#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 -0.59 -3.28 1.61 7.64 -1.26 -5.10 113.62 112.64 1v27 n SER 2 Ca 0.00 0.38 -0.16 0.00 1.01 0.00 0.00 58.87 60.10 1v27 n SER 2 Cb 0.00 0.72 0.02 0.00 -1.01 0.00 0.00 64.21 63.93 1v27 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1v27 n SER 3 N -3.16 -6.27 -4.89 6.43 7.64 -1.26 -4.94 113.62 107.18 1v27 n SER 3 Ca 0.00 0.24 -0.33 0.00 1.01 0.00 0.00 58.87 59.79 1v27 n SER 3 Cb 0.00 -1.96 -0.05 0.00 -1.01 0.00 0.00 64.21 61.19 1v27 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v27 s GLY 4 N -1.29 2.24 -0.76 0.23 0.00 -1.26 -5.05 107.32 101.43 1v27 s GLY 4 Ca 0.17 -0.60 -0.06 0.00 0.00 0.00 0.00 44.72 44.22 1v27 s GLY 4 CO 0.43 -0.46 0.63 -0.56 0.00 0.00 0.00 173.10 173.14 1v27 s SER 5 N -1.98 5.94 -0.25 1.64 0.01 -1.26 -5.04 113.70 112.76 1v27 s SER 5 Ca 0.32 -3.00 -0.10 0.00 1.31 0.00 0.00 55.95 54.49 1v27 s SER 5 Cb -0.13 -1.99 -0.04 0.00 0.21 0.00 0.00 66.02 64.06 1v27 s SER 5 CO 0.20 -0.39 0.14 -0.44 0.41 0.00 0.00 173.24 173.15 1v27 s SER 6 N 1.02 5.77 0.00 2.44 0.01 -1.26 -4.99 113.70 116.70 1v27 s SER 6 Ca 0.20 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.44 1v27 s SER 6 Cb -0.14 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.04 1v27 s SER 6 CO -0.07 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.20 1v27 n GLY 7 N 4.64 4.18 0.00 3.44 0.00 -1.26 -4.82 105.19 111.37 1v27 n GLY 7 Ca -0.15 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1v27 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v27 n GLY 8 N -1.61 5.04 2.91 -0.02 0.00 -1.26 -4.58 105.19 105.67 1v27 n GLY 8 Ca 0.00 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.19 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 4.12 0.12 0.00 1.61 -0.21 -0.79 -3.70 119.66 120.82 1v27 s GLN 9 Ca 0.00 -0.23 0.04 0.00 0.02 0.00 0.00 55.36 55.19 1v27 s GLN 9 Cb 0.00 0.04 -0.01 0.00 1.00 0.00 0.00 33.01 34.03 1v27 s GLN 9 CO 0.00 -0.02 -0.14 -1.17 -2.12 0.00 0.00 175.29 171.84 1v27 s LEU 10 N -0.56 2.06 -0.37 2.90 2.96 -1.09 -0.95 118.68 123.63 1v27 s LEU 10 Ca -0.06 -0.29 -0.10 0.00 -0.22 0.00 0.00 54.13 53.45 1v27 s LEU 10 Cb -0.04 -0.69 0.03 0.00 0.50 0.00 0.00 46.19 46.00 1v27 s LEU 10 CO -0.00 0.14 0.19 -0.44 -1.32 0.00 0.00 176.35 174.92 1v27 s SER 11 N -0.50 5.65 -0.16 3.68 0.01 -0.64 -1.34 113.70 120.40 1v27 s SER 11 Ca 0.05 -1.06 0.01 0.00 1.31 0.00 0.00 55.95 56.26 1v27 s SER 11 Cb -0.06 -1.99 0.01 0.00 0.21 0.00 0.00 66.02 64.19 1v27 s SER 11 CO -0.00 -0.38 -0.20 -0.63 0.41 0.00 0.00 173.24 172.44 1v27 s ILE 12 N 1.52 2.19 -0.33 1.44 1.01 -1.20 -1.04 121.20 124.78 1v27 s ILE 12 Ca 0.01 -0.92 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 1v27 s ILE 12 Cb -0.19 -1.90 -0.00 0.00 0.01 0.00 0.00 42.46 40.37 1v27 s ILE 12 CO 0.06 0.54 0.19 -0.75 0.00 0.00 0.00 174.94 174.97 1v27 s LYS 13 N 1.03 3.28 0.16 2.79 2.20 0.89 -3.97 119.74 126.12 1v27 s LYS 13 Ca -0.02 -0.77 0.05 0.00 -0.36 0.00 0.00 55.97 54.87 1v27 s LYS 13 Cb -0.14 -3.67 -0.04 0.00 -1.51 0.00 0.00 37.83 32.47 1v27 s LYS 13 CO -0.06 -0.48 0.15 -0.51 -0.36 0.00 0.00 175.35 174.09 1v27 s LEU 14 N 1.63 3.86 0.09 5.43 1.43 -1.26 0.14 118.68 130.00 1v27 s LEU 14 Ca 0.05 -0.09 -0.24 0.00 -1.03 0.00 0.00 54.13 52.82 1v27 s LEU 14 Cb -0.18 -2.47 0.06 0.00 0.03 0.00 0.00 46.19 43.63 1v27 s LEU 14 CO 0.08 0.07 0.57 0.86 0.23 0.00 0.00 176.35 178.16 1v27 s TRP 15 N -1.74 -0.50 -0.13 0.29 -0.11 0.30 -2.35 118.94 114.70 1v27 s TRP 15 Ca 0.31 0.47 0.01 0.00 1.22 0.00 0.00 56.10 58.11 1v27 s TRP 15 Cb -0.10 0.44 0.02 0.00 -1.50 0.00 0.00 33.47 32.33 1v27 s TRP 15 CO 0.24 -0.74 -0.16 0.12 -4.62 0.00 0.00 176.95 171.79 1v27 s PHE 16 N -2.95 2.23 -1.10 5.86 5.36 -1.26 0.19 117.98 126.30 1v27 s PHE 16 Ca -0.03 -1.16 -0.08 0.00 -0.96 0.00 0.00 56.93 54.70 1v27 s PHE 16 Cb -0.00 -1.59 0.28 0.00 -0.34 0.00 0.00 43.02 41.36 1v27 s PHE 16 CO -0.06 -0.60 1.09 -0.25 -1.46 0.00 0.00 175.22 173.95 1v27 n ASP 17 N 4.42 5.42 0.24 6.13 8.00 0.81 -4.82 116.55 136.75 1v27 n ASP 17 Ca -0.19 -3.05 0.15 0.00 0.71 0.00 0.00 54.79 52.41 1v27 n ASP 17 Cb 0.51 -1.35 0.79 0.00 -0.02 0.00 0.00 41.12 41.05 1v27 n ASP 17 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1v27 h LYS 18 N 6.58 0.00 0.57 -1.24 -0.00 -1.92 1.09 116.57 121.65 1v27 h LYS 18 Ca 0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.80 1v27 h LYS 18 Cb 0.86 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.09 1v27 h LYS 18 CO 1.01 0.00 -0.36 0.28 -0.00 0.00 0.00 179.45 180.38 1v27 h VAL 19 N 0.00 0.00 -0.38 0.07 2.07 -1.94 -3.21 116.25 112.86 1v27 h VAL 19 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1v27 h VAL 19 Cb 0.15 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1v27 h VAL 19 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 1v27 n GLY 20 N -1.45 1.78 3.24 2.17 0.00 -0.90 -4.98 105.19 105.05 1v27 n GLY 20 Ca -0.11 -0.62 -0.15 0.00 0.00 0.00 0.00 46.02 45.15 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 1.20 -2.35 -4.56 1.61 -0.00 0.37 -4.73 115.22 106.75 1v27 n HIS 21 Ca 0.17 0.85 -0.23 0.00 -0.00 0.00 0.00 57.72 58.51 1v27 n HIS 21 Cb 0.53 -4.28 -0.16 0.00 -0.00 0.00 0.00 29.99 26.08 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 -4.56 1.40 -0.20 -0.41 -0.21 -0.54 0.17 119.66 115.32 1v27 s GLN 22 Ca 0.36 -0.41 -0.24 0.00 0.02 0.00 0.00 55.36 55.08 1v27 s GLN 22 Cb -0.05 -1.22 -0.01 0.00 1.00 0.00 0.00 33.01 32.73 1v27 s GLN 22 CO 0.72 0.11 0.81 -1.17 -2.12 0.00 0.00 175.29 173.64 1v27 s LEU 23 N 0.34 4.14 -0.13 2.90 2.96 0.22 -0.13 118.68 128.97 1v27 s LEU 23 Ca -0.07 1.09 -0.12 0.00 -0.22 0.00 0.00 54.13 54.80 1v27 s LEU 23 Cb -0.12 -3.18 -0.05 0.00 0.50 0.00 0.00 46.19 43.35 1v27 s LEU 23 CO 0.02 -0.42 0.27 -0.63 -1.32 0.00 0.00 176.35 174.26 1v27 s ILE 24 N 2.36 5.31 -0.23 6.68 1.09 0.50 -0.08 121.20 136.82 1v27 s ILE 24 Ca 0.36 0.50 -0.03 0.00 -1.10 0.00 0.00 60.65 60.38 1v27 s ILE 24 Cb -0.16 -3.59 0.11 0.00 -1.06 0.00 0.00 42.46 37.76 1v27 s ILE 24 CO 0.10 0.47 0.24 0.54 -0.10 0.00 0.00 174.94 176.19 1v27 s VAL 25 N -0.07 -0.34 -0.17 2.92 0.11 0.12 0.11 120.40 123.07 1v27 s VAL 25 Ca 0.17 -0.24 -0.07 0.00 -2.93 0.00 0.00 61.98 58.91 1v27 s VAL 25 Cb -0.13 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.90 1v27 s VAL 25 CO 0.05 -0.29 0.05 -0.89 -3.33 0.00 0.00 175.10 170.68 1v27 s THR 26 N 2.33 4.67 -0.82 5.04 2.01 0.36 -1.20 115.64 128.03 1v27 s THR 26 Ca 0.08 -0.08 -0.17 0.00 0.31 0.00 0.00 61.69 61.82 1v27 s THR 26 Cb -0.15 -3.08 0.15 0.00 0.01 0.00 0.00 72.50 69.42 1v27 s THR 26 CO -0.19 0.48 0.93 -0.63 -0.69 0.00 0.00 174.62 174.52 1v27 s ILE 27 N 0.23 5.02 0.00 1.82 -1.09 -0.97 -0.08 121.20 126.13 1v27 s ILE 27 Ca 0.03 -1.72 0.00 0.00 -2.23 0.00 0.00 60.65 56.73 1v27 s ILE 27 Cb -0.12 -4.62 0.00 0.00 -1.58 0.00 0.00 42.46 36.13 1v27 s ILE 27 CO 0.01 -1.28 0.00 0.18 -1.23 0.00 0.00 174.94 172.62 1v27 n LEU 28 N 5.71 0.00 -3.45 2.97 4.77 -0.20 0.20 117.00 127.01 1v27 n LEU 28 Ca 0.13 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.99 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 0.47 0.00 0.45 -0.83 -1.33 0.00 0.00 177.39 176.15 1v27 s GLY 29 N 0.00 -0.59 0.55 -0.72 0.00 -1.21 0.20 107.32 105.55 1v27 s GLY 29 Ca 0.00 0.68 0.05 0.00 0.00 0.00 0.00 44.72 45.45 1v27 s GLY 29 CO 0.00 0.29 0.76 0.00 0.00 0.00 0.00 173.10 174.14 1v27 s ALA 30 N -3.33 4.22 0.16 3.20 0.00 -1.13 -1.61 121.76 123.26 1v27 s ALA 30 Ca 0.00 -1.67 -0.24 0.00 0.00 0.00 0.00 51.96 50.05 1v27 s ALA 30 Cb -0.01 -1.81 0.06 0.00 0.00 0.00 0.00 23.12 21.37 1v27 s ALA 30 CO -0.10 -0.76 0.83 -1.59 0.00 0.00 0.00 175.76 174.14 1v27 s LYS 31 N -4.69 1.29 -1.47 0.00 0.00 -0.13 -2.94 119.74 111.81 1v27 s LYS 31 Ca 0.59 -0.64 -0.11 0.00 0.00 0.00 0.00 55.97 55.81 1v27 s LYS 31 Cb -0.08 0.48 0.06 0.00 0.00 0.00 0.00 37.83 38.29 1v27 s LYS 31 CO 0.38 -0.58 0.83 -0.25 0.00 0.00 0.00 175.35 175.72 1v27 n ASP 32 N -0.41 -5.01 -4.83 0.03 8.00 -1.26 -1.88 116.55 111.20 1v27 n ASP 32 Ca -0.08 -0.57 -0.32 0.00 0.71 0.00 0.00 54.79 54.53 1v27 n ASP 32 Cb 0.61 -4.03 0.02 0.00 -0.02 0.00 0.00 41.12 37.70 1v27 n ASP 32 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1v27 s LEU 33 N -7.00 3.34 -0.40 0.64 1.43 -1.23 -4.28 118.68 111.17 1v27 s LEU 33 Ca 0.53 1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 54.98 1v27 s LEU 33 Cb -0.26 -4.50 0.01 0.00 0.03 0.00 0.00 46.19 41.46 1v27 s LEU 33 CO 0.66 -1.13 1.40 -2.16 0.23 0.00 0.00 176.35 175.35 1v27 s PRO 34 N -4.61 3.61 0.51 1.29 0.04 -1.26 -5.00 135.00 129.58 1v27 s PRO 34 Ca 0.59 0.98 0.06 0.00 0.04 0.00 0.00 61.00 62.67 1v27 s PRO 34 Cb -0.13 -4.01 0.06 0.00 0.04 0.00 0.00 34.50 30.45 1v27 s PRO 34 CO 0.45 -1.51 0.48 0.45 0.04 0.00 0.00 177.00 176.91 1v27 n SER 35 N 8.68 2.41 -4.08 6.66 2.88 -1.26 -4.97 113.62 123.93 1v27 n SER 35 Ca 0.16 -2.63 -0.21 0.00 -1.33 0.00 0.00 58.87 54.86 1v27 n SER 35 Cb 0.48 -0.14 -0.15 0.00 -0.75 0.00 0.00 64.21 63.65 1v27 n SER 35 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1v27 s ARG 36 N -4.16 1.00 0.00 -1.46 0.52 -1.25 -5.08 118.95 108.52 1v27 s ARG 36 Ca 0.36 -0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.13 1v27 s ARG 36 Cb -0.03 -0.97 0.00 0.00 0.52 0.00 0.00 34.95 34.47 1v27 s ARG 36 CO 0.23 0.27 0.25 0.39 0.02 0.00 0.00 175.30 176.46 1v27 n GLU 37 N 2.76 0.00 -1.93 3.54 1.02 -1.26 -3.75 120.64 121.02 1v27 n GLU 37 Ca -0.14 0.17 -0.28 0.00 -0.02 0.00 0.00 57.16 56.89 1v27 n GLU 37 Cb 0.56 -0.75 0.03 0.00 -0.02 0.00 0.00 31.44 31.26 1v27 n GLU 37 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1v27 n ASP 38 N -0.43 5.77 -1.82 1.62 5.68 -1.26 -4.61 116.55 121.50 1v27 n ASP 38 Ca 0.00 -3.76 -0.09 0.00 -0.50 0.00 0.00 54.79 50.43 1v27 n ASP 38 Cb 0.00 -0.57 0.07 0.00 -1.14 0.00 0.00 41.12 39.47 1v27 n ASP 38 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1v27 n GLY 39 N -0.70 4.62 1.38 6.12 0.00 -1.25 -5.10 105.19 110.25 1v27 n GLY 39 Ca 0.48 -1.85 0.12 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.66 -3.08 0.00 1.61 5.12 -1.26 -4.76 116.66 113.63 1v27 n ARG 40 Ca 0.27 2.49 0.00 0.00 -1.93 0.00 0.00 57.85 58.68 1v27 n ARG 40 Cb 0.89 -3.52 0.00 0.00 -1.16 0.00 0.00 32.46 28.67 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 -3.86 0.00 0.00 5.56 -0.04 -1.26 -3.94 135.00 131.46 1v27 n PRO 41 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1v27 n PRO 41 Cb 0.56 -0.07 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 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 -1.48 -3.89 0.54 1.85 -1.26 -4.65 116.66 107.78 1v27 n ARG 42 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.52 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 0.00 4.84 0.43 2.89 0.01 -1.26 -1.90 114.94 119.94 1v27 s ASN 43 Ca 0.00 -2.51 -0.23 0.00 -0.71 0.00 0.00 52.86 49.41 1v27 s ASN 43 Cb 0.00 -1.72 -0.09 0.00 0.41 0.00 0.00 41.25 39.85 1v27 s ASN 43 CO 0.00 -0.37 1.05 -2.16 -1.51 0.00 0.00 177.10 174.11 1v27 s PRO 44 N 0.43 4.05 -0.28 -0.60 0.04 -1.06 -0.77 135.00 136.81 1v27 s PRO 44 Ca 0.13 1.47 -0.20 0.00 0.04 0.00 0.00 61.00 62.44 1v27 s PRO 44 Cb -0.22 -2.41 0.09 0.00 0.04 0.00 0.00 34.50 32.01 1v27 s PRO 44 CO -0.04 -0.23 0.79 1.52 0.04 0.00 0.00 177.00 179.08 1v27 s TYR 45 N -1.75 -0.82 0.12 0.56 -0.85 -0.86 -2.29 117.35 111.46 1v27 s TYR 45 Ca 0.61 1.78 -0.03 0.00 -0.52 0.00 0.00 57.07 58.91 1v27 s TYR 45 Cb -0.20 0.44 -0.05 0.00 0.38 0.00 0.00 41.96 42.52 1v27 s TYR 45 CO 0.25 -0.40 0.32 0.08 -1.52 0.00 0.00 175.55 174.28 1v27 s VAL 46 N 0.98 5.25 -0.21 -3.49 1.01 -1.26 -2.26 120.40 120.42 1v27 s VAL 46 Ca -0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 1v27 s VAL 46 Cb -0.05 -3.63 0.07 0.00 0.00 0.00 0.00 36.38 32.77 1v27 s VAL 46 CO -0.10 0.06 0.05 -0.75 0.00 0.00 0.00 175.10 174.36 1v27 s LYS 47 N -2.65 0.61 0.24 2.72 2.20 0.44 -2.77 119.74 120.54 1v27 s LYS 47 Ca 0.39 -0.48 -0.09 0.00 -0.36 0.00 0.00 55.97 55.42 1v27 s LYS 47 Cb -0.12 -2.04 -0.07 0.00 -1.51 0.00 0.00 37.83 34.08 1v27 s LYS 47 CO 0.26 -0.70 0.56 0.42 -0.36 0.00 0.00 175.35 175.53 1v27 s ILE 48 N 1.86 4.94 -0.31 5.43 1.01 0.24 -0.50 121.20 133.87 1v27 s ILE 48 Ca 0.01 0.41 0.04 0.00 0.00 0.00 0.00 60.65 61.11 1v27 s ILE 48 Cb -0.17 -3.64 0.17 0.00 0.01 0.00 0.00 42.46 38.84 1v27 s ILE 48 CO -0.11 -0.12 0.48 -0.31 0.00 0.00 0.00 174.94 174.88 1v27 s TYR 49 N -1.87 -1.29 -0.22 3.97 1.51 -1.02 -1.89 117.35 116.53 1v27 s TYR 49 Ca 0.47 0.47 -0.29 0.00 -1.01 0.00 0.00 57.07 56.71 1v27 s TYR 49 Cb -0.11 0.02 -0.01 0.00 -0.11 0.00 0.00 41.96 41.74 1v27 s TYR 49 CO 0.23 -1.04 1.33 0.12 -1.11 0.00 0.00 175.55 175.08 1v27 s PHE 50 N 2.49 2.67 0.19 2.71 2.19 -1.26 -2.98 117.98 124.00 1v27 s PHE 50 Ca 0.11 0.87 0.04 0.00 0.33 0.00 0.00 56.93 58.28 1v27 s PHE 50 Cb -0.11 -3.74 -0.03 0.00 -1.31 0.00 0.00 43.02 37.83 1v27 s PHE 50 CO -0.25 -1.91 0.30 -0.51 1.83 0.00 0.00 175.22 174.68 1v27 s LEU 51 N 4.06 4.25 0.09 6.12 1.43 -1.15 -3.32 118.68 130.17 1v27 s LEU 51 Ca 0.58 0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 1v27 s LEU 51 Cb -0.20 -2.81 -0.06 0.00 0.03 0.00 0.00 46.19 43.14 1v27 s LEU 51 CO 0.20 -0.00 1.15 -2.16 0.23 0.00 0.00 176.35 175.77 1v27 s PRO 52 N -3.55 4.49 0.00 1.29 0.04 -1.26 -3.76 135.00 132.24 1v27 s PRO 52 Ca 0.34 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.11 1v27 s PRO 52 Cb -0.10 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.10 1v27 s PRO 52 CO 0.28 -0.15 0.00 -0.25 0.04 0.00 0.00 177.00 176.92 1v27 n ASP 53 N 3.49 0.00 -3.59 6.66 8.00 -1.21 -5.09 116.55 124.81 1v27 n ASP 53 Ca 0.07 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.30 1v27 n ASP 53 Cb 0.47 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.47 1v27 n ASP 53 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1v27 n ARG 54 N 0.00 2.26 -3.55 -1.24 1.74 -1.26 -4.29 116.66 110.32 1v27 n ARG 54 Ca 0.00 -4.59 -0.01 0.00 -0.77 0.00 0.00 57.85 52.48 1v27 n ARG 54 Cb 0.00 -2.26 0.02 0.00 -1.02 0.00 0.00 32.46 29.20 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 1.25 -1.30 -3.53 0.55 2.88 -1.26 -5.08 113.62 107.13 1v27 n SER 55 Ca 0.26 -1.57 -0.21 0.00 -1.33 0.00 0.00 58.87 56.03 1v27 n SER 55 Cb 0.39 2.09 0.19 0.00 -0.75 0.00 0.00 64.21 66.12 1v27 n SER 55 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1v27 n ASP 56 N -1.09 -3.27 0.00 -3.46 8.00 -1.26 -1.10 116.55 114.37 1v27 n ASP 56 Ca 0.00 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 55.00 1v27 n ASP 56 Cb 0.49 -0.84 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1v27 n ASP 56 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1v27 n LYS 57 N -2.83 0.00 0.18 -1.24 3.00 -1.26 -3.56 118.16 112.45 1v27 n LYS 57 Ca 0.08 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.45 1v27 n LYS 57 Cb 0.41 0.00 0.28 0.00 0.00 0.00 0.00 35.03 35.72 1v27 n LYS 57 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1v27 h ASN 58 N 0.00 0.00 -2.63 3.14 4.21 -1.93 -3.43 115.58 114.94 1v27 h ASN 58 Ca 0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 1v27 h ASN 58 Cb 0.00 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.19 1v27 h ASN 58 CO 0.00 0.36 1.09 -0.75 -1.29 0.00 0.00 177.43 176.84 1v27 s LYS 59 N -3.41 4.12 -0.19 0.81 2.36 -0.26 -4.08 119.74 119.08 1v27 s LYS 59 Ca 0.02 2.10 0.01 0.00 -2.55 0.00 0.00 55.97 55.54 1v27 s LYS 59 Cb 0.10 -3.99 0.04 0.00 -1.05 0.00 0.00 37.83 32.93 1v27 s LYS 59 CO 0.69 -0.91 -0.12 1.03 1.55 0.00 0.00 175.35 177.59 1v27 s ARG 60 N 4.11 2.17 -0.02 4.03 1.81 -0.79 -4.88 118.95 125.38 1v27 s ARG 60 Ca 0.73 -0.83 0.05 0.00 -1.72 0.00 0.00 55.73 53.96 1v27 s ARG 60 Cb -0.32 -2.41 -0.01 0.00 -0.45 0.00 0.00 34.95 31.76 1v27 s ARG 60 CO 0.29 -0.39 -0.18 0.50 -0.68 0.00 0.00 175.30 174.84 1v27 s ARG 61 N 1.38 1.62 0.64 3.54 3.00 -1.26 0.81 118.95 128.67 1v27 s ARG 61 Ca -0.00 -0.66 -0.10 0.00 -1.00 0.00 0.00 55.73 53.97 1v27 s ARG 61 Cb -0.16 -1.51 -0.01 0.00 0.00 0.00 0.00 34.95 33.28 1v27 s ARG 61 CO -0.09 0.36 1.02 0.95 0.00 0.00 0.00 175.30 177.54 1v27 s THR 62 N -0.30 4.06 0.49 4.11 -4.23 -1.12 -5.00 115.64 113.65 1v27 s THR 62 Ca 0.04 0.53 -0.23 0.00 -1.18 0.00 0.00 61.69 60.84 1v27 s THR 62 Cb -0.09 -3.64 -0.07 0.00 1.34 0.00 0.00 72.50 70.04 1v27 s THR 62 CO 0.00 -0.81 1.29 2.29 -0.54 0.00 0.00 174.62 176.85 1v27 n LYS 63 N -2.80 1.77 -2.68 3.99 2.85 -1.26 -4.67 118.16 115.36 1v27 n LYS 63 Ca 0.06 0.64 -0.43 0.00 -1.05 0.00 0.00 58.31 57.53 1v27 n LYS 63 Cb 0.56 -2.46 -0.02 0.00 -0.65 0.00 0.00 35.03 32.46 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 -1.26 4.62 -0.01 0.58 2.01 -1.26 -4.81 115.64 115.51 1v27 s THR 64 Ca 0.66 1.82 -0.21 0.00 0.31 0.00 0.00 61.69 64.28 1v27 s THR 64 Cb -0.46 -4.33 -0.05 0.00 0.01 0.00 0.00 72.50 67.66 1v27 s THR 64 CO 0.54 -0.31 0.61 -0.69 -0.69 0.00 0.00 174.62 174.07 1v27 s VAL 65 N 3.36 4.91 -0.01 3.82 1.01 -0.97 -5.01 120.40 127.51 1v27 s VAL 65 Ca 0.43 1.27 -0.01 0.00 0.00 0.00 0.00 61.98 63.67 1v27 s VAL 65 Cb -0.14 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1v27 s VAL 65 CO 0.11 0.41 0.09 -0.54 0.00 0.00 0.00 175.10 175.16 1v27 s LYS 66 N -0.14 3.11 0.00 2.72 1.02 -1.26 -2.57 119.74 122.61 1v27 s LYS 66 Ca 0.32 -0.46 0.00 0.00 0.02 0.00 0.00 55.97 55.85 1v27 s LYS 66 Cb -0.18 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.24 1v27 s LYS 66 CO 0.17 0.66 0.00 1.63 -0.92 0.00 0.00 175.35 176.89 1v27 n LYS 67 N 1.22 -0.30 0.00 1.68 4.01 -0.80 -4.96 118.16 119.00 1v27 n LYS 67 Ca -0.13 0.76 0.00 0.00 -0.51 0.00 0.00 58.31 58.43 1v27 n LYS 67 Cb 0.53 -0.93 0.00 0.00 -0.51 0.00 0.00 35.03 34.12 1v27 n LYS 67 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1v27 n THR 68 N 1.33 0.00 0.44 -0.18 5.66 -1.19 -4.98 114.28 115.35 1v27 n THR 68 Ca 0.00 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.12 1v27 n THR 68 Cb 0.46 0.00 0.18 0.00 -1.55 0.00 0.00 70.33 69.42 1v27 n THR 68 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1v27 h LEU 69 N 0.00 0.00 -6.77 1.09 3.38 -1.94 -3.41 115.31 107.66 1v27 h LEU 69 Ca 0.00 -0.10 -0.60 0.00 0.09 0.00 0.00 57.88 57.27 1v27 h LEU 69 Cb 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.36 1v27 h LEU 69 CO 0.00 0.05 -0.80 -1.61 0.09 0.00 0.00 178.44 176.17 1v27 s GLU 70 N -3.20 0.98 1.02 1.13 8.01 -1.26 -3.57 118.70 121.82 1v27 s GLU 70 Ca 0.06 -1.78 -0.17 0.00 0.01 0.00 0.00 54.97 53.09 1v27 s GLU 70 Cb 0.11 -1.86 0.25 0.00 -4.31 0.00 0.00 34.13 28.32 1v27 s GLU 70 CO 0.70 -1.20 1.13 -0.35 0.01 0.00 0.00 175.26 175.55 1v27 n PRO 71 N 3.64 -2.08 -2.76 0.39 -0.04 -1.15 -4.83 135.00 128.17 1v27 n PRO 71 Ca 0.12 -1.77 -0.01 0.00 -0.04 0.00 0.00 63.50 61.80 1v27 n PRO 71 Cb 0.37 -1.39 0.02 0.00 -0.04 0.00 0.00 33.50 32.45 1v27 n PRO 71 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1v27 s LYS 72 N -5.50 0.35 0.18 0.54 -2.85 -1.25 -2.83 119.74 108.37 1v27 s LYS 72 Ca 0.68 -0.26 0.09 0.00 -1.00 0.00 0.00 55.97 55.47 1v27 s LYS 72 Cb -0.04 0.00 0.01 0.00 -2.06 0.00 0.00 37.83 35.74 1v27 s LYS 72 CO 0.50 -0.46 1.41 -1.49 0.10 0.00 0.00 175.35 175.40 1v27 h TRP 73 N 4.94 0.00 -5.47 1.78 6.55 0.23 -3.46 115.95 120.52 1v27 h TRP 73 Ca -0.00 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.52 1v27 h TRP 73 Cb 1.18 0.00 -0.20 0.00 -0.86 0.00 0.00 29.16 29.29 1v27 h TRP 73 CO -0.05 0.84 -0.46 0.09 -1.05 0.00 0.00 178.44 177.82 1v27 n ASN 74 N -3.50 -1.18 -4.37 -3.49 3.02 0.54 -4.84 115.26 101.44 1v27 n ASN 74 Ca -0.00 -0.50 -0.28 0.00 -0.03 0.00 0.00 54.58 53.77 1v27 n ASN 74 Cb 0.82 -1.06 0.15 0.00 -0.61 0.00 0.00 39.78 39.08 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 -5.09 1.09 -0.00 3.52 -1.52 -1.07 -4.82 119.66 111.77 1v27 s GLN 75 Ca 0.42 -0.59 0.05 0.00 -1.95 0.00 0.00 55.36 53.29 1v27 s GLN 75 Cb -0.25 -2.01 -0.01 0.00 -0.22 0.00 0.00 33.01 30.52 1v27 s GLN 75 CO 0.52 -2.03 -0.15 0.99 -0.25 0.00 0.00 175.29 174.38 1v27 s THR 76 N -3.62 1.15 -0.13 -0.19 2.01 -1.26 -2.30 115.64 111.30 1v27 s THR 76 Ca 0.70 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 62.00 1v27 s THR 76 Cb -0.05 -0.96 0.05 0.00 0.01 0.00 0.00 72.50 71.55 1v27 s THR 76 CO 0.50 0.29 0.10 -0.36 -0.69 0.00 0.00 174.62 174.45 1v27 s PHE 77 N -0.40 0.09 0.02 4.92 0.08 -0.34 -4.96 117.98 117.40 1v27 s PHE 77 Ca 0.05 -0.05 -0.07 0.00 0.12 0.00 0.00 56.93 56.98 1v27 s PHE 77 Cb -0.06 -0.58 -0.05 0.00 -0.57 0.00 0.00 43.02 41.76 1v27 s PHE 77 CO -0.00 -0.41 0.29 0.42 -0.10 0.00 0.00 175.22 175.42 1v27 s ILE 78 N 2.17 5.26 -0.17 0.64 1.01 -1.26 -0.70 121.20 128.15 1v27 s ILE 78 Ca 0.03 0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.85 1v27 s ILE 78 Cb -0.15 -3.58 0.06 0.00 0.01 0.00 0.00 42.46 38.80 1v27 s ILE 78 CO -0.07 0.34 0.04 -0.31 0.00 0.00 0.00 174.94 174.94 1v27 s TYR 79 N -1.33 0.80 0.10 3.97 2.02 0.89 -4.91 117.35 118.90 1v27 s TYR 79 Ca 0.29 -0.65 -0.08 0.00 -0.37 0.00 0.00 57.07 56.26 1v27 s TYR 79 Cb -0.13 -0.93 -0.01 0.00 -0.40 0.00 0.00 41.96 40.49 1v27 s TYR 79 CO 0.17 -0.55 0.19 -1.54 -1.57 0.00 0.00 175.55 172.25 1v27 s SER 80 N 1.93 0.14 0.30 2.29 1.04 -1.26 0.70 113.70 118.83 1v27 s SER 80 Ca 0.00 -0.74 -0.29 0.00 0.48 0.00 0.00 55.95 55.41 1v27 s SER 80 Cb -0.16 0.35 -0.09 0.00 0.10 0.00 0.00 66.02 66.21 1v27 s SER 80 CO -0.08 -0.75 1.08 -2.16 0.98 0.00 0.00 173.24 172.30 1v27 s PRO 81 N -3.89 4.58 -0.14 4.02 0.04 -1.26 -5.07 135.00 133.28 1v27 s PRO 81 Ca 0.08 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 62.82 1v27 s PRO 81 Cb 0.05 -3.09 0.05 0.00 0.04 0.00 0.00 34.50 31.55 1v27 s PRO 81 CO -0.08 0.18 0.03 0.08 0.04 0.00 0.00 177.00 177.25 1v27 s VAL 82 N -1.25 0.36 0.33 -0.36 1.01 0.46 -4.99 120.40 115.96 1v27 s VAL 82 Ca 0.46 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.26 1v27 s VAL 82 Cb -0.30 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 1v27 s VAL 82 CO 0.38 -0.03 0.49 -1.00 0.00 0.00 0.00 175.10 174.94 1v27 s HIS 83 N 1.95 3.35 0.11 5.22 3.76 -1.26 -3.80 115.29 124.62 1v27 s HIS 83 Ca 0.02 0.09 -0.13 0.00 -0.15 0.00 0.00 55.06 54.89 1v27 s HIS 83 Cb -0.15 -1.89 -0.11 0.00 1.11 0.00 0.00 32.58 31.54 1v27 s HIS 83 CO -0.07 0.10 1.37 -0.09 -0.85 0.00 0.00 174.74 175.20 1v27 h ARG 84 N 0.85 0.80 0.00 1.40 9.65 -2.00 -2.64 114.38 122.44 1v27 h ARG 84 Ca -0.49 -0.54 0.00 0.00 -1.10 0.00 0.00 59.98 57.85 1v27 h ARG 84 Cb 1.24 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.89 1v27 h ARG 84 CO 0.59 1.17 0.00 2.89 2.80 0.00 0.00 179.97 187.41 1v27 n ARG 85 N -4.06 0.20 0.05 0.20 1.85 -1.26 -1.63 116.66 112.01 1v27 n ARG 85 Ca -0.05 0.14 0.11 0.00 -1.00 0.00 0.00 57.85 57.05 1v27 n ARG 85 Cb 0.63 -1.50 0.04 0.00 -1.05 0.00 0.00 32.46 30.57 1v27 n ARG 85 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1v27 n GLU 86 N -1.32 0.37 -0.08 2.89 -0.58 -1.00 -4.05 120.64 116.87 1v27 n GLU 86 Ca 0.07 0.03 0.12 0.00 -0.42 0.00 0.00 57.16 56.96 1v27 n GLU 86 Cb 0.15 -1.65 0.50 0.00 -0.57 0.00 0.00 31.44 29.87 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 0.00 0.43 -0.19 -0.32 -1.00 -1.24 0.60 116.94 115.21 1v27 h PHE 87 Ca 0.00 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1v27 h PHE 87 Cb 0.80 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.22 1v27 h PHE 87 CO 0.00 0.20 0.00 2.89 -1.61 0.00 0.00 178.31 179.79 1v27 n ARG 88 N -4.47 1.75 -0.05 1.51 1.85 -1.26 -2.44 116.66 113.56 1v27 n ARG 88 Ca 0.10 -1.13 -0.02 0.00 -1.00 0.00 0.00 57.85 55.80 1v27 n ARG 88 Cb 0.38 -1.38 -0.12 0.00 -1.05 0.00 0.00 32.46 30.28 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 0.36 1.14 -4.28 2.89 1.02 0.20 -5.03 120.64 116.94 1v27 n GLU 89 Ca 0.16 -0.06 -0.17 0.00 -0.02 0.00 0.00 57.16 57.07 1v27 n GLU 89 Cb 0.33 -1.39 -0.09 0.00 -0.02 0.00 0.00 31.44 30.27 1v27 n GLU 89 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1v27 s ARG 90 N -2.66 1.53 0.05 3.49 1.70 -0.35 -4.94 118.95 117.78 1v27 s ARG 90 Ca -0.07 -1.87 -0.16 0.00 -0.47 0.00 0.00 55.73 53.17 1v27 s ARG 90 Cb 0.07 0.15 0.03 0.00 -0.57 0.00 0.00 34.95 34.63 1v27 s ARG 90 CO 0.64 -0.50 0.36 1.41 -1.08 0.00 0.00 175.30 176.13 1v27 s MET 91 N -3.79 0.89 0.28 3.89 -2.45 -1.25 -4.26 119.30 112.61 1v27 s MET 91 Ca 0.38 -0.48 -0.05 0.00 -1.25 0.00 0.00 55.69 54.29 1v27 s MET 91 Cb 0.05 0.39 -0.05 0.00 1.25 0.00 0.00 34.83 36.46 1v27 s MET 91 CO 0.19 -0.30 0.55 -0.51 1.05 0.00 0.00 175.02 176.00 1v27 s LEU 92 N -2.15 4.07 -0.31 4.11 2.01 -0.58 -2.94 118.68 122.88 1v27 s LEU 92 Ca -0.04 0.72 -0.02 0.00 0.01 0.00 0.00 54.13 54.80 1v27 s LEU 92 Cb -0.00 -3.53 0.12 0.00 0.01 0.00 0.00 46.19 42.79 1v27 s LEU 92 CO -0.04 -0.18 0.19 -0.70 1.01 0.00 0.00 176.35 176.62 1v27 s GLU 93 N -3.49 0.35 0.23 1.70 2.12 -1.16 -2.64 118.70 115.82 1v27 s GLU 93 Ca 0.44 -0.77 -0.10 0.00 0.36 0.00 0.00 54.97 54.90 1v27 s GLU 93 Cb -0.11 -1.12 -0.07 0.00 0.26 0.00 0.00 34.13 33.09 1v27 s GLU 93 CO 0.29 -1.10 0.55 0.42 -0.54 0.00 0.00 175.26 174.89 1v27 s ILE 94 N 1.75 4.93 -0.00 -3.70 1.09 -0.57 -2.43 121.20 122.27 1v27 s ILE 94 Ca 0.13 0.47 -0.01 0.00 -1.10 0.00 0.00 60.65 60.13 1v27 s ILE 94 Cb -0.18 -3.62 -0.00 0.00 -1.06 0.00 0.00 42.46 37.59 1v27 s ILE 94 CO -0.22 -0.08 0.02 0.42 -0.10 0.00 0.00 174.94 174.98 1v27 s THR 95 N -1.83 0.04 -0.02 2.92 -4.23 0.35 -0.38 115.64 112.49 1v27 s THR 95 Ca 0.47 -0.36 0.03 0.00 -1.18 0.00 0.00 61.69 60.65 1v27 s THR 95 Cb -0.11 -0.16 -0.00 0.00 1.34 0.00 0.00 72.50 73.57 1v27 s THR 95 CO 0.21 -0.20 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.77 1v27 s LEU 96 N -0.60 1.89 0.37 4.79 2.96 -0.64 0.17 118.68 127.61 1v27 s LEU 96 Ca -0.07 -0.21 -0.07 0.00 -0.22 0.00 0.00 54.13 53.57 1v27 s LEU 96 Cb -0.04 -0.60 0.03 0.00 0.50 0.00 0.00 46.19 46.07 1v27 s LEU 96 CO -0.00 0.10 0.61 0.26 -1.32 0.00 0.00 176.35 175.99 1v27 s TRP 97 N 0.01 0.75 -0.20 5.38 0.52 -0.96 -1.70 118.94 122.74 1v27 s TRP 97 Ca -0.00 -1.15 0.01 0.00 0.02 0.00 0.00 56.10 54.98 1v27 s TRP 97 Cb -0.07 0.27 0.03 0.00 -1.15 0.00 0.00 33.47 32.55 1v27 s TRP 97 CO 0.00 -1.33 -0.16 0.34 0.02 0.00 0.00 176.95 175.82 1v27 s ASP 98 N -3.19 3.42 -0.84 2.95 2.15 -1.26 -2.03 116.67 117.87 1v27 s ASP 98 Ca 0.25 -0.83 -0.22 0.00 0.43 0.00 0.00 52.55 52.18 1v27 s ASP 98 Cb -0.02 -1.44 -0.19 0.00 -0.30 0.00 0.00 42.92 40.97 1v27 s ASP 98 CO 0.18 -0.06 2.23 1.67 -0.17 0.00 0.00 175.17 179.01 1v27 n GLN 99 N 4.60 0.33 0.00 4.34 7.27 0.05 -4.64 117.38 129.34 1v27 n GLN 99 Ca -0.18 -0.82 0.00 0.00 0.07 0.00 0.00 57.00 56.07 1v27 n GLN 99 Cb 0.48 -3.10 0.00 0.00 2.41 0.00 0.00 30.24 30.03 1v27 n GLN 99 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1v27 n ALA 100 N 15.79 0.00 -1.64 1.69 0.00 -1.26 -4.56 120.51 130.52 1v27 n ALA 100 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1v27 n ALA 100 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1v27 n ALA 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1v27 n ARG 101 N -0.26 1.51 -4.41 0.00 5.12 -1.26 -5.09 116.66 112.28 1v27 n ARG 101 Ca 0.00 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.72 1v27 n ARG 101 Cb 0.00 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.20 1v27 n ARG 101 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1v27 s VAL 102 N 0.67 1.44 -1.72 1.55 -7.23 -1.26 -4.73 120.40 109.12 1v27 s VAL 102 Ca 0.00 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 1v27 s VAL 102 Cb 0.00 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.48 1v27 s VAL 102 CO 0.00 -0.28 0.00 0.54 -0.31 0.00 0.00 175.10 175.05 1v27 n ARG 103 N -0.55 -1.33 -2.94 4.82 1.74 -1.26 -3.99 116.66 113.15 1v27 n ARG 103 Ca -0.05 1.00 -0.01 0.00 -0.77 0.00 0.00 57.85 58.02 1v27 n ARG 103 Cb 0.64 -5.37 -0.01 0.00 -1.02 0.00 0.00 32.46 26.70 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 -2.59 -2.20 0.00 5.56 4.71 -1.26 -4.98 120.64 119.87 1v27 n GLU 104 Ca -0.19 1.91 0.00 0.00 -0.01 0.00 0.00 57.16 58.87 1v27 n GLU 104 Cb 0.62 -2.58 0.00 0.00 -1.01 0.00 0.00 31.44 28.47 1v27 n GLU 104 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1v27 n GLU 105 N 1.78 0.00 -4.47 3.49 1.02 -1.26 -5.08 120.64 116.12 1v27 n GLU 105 Ca -0.11 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.76 1v27 n GLU 105 Cb 0.28 -0.14 -0.17 0.00 -0.02 0.00 0.00 31.44 31.39 1v27 n GLU 105 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1v27 s GLU 106 N -1.76 2.12 -0.02 3.49 0.41 -1.26 -5.09 118.70 116.58 1v27 s GLU 106 Ca 0.00 -0.53 0.01 0.00 -0.41 0.00 0.00 54.97 54.04 1v27 s GLU 106 Cb 0.00 -1.80 0.02 0.00 -1.78 0.00 0.00 34.13 30.56 1v27 s GLU 106 CO 0.00 -0.05 -0.02 -1.54 -0.49 0.00 0.00 175.26 173.16 1v27 s SER 107 N 0.95 0.52 0.01 -0.19 1.04 -1.26 -4.04 113.70 110.74 1v27 s SER 107 Ca -0.08 -0.06 0.25 0.00 0.48 0.00 0.00 55.95 56.54 1v27 s SER 107 Cb -0.15 -0.21 0.48 0.00 0.10 0.00 0.00 66.02 66.23 1v27 s SER 107 CO -0.01 -0.05 1.39 -1.84 0.98 0.00 0.00 173.24 173.72 1v27 n GLU 108 N 3.77 0.03 -2.57 4.02 0.28 -1.26 -5.00 120.64 119.91 1v27 n GLU 108 Ca -0.23 0.01 -0.14 0.00 -0.16 0.00 0.00 57.16 56.64 1v27 n GLU 108 Cb 0.53 -1.52 0.01 0.00 1.43 0.00 0.00 31.44 31.90 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 -1.56 -0.98 0.16 -1.84 7.35 -1.26 -4.70 117.46 114.63 1v27 n PHE 109 Ca 0.05 0.41 0.18 0.00 -0.76 0.00 0.00 57.45 57.34 1v27 n PHE 109 Cb 0.35 -0.96 0.80 0.00 0.35 0.00 0.00 39.48 40.01 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 2.10 0.00 0.00 -2.13 3.38 -1.66 -3.46 115.31 113.54 1v27 h LEU 110 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1v27 h LEU 110 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1v27 h LEU 110 CO 0.08 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1v27 n GLY 111 N -1.43 4.46 3.67 0.83 0.00 -1.10 -4.03 105.19 107.59 1v27 n GLY 111 Ca 0.04 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 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 -3.48 2.71 -0.37 1.61 -1.05 -1.11 -1.62 118.70 115.39 1v27 s GLU 112 Ca 0.00 -0.67 -0.00 0.00 -0.15 0.00 0.00 54.97 54.15 1v27 s GLU 112 Cb 0.00 -2.62 0.10 0.00 -0.44 0.00 0.00 34.13 31.17 1v27 s GLU 112 CO 0.00 0.61 0.12 0.42 0.95 0.00 0.00 175.26 177.35 1v27 s ILE 113 N -1.11 2.86 0.14 1.83 1.01 0.49 -3.46 121.20 122.95 1v27 s ILE 113 Ca 0.20 -2.07 -0.10 0.00 0.00 0.00 0.00 60.65 58.68 1v27 s ILE 113 Cb -0.11 -2.96 -0.06 0.00 0.01 0.00 0.00 42.46 39.33 1v27 s ILE 113 CO 0.11 -0.57 0.46 -0.76 0.00 0.00 0.00 174.94 174.18 1v27 s LEU 114 N 1.07 4.29 -0.04 2.97 1.02 -1.26 -1.51 118.68 125.21 1v27 s LEU 114 Ca 0.07 0.85 -0.03 0.00 0.02 0.00 0.00 54.13 55.04 1v27 s LEU 114 Cb -0.21 -3.26 0.02 0.00 0.02 0.00 0.00 46.19 42.76 1v27 s LEU 114 CO -0.05 0.08 0.10 -0.63 0.02 0.00 0.00 176.35 175.87 1v27 s ILE 115 N -1.56 -0.03 -0.48 -0.59 1.09 -1.08 -4.97 121.20 113.58 1v27 s ILE 115 Ca 0.39 0.10 -0.18 0.00 -1.10 0.00 0.00 60.65 59.86 1v27 s ILE 115 Cb -0.13 -0.16 0.06 0.00 -1.06 0.00 0.00 42.46 41.16 1v27 s ILE 115 CO 0.20 0.04 0.54 -1.61 -0.10 0.00 0.00 174.94 174.02 1v27 s GLU 116 N 0.61 3.09 0.51 2.79 2.02 -1.26 -1.52 118.70 124.94 1v27 s GLU 116 Ca -0.05 -0.97 0.42 0.00 0.02 0.00 0.00 54.97 54.39 1v27 s GLU 116 Cb -0.06 -4.09 1.61 0.00 0.10 0.00 0.00 34.13 31.69 1v27 s GLU 116 CO -0.03 -1.12 1.61 -0.07 0.02 0.00 0.00 175.26 175.68 1v27 h LEU 117 N 9.38 0.09 0.30 1.80 3.38 -1.74 1.14 115.31 129.65 1v27 h LEU 117 Ca -0.28 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1v27 h LEU 117 Cb 1.10 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1v27 h LEU 117 CO 0.92 -0.08 -0.21 -0.08 0.09 0.00 0.00 178.44 179.07 1v27 h GLU 118 N 0.02 -0.49 -0.62 1.13 4.81 -1.74 -2.63 114.58 115.07 1v27 h GLU 118 Ca 0.87 0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 60.01 1v27 h GLU 118 Cb 3.21 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 32.63 1v27 h GLU 118 CO -0.17 -0.33 0.14 0.25 -0.73 0.00 0.00 179.01 178.17 1v27 n THR 119 N -5.34 2.80 -2.49 0.32 -2.24 0.32 -4.96 114.28 102.69 1v27 n THR 119 Ca -0.09 -1.64 -0.42 0.00 -2.27 0.00 0.00 64.05 59.63 1v27 n THR 119 Cb 0.25 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.13 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 -2.92 3.36 -0.95 6.98 0.00 0.28 -4.84 121.76 123.67 1v27 s ALA 120 Ca 0.53 0.80 -0.16 0.00 0.00 0.00 0.00 51.96 53.13 1v27 s ALA 120 Cb 0.42 -3.39 0.17 0.00 0.00 0.00 0.00 23.12 20.32 1v27 s ALA 120 CO 0.13 -0.32 1.05 -0.48 0.00 0.00 0.00 175.76 176.15 1v27 s LEU 121 N 0.45 5.68 -0.23 0.00 0.05 -1.26 -4.97 118.68 118.40 1v27 s LEU 121 Ca 0.54 -2.48 -0.21 0.00 0.05 0.00 0.00 54.13 52.03 1v27 s LEU 121 Cb -0.29 -2.33 -0.02 0.00 -2.05 0.00 0.00 46.19 41.51 1v27 s LEU 121 CO 0.31 -0.81 0.63 -0.76 -0.55 0.00 0.00 176.35 175.18 1v27 s LEU 122 N 1.46 4.10 -0.06 1.48 1.43 -1.26 -4.76 118.68 121.07 1v27 s LEU 122 Ca 0.29 0.78 0.02 0.00 -1.03 0.00 0.00 54.13 54.19 1v27 s LEU 122 Cb -0.07 -2.88 0.07 0.00 0.03 0.00 0.00 46.19 43.34 1v27 s LEU 122 CO -0.08 -0.33 0.59 -0.67 0.23 0.00 0.00 176.35 176.10 1v27 n ASP 123 N 5.39 -0.43 -3.58 2.29 -0.08 -1.20 -4.86 116.55 114.09 1v27 n ASP 123 Ca -0.01 -1.04 -0.24 0.00 -1.51 0.00 0.00 54.79 51.99 1v27 n ASP 123 Cb 0.49 0.17 -0.04 0.00 2.34 0.00 0.00 41.12 44.08 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 -0.26 -1.42 -4.46 1.67 2.03 -0.99 -4.86 116.55 108.25 1v27 n ASP 124 Ca -0.08 -0.48 -0.34 0.00 0.52 0.00 0.00 54.79 54.41 1v27 n ASP 124 Cb 0.51 -1.30 -0.13 0.00 -0.72 0.00 0.00 41.12 39.49 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 -6.09 3.61 -0.10 -0.67 2.02 -1.26 -4.99 118.70 111.22 1v27 s GLU 125 Ca 0.46 -0.55 -0.30 0.00 0.02 0.00 0.00 54.97 54.60 1v27 s GLU 125 Cb -0.27 -2.89 -0.03 0.00 0.10 0.00 0.00 34.13 31.04 1v27 s GLU 125 CO 0.56 0.19 1.24 -1.25 0.02 0.00 0.00 175.26 176.03 1v27 s PRO 126 N 0.48 4.29 -0.05 0.39 0.04 -1.26 -4.50 135.00 134.40 1v27 s PRO 126 Ca -0.04 1.69 0.04 0.00 0.04 0.00 0.00 61.00 62.73 1v27 s PRO 126 Cb -0.14 -3.65 -0.00 0.00 0.04 0.00 0.00 34.50 30.74 1v27 s PRO 126 CO 0.03 -0.57 -0.17 -1.01 0.04 0.00 0.00 177.00 175.31 1v27 s HIS 127 N 2.80 1.75 -0.57 0.56 3.76 -1.25 -5.02 115.29 117.32 1v27 s HIS 127 Ca 0.56 -0.51 -0.24 0.00 -0.15 0.00 0.00 55.06 54.71 1v27 s HIS 127 Cb -0.24 -1.18 0.04 0.00 1.11 0.00 0.00 32.58 32.32 1v27 s HIS 127 CO 0.19 -0.18 0.97 -1.58 -0.85 0.00 0.00 174.74 173.29 1v27 s TRP 128 N 0.06 2.76 -0.17 1.40 0.52 -1.26 -3.26 118.94 118.98 1v27 s TRP 128 Ca -0.05 -0.04 -0.15 0.00 0.02 0.00 0.00 56.10 55.89 1v27 s TRP 128 Cb -0.12 -4.13 -0.04 0.00 -1.15 0.00 0.00 33.47 28.02 1v27 s TRP 128 CO 0.02 -1.41 0.33 0.71 0.02 0.00 0.00 176.95 176.62 1v27 s TYR 129 N 4.06 3.43 0.25 -1.98 2.02 -0.45 -4.91 117.35 119.77 1v27 s TYR 129 Ca 0.31 0.60 -0.30 0.00 -0.37 0.00 0.00 57.07 57.31 1v27 s TYR 129 Cb -0.12 -2.41 -0.09 0.00 -0.40 0.00 0.00 41.96 38.94 1v27 s TYR 129 CO 0.19 0.15 1.09 0.15 -1.57 0.00 0.00 175.55 175.55 1v27 s LYS 130 N 0.77 4.65 0.45 -0.62 1.02 -1.26 -2.69 119.74 122.06 1v27 s LYS 130 Ca 0.17 1.76 -0.10 0.00 0.02 0.00 0.00 55.97 57.83 1v27 s LYS 130 Cb -0.14 -3.22 -0.06 0.00 -0.52 0.00 0.00 37.83 33.90 1v27 s LYS 130 CO 0.06 0.20 0.81 -0.51 -0.92 0.00 0.00 175.35 174.99 1v27 s LEU 131 N -1.18 3.72 0.02 3.17 1.43 -1.24 -4.87 118.68 119.73 1v27 s LEU 131 Ca 0.45 1.15 0.06 0.00 -1.03 0.00 0.00 54.13 54.76 1v27 s LEU 131 Cb -0.31 -4.06 -0.02 0.00 0.03 0.00 0.00 46.19 41.83 1v27 s LEU 131 CO 0.39 -0.49 -0.17 0.00 0.23 0.00 0.00 176.35 176.31 1v27 s GLN 132 N -4.17 1.21 -0.59 1.70 -2.07 -1.22 -4.89 119.66 109.63 1v27 s GLN 132 Ca 0.51 -0.76 0.06 0.00 -1.82 0.00 0.00 55.36 53.35 1v27 s GLN 132 Cb -0.10 -1.24 0.20 0.00 -1.09 0.00 0.00 33.01 30.78 1v27 s GLN 132 CO 0.36 0.32 0.54 0.25 -1.32 0.00 0.00 175.29 175.45 1v27 n THR 133 N 2.15 0.99 -3.15 3.63 -2.24 -1.26 -2.76 114.28 111.64 1v27 n THR 133 Ca -0.17 -4.58 0.05 0.00 -2.27 0.00 0.00 64.05 57.08 1v27 n THR 133 Cb 0.54 -2.03 -0.00 0.00 -2.10 0.00 0.00 70.33 66.74 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 -1.44 -1.22 -0.29 4.78 5.65 -1.26 -5.13 115.29 116.37 1v27 s HIS 134 Ca 0.32 0.82 -0.14 0.00 0.25 0.00 0.00 55.06 56.32 1v27 s HIS 134 Cb 0.06 0.25 0.12 0.00 -1.18 0.00 0.00 32.58 31.83 1v27 s HIS 134 CO -0.12 -0.70 0.76 0.34 -0.65 0.00 0.00 174.74 174.36 1v27 s ASP 135 N 2.89 -0.91 0.13 9.88 2.15 -1.26 -5.15 116.67 124.40 1v27 s ASP 135 Ca 0.16 1.33 0.11 0.00 0.43 0.00 0.00 52.55 54.58 1v27 s ASP 135 Cb -0.08 1.76 -0.04 0.00 -0.30 0.00 0.00 42.92 44.26 1v27 s ASP 135 CO -0.23 -0.20 -0.26 -0.55 -0.17 0.00 0.00 175.17 173.76 1v27 s SER 136 N 2.20 3.21 0.29 -0.34 0.15 -1.26 -5.06 113.70 112.89 1v27 s SER 136 Ca -0.07 -0.74 -0.19 0.00 0.70 0.00 0.00 55.95 55.64 1v27 s SER 136 Cb -0.08 -0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.04 1v27 s SER 136 CO -0.19 0.16 0.70 -0.83 1.20 0.00 0.00 173.24 174.29 1v27 s GLY 137 N -2.03 0.03 -1.19 9.45 0.00 -1.26 -5.05 107.32 107.28 1v27 s GLY 137 Ca 0.13 -0.42 -0.10 0.00 0.00 0.00 0.00 44.72 44.33 1v27 s GLY 137 CO 0.06 -0.18 2.38 -1.55 0.00 0.00 0.00 173.10 173.81 1v27 n PRO 138 N -0.46 2.63 0.21 2.90 -0.04 -1.26 -3.32 135.00 135.66 1v27 n PRO 138 Ca -0.04 -1.88 0.00 0.00 -0.04 0.00 0.00 63.50 61.54 1v27 n PRO 138 Cb 0.59 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 1v27 n PRO 138 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1v27 n SER 139 N 4.63 -3.75 0.00 3.54 7.64 -1.26 -5.04 113.62 119.38 1v27 n SER 139 Ca 0.57 0.83 0.00 0.00 1.01 0.00 0.00 58.87 61.29 1v27 n SER 139 Cb 0.23 3.53 0.00 0.00 -1.01 0.00 0.00 64.21 66.96 1v27 n SER 139 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1v27 n SER 140 N -3.36 0.00 0.00 6.43 2.88 -1.21 -5.27 113.62 113.09 1v27 n SER 140 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1v27 n SER 140 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1v27 n SER 140 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42