0.00 54.13 53.51 1v27 s LEU 96 Cb -0.06 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 1v27 s LEU 96 CO 0.00 0.16 0.27 0.79 -1.32 0.00 0.00 176.35 176.26 1v27 n TRP 97 N 3.35 -0.77 -3.83 5.38 7.02 -1.17 -2.20 117.44 125.22 1v27 n TRP 97 Ca -0.19 -2.62 -0.27 0.00 -1.02 0.00 0.00 57.50 53.40 1v27 n TRP 97 Cb 0.53 0.28 -0.17 0.00 -2.42 0.00 0.00 31.31 29.53 1v27 n TRP 97 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1v27 s ASP 98 N -3.18 2.60 -0.41 -0.99 2.15 -1.22 -2.31 116.67 113.32 1v27 s ASP 98 Ca 0.37 -0.59 -0.27 0.00 0.43 0.00 0.00 52.55 52.50 1v27 s ASP 98 Cb 0.02 -0.74 -0.06 0.00 -0.30 0.00 0.00 42.92 41.83 1v27 s ASP 98 CO 0.26 -0.22 2.31 -1.58 -0.17 0.00 0.00 175.17 175.78 1v27 s GLN 99 N 1.75 2.47 0.17 4.34 -0.44 0.46 -4.22 119.66 124.21 1v27 s GLN 99 Ca 0.01 1.56 0.00 0.00 -2.50 0.00 0.00 55.36 54.44 1v27 s GLN 99 Cb -0.15 -4.50 0.00 0.00 -1.64 0.00 0.00 33.01 26.72 1v27 s GLN 99 CO -0.07 -2.86 0.03 0.00 0.50 0.00 0.00 175.29 172.89 1v27 n ALA 100 N 14.32 0.18 -0.85 1.58 0.00 -1.26 -3.98 120.51 130.49 1v27 n ALA 100 Ca 0.33 -0.76 0.10 0.00 0.00 0.00 0.00 53.44 53.12 1v27 n ALA 100 Cb 0.51 0.39 -0.03 0.00 0.00 0.00 0.00 19.45 20.33 1v27 n ALA 100 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1v27 n ARG 101 N -0.54 -1.53 -0.05 0.00 3.00 -1.26 -4.77 116.66 111.50 1v27 n ARG 101 Ca -0.06 1.01 -0.07 0.00 -0.00 0.00 0.00 57.85 58.73 1v27 n ARG 101 Cb 0.21 -1.87 -0.05 0.00 0.00 0.00 0.00 32.46 30.76 1v27 n ARG 101 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1v27 n VAL 102 N -2.57 0.58 0.05 5.15 0.24 -1.26 -4.99 118.33 115.53 1v27 n VAL 102 Ca 0.01 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1v27 n VAL 102 Cb 0.35 -0.86 0.00 0.00 -1.47 0.00 0.00 33.84 31.86 1v27 n VAL 102 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1v27 n ARG 103 N -2.78 0.00 -1.40 7.34 1.74 -1.26 -5.09 116.66 115.21 1v27 n ARG 103 Ca -0.18 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.45 1v27 n ARG 103 Cb 0.70 -0.04 -0.02 0.00 -1.02 0.00 0.00 32.46 32.08 1v27 n ARG 103 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1v27 n GLU 104 N -2.87 0.17 -2.25 5.56 1.02 -1.26 -4.75 120.64 116.26 1v27 n GLU 104 Ca 0.00 0.06 -0.39 0.00 -0.02 0.00 0.00 57.16 56.81 1v27 n GLU 104 Cb 0.00 -1.12 -0.03 0.00 -0.02 0.00 0.00 31.44 30.27 1v27 n GLU 104 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1v27 s GLU 105 N -1.10 2.86 -0.41 3.49 2.12 -1.26 -4.78 118.70 119.63 1v27 s GLU 105 Ca 0.62 0.18 0.08 0.00 0.36 0.00 0.00 54.97 56.21 1v27 s GLU 105 Cb -0.81 -4.39 0.25 0.00 0.26 0.00 0.00 34.13 29.44 1v27 s GLU 105 CO 0.58 -2.54 0.53 0.39 -0.54 0.00 0.00 175.26 173.68 1v27 n GLU 106 N 9.23 0.81 -4.35 4.30 1.02 -1.26 -4.92 120.64 125.46 1v27 n GLU 106 Ca 0.16 -3.31 -0.34 0.00 -0.02 0.00 0.00 57.16 53.66 1v27 n GLU 106 Cb 0.51 -1.28 -0.09 0.00 -0.02 0.00 0.00 31.44 30.55 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 -1.23 5.12 -0.18 1.62 0.01 -1.26 -4.32 113.70 113.47 1v27 s SER 107 Ca 0.35 0.05 -0.08 0.00 1.31 0.00 0.00 55.95 57.59 1v27 s SER 107 Cb 0.17 -1.38 -0.04 0.00 0.21 0.00 0.00 66.02 64.98 1v27 s SER 107 CO -0.11 0.33 0.07 -0.70 0.41 0.00 0.00 173.24 173.24 1v27 s GLU 108 N -1.21 3.97 -0.72 12.44 2.12 -1.26 -4.83 118.70 129.21 1v27 s GLU 108 Ca 0.16 -0.33 -0.27 0.00 0.36 0.00 0.00 54.97 54.89 1v27 s GLU 108 Cb -0.11 -3.22 0.03 0.00 0.26 0.00 0.00 34.13 31.08 1v27 s GLU 108 CO 0.06 0.30 1.32 0.12 -0.54 0.00 0.00 175.26 176.51 1v27 s PHE 109 N 0.31 2.25 0.32 5.30 5.36 -1.26 -3.39 117.98 126.87 1v27 s PHE 109 Ca 0.04 0.02 0.09 0.00 -0.96 0.00 0.00 56.93 56.12 1v27 s PHE 109 Cb -0.12 -4.59 0.53 0.00 -0.34 0.00 0.00 43.02 38.50 1v27 s PHE 109 CO -0.00 -2.08 1.73 -0.07 -1.46 0.00 0.00 175.22 173.34 1v27 h LEU 110 N 13.21 0.12 0.00 6.12 3.38 -1.73 -3.47 115.31 132.95 1v27 h LEU 110 Ca -0.28 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1v27 h LEU 110 Cb 1.06 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1v27 h LEU 110 CO 1.27 0.54 0.00 0.61 0.09 0.00 0.00 178.44 180.96 1v27 n GLY 111 N -0.21 4.42 3.55 0.83 0.00 -1.18 -4.19 105.19 108.40 1v27 n GLY 111 Ca -0.02 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 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 -3.43 1.99 -0.33 1.61 -1.05 -1.14 -1.02 118.70 115.34 1v27 s GLU 112 Ca 0.00 -1.15 0.03 0.00 -0.15 0.00 0.00 54.97 53.71 1v27 s GLU 112 Cb 0.00 -2.20 0.09 0.00 -0.44 0.00 0.00 34.13 31.59 1v27 s GLU 112 CO 0.00 0.48 0.03 0.42 0.95 0.00 0.00 175.26 177.14 1v27 s ILE 113 N -1.33 2.14 0.16 1.83 1.01 0.35 -3.33 121.20 122.04 1v27 s ILE 113 Ca 0.21 -2.17 -0.11 0.00 0.00 0.00 0.00 60.65 58.58 1v27 s ILE 113 Cb -0.10 -2.54 -0.07 0.00 0.01 0.00 0.00 42.46 39.76 1v27 s ILE 113 CO 0.13 -0.53 0.51 -0.76 0.00 0.00 0.00 174.94 174.29 1v27 s LEU 114 N 0.99 4.28 -0.04 2.97 1.02 -1.26 -1.46 118.68 125.18 1v27 s LEU 114 Ca 0.08 0.94 -0.03 0.00 0.02 0.00 0.00 54.13 55.14 1v27 s LEU 114 Cb -0.19 -3.35 0.01 0.00 0.02 0.00 0.00 46.19 42.68 1v27 s LEU 114 CO -0.09 0.05 0.10 -0.63 0.02 0.00 0.00 176.35 175.80 1v27 s ILE 115 N -1.58 -0.00 -0.42 -0.59 1.09 -1.01 -4.97 121.20 113.71 1v27 s ILE 115 Ca 0.40 0.01 -0.15 0.00 -1.10 0.00 0.00 60.65 59.81 1v27 s ILE 115 Cb -0.13 -0.14 0.03 0.00 -1.06 0.00 0.00 42.46 41.16 1v27 s ILE 115 CO 0.20 0.00 0.32 -1.61 -0.10 0.00 0.00 174.94 173.75 1v27 s GLU 116 N 0.10 2.97 0.54 2.79 2.02 -1.26 -1.44 118.70 124.42 1v27 s GLU 116 Ca -0.00 -1.10 0.40 0.00 0.02 0.00 0.00 54.97 54.28 1v27 s GLU 116 Cb -0.01 -4.01 1.60 0.00 0.10 0.00 0.00 34.13 31.81 1v27 s GLU 116 CO -0.00 -0.82 1.74 -0.07 0.02 0.00 0.00 175.26 176.14 1v27 h LEU 117 N 8.65 0.01 -0.44 1.80 3.38 -1.73 1.33 115.31 128.31 1v27 h LEU 117 Ca -0.27 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1v27 h LEU 117 Cb 1.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 1v27 h LEU 117 CO 0.76 -0.00 0.29 -0.08 0.09 0.00 0.00 178.44 179.50 1v27 h GLU 118 N 0.01 0.57 -0.26 1.13 4.81 -1.80 -2.76 114.58 116.27 1v27 h GLU 118 Ca 0.67 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.81 1v27 h GLU 118 Cb 2.66 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 31.88 1v27 h GLU 118 CO -0.02 0.38 -0.01 0.25 -0.73 0.00 0.00 179.01 178.88 1v27 n THR 119 N -4.79 2.33 -2.56 0.32 -2.24 0.32 -4.96 114.28 102.70 1v27 n THR 119 Ca 0.01 -2.12 -0.43 0.00 -2.27 0.00 0.00 64.05 59.24 1v27 n THR 119 Cb 0.03 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 67.96 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 -2.94 3.51 -1.05 6.98 0.00 0.37 -4.85 121.76 123.79 1v27 s ALA 120 Ca 0.42 0.08 -0.23 0.00 0.00 0.00 0.00 51.96 52.23 1v27 s ALA 120 Cb 0.35 -3.67 -0.00 0.00 0.00 0.00 0.00 23.12 19.80 1v27 s ALA 120 CO 0.06 -1.45 1.74 -0.48 0.00 0.00 0.00 175.76 175.63 1v27 s LEU 121 N 3.74 3.36 -0.15 0.00 0.05 -1.26 -4.94 118.68 119.48 1v27 s LEU 121 Ca 0.49 -1.37 -0.21 0.00 0.05 0.00 0.00 54.13 53.09 1v27 s LEU 121 Cb -0.15 -2.57 -0.03 0.00 -2.05 0.00 0.00 46.19 41.39 1v27 s LEU 121 CO 0.16 -2.14 0.63 -0.76 -0.55 0.00 0.00 176.35 173.69 1v27 s LEU 122 N 7.60 4.20 0.00 1.48 1.43 -1.26 -4.78 118.68 127.36 1v27 s LEU 122 Ca 0.59 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.61 1v27 s LEU 122 Cb -0.02 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.29 1v27 s LEU 122 CO -0.00 -0.20 0.00 -0.67 0.23 0.00 0.00 176.35 175.71 1v27 n ASP 123 N 4.55 0.00 -4.50 2.29 -0.08 -1.16 -4.85 116.55 112.79 1v27 n ASP 123 Ca -0.02 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.84 1v27 n ASP 123 Cb 0.50 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.89 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 0.00 -1.91 -4.33 1.67 2.03 -1.00 -4.88 116.55 108.13 1v27 n ASP 124 Ca 0.00 -1.21 -0.35 0.00 0.52 0.00 0.00 54.79 53.75 1v27 n ASP 124 Cb 0.00 -1.66 -0.14 0.00 -0.72 0.00 0.00 41.12 38.60 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 -7.20 3.41 -0.11 -0.67 2.02 -1.26 -4.99 118.70 109.90 1v27 s GLU 125 Ca 0.82 -0.61 -0.30 0.00 0.02 0.00 0.00 54.97 54.91 1v27 s GLU 125 Cb -0.48 -3.02 -0.02 0.00 0.10 0.00 0.00 34.13 30.70 1v27 s GLU 125 CO 1.01 -0.17 1.25 -1.25 0.02 0.00 0.00 175.26 176.12 1v27 s PRO 126 N 1.42 4.28 0.02 0.39 0.04 -1.26 -4.51 135.00 135.38 1v27 s PRO 126 Ca 0.05 1.68 0.06 0.00 0.04 0.00 0.00 61.00 62.83 1v27 s PRO 126 Cb -0.14 -3.67 -0.02 0.00 0.04 0.00 0.00 34.50 30.71 1v27 s PRO 126 CO -0.02 -0.59 -0.18 -1.01 0.04 0.00 0.00 177.00 175.23 1v27 s HIS 127 N 2.91 1.61 -0.49 0.56 3.76 -1.25 -5.02 115.29 117.37 1v27 s HIS 127 Ca 0.56 -0.33 -0.20 0.00 -0.15 0.00 0.00 55.06 54.93 1v27 s HIS 127 Cb -0.23 -0.99 0.04 0.00 1.11 0.00 0.00 32.58 32.51 1v27 s HIS 127 CO 0.18 0.03 0.68 -1.58 -0.85 0.00 0.00 174.74 173.20 1v27 s TRP 128 N -0.62 3.01 -0.11 1.40 0.52 -1.26 -2.95 118.94 118.93 1v27 s TRP 128 Ca 0.06 -0.31 -0.13 0.00 0.02 0.00 0.00 56.10 55.74 1v27 s TRP 128 Cb -0.08 -3.57 -0.05 0.00 -1.15 0.00 0.00 33.47 28.63 1v27 s TRP 128 CO 0.01 -1.04 0.31 0.71 0.02 0.00 0.00 176.95 176.96 1v27 s TYR 129 N 2.91 3.55 0.36 -1.98 2.02 0.18 -4.86 117.35 119.54 1v27 s TYR 129 Ca 0.20 0.71 -0.26 0.00 -0.37 0.00 0.00 57.07 57.35 1v27 s TYR 129 Cb -0.17 -2.28 -0.09 0.00 -0.40 0.00 0.00 41.96 39.02 1v27 s TYR 129 CO 0.15 0.41 1.06 0.15 -1.57 0.00 0.00 175.55 175.75 1v27 s LYS 130 N -0.14 4.33 0.23 -0.62 1.02 -1.26 -1.29 119.74 122.02 1v27 s LYS 130 Ca 0.19 1.59 -0.09 0.00 0.02 0.00 0.00 55.97 57.68 1v27 s LYS 130 Cb -0.14 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.34 1v27 s LYS 130 CO 0.07 -0.01 0.54 -0.51 -0.92 0.00 0.00 175.35 174.52 1v27 s LEU 131 N -2.24 4.16 0.02 3.17 1.43 -1.19 -4.85 118.68 119.18 1v27 s LEU 131 Ca 0.53 0.88 0.08 0.00 -1.03 0.00 0.00 54.13 54.60 1v27 s LEU 131 Cb -0.25 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.30 1v27 s LEU 131 CO 0.31 -0.08 -0.25 0.00 0.23 0.00 0.00 176.35 176.56 1v27 s GLN 132 N -2.88 1.97 -0.27 1.70 -2.07 -1.21 -4.84 119.66 112.06 1v27 s GLN 132 Ca 0.47 -1.01 0.01 0.00 -1.82 0.00 0.00 55.36 53.00 1v27 s GLN 132 Cb -0.11 -2.03 0.07 0.00 -1.09 0.00 0.00 33.01 29.85 1v27 s GLN 132 CO 0.22 0.54 -0.02 0.95 -1.32 0.00 0.00 175.29 175.66 1v27 s THR 133 N -0.73 1.63 -0.25 3.63 -4.23 -1.26 -2.90 115.64 111.53 1v27 s THR 133 Ca 0.11 -1.49 -0.06 0.00 -1.18 0.00 0.00 61.69 59.07 1v27 s THR 133 Cb -0.10 -1.98 0.01 0.00 1.34 0.00 0.00 72.50 71.77 1v27 s THR 133 CO 0.01 -0.27 0.23 1.57 -0.54 0.00 0.00 174.62 175.62 1v27 n HIS 134 N 4.60 -2.38 0.00 3.99 -0.00 -1.26 -4.98 115.22 115.19 1v27 n HIS 134 Ca -0.08 1.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.64 1v27 n HIS 134 Cb 0.43 -3.15 0.00 0.00 -0.00 0.00 0.00 29.99 27.27 1v27 n HIS 134 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1v27 n ASP 135 N -0.05 0.00 0.00 0.26 8.00 -1.26 -5.07 116.55 118.43 1v27 n ASP 135 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 1v27 n ASP 135 Cb 0.18 0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1v27 n ASP 135 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1v27 n SER 136 N -1.73 0.00 0.00 -2.24 7.64 -1.26 -4.83 113.62 111.21 1v27 n SER 136 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1v27 n SER 136 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1v27 n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v27 n GLY 137 N 0.00 2.42 3.82 0.23 0.00 -1.26 -5.05 105.19 105.35 1v27 n GLY 137 Ca 0.00 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 1v27 n GLY 137 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v27 s PRO 138 N -1.87 3.07 -0.29 1.61 0.04 -1.26 -5.07 135.00 131.22 1v27 s PRO 138 Ca 0.00 1.01 -0.14 0.00 0.04 0.00 0.00 61.00 61.91 1v27 s PRO 138 Cb 0.00 -2.01 0.13 0.00 0.04 0.00 0.00 34.50 32.67 1v27 s PRO 138 CO 0.00 -1.00 0.85 0.45 0.04 0.00 0.00 177.00 177.34 1v27 s SER 139 N -3.54 -0.76 0.91 6.66 0.15 -1.26 -5.17 113.70 110.69 1v27 s SER 139 Ca 0.59 1.12 -0.11 0.00 0.70 0.00 0.00 55.95 58.25 1v27 s SER 139 Cb -0.14 1.61 0.13 0.00 -1.71 0.00 0.00 66.02 65.91 1v27 s SER 139 CO 0.50 -0.17 1.09 -0.55 1.20 0.00 0.00 173.24 175.31 1v27 s SER 140 N 2.05 3.34 0.00 5.45 0.15 -1.26 -5.34 113.70 118.09 1v27 s SER 140 Ca -0.07 1.56 0.07 0.00 0.70 0.00 0.00 55.95 58.21 1v27 s SER 140 Cb -0.06 -2.23 0.40 0.00 -1.71 0.00 0.00 66.02 62.42 1v27 s SER 140 CO -0.18 -2.73 0.86 0.61 1.20 0.00 0.00 173.24 173.01