#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 -3.55 0.00 1.61 3.41 -1.26 -4.90 113.62 108.93 1v27 n SER 2 Ca 0.00 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1v27 n SER 2 Cb 0.00 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 1v27 n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1v27 n SER 3 N 0.87 0.00 -1.50 4.04 7.64 -1.26 -5.17 113.62 118.24 1v27 n SER 3 Ca 0.02 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.02 1v27 n SER 3 Cb 0.59 0.35 -0.07 0.00 -1.01 0.00 0.00 64.21 64.07 1v27 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v27 n GLY 4 N -1.36 -3.52 3.83 0.23 0.00 -1.26 -4.99 105.19 98.12 1v27 n GLY 4 Ca 0.00 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.83 1v27 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v27 s SER 5 N -6.80 4.69 -0.30 1.61 1.04 -1.26 -4.99 113.70 107.70 1v27 s SER 5 Ca 0.00 -1.02 -0.21 0.00 0.48 0.00 0.00 55.95 55.20 1v27 s SER 5 Cb 0.00 -0.25 0.19 0.00 0.10 0.00 0.00 66.02 66.06 1v27 s SER 5 CO 0.00 -0.74 1.31 -0.55 0.98 0.00 0.00 173.24 174.24 1v27 s SER 6 N -4.09 -0.13 0.27 7.02 0.15 -1.26 -5.04 113.70 110.63 1v27 s SER 6 Ca 0.41 0.22 0.02 0.00 0.70 0.00 0.00 55.95 57.30 1v27 s SER 6 Cb -0.00 0.57 -0.01 0.00 -1.71 0.00 0.00 66.02 64.87 1v27 s SER 6 CO 0.24 -0.04 0.31 0.61 1.20 0.00 0.00 173.24 175.56 1v27 n GLY 7 N 2.32 2.73 0.00 9.45 0.00 -1.22 -4.33 105.19 114.13 1v27 n GLY 7 Ca -0.13 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.48 1.80 2.95 -0.02 0.00 -1.25 -4.86 105.19 103.34 1v27 n GLY 8 Ca 0.03 0.08 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 2.02 0.10 0.03 1.61 -0.21 -1.04 -3.14 119.66 119.03 1v27 s GLN 9 Ca 0.00 0.07 0.07 0.00 0.02 0.00 0.00 55.36 55.52 1v27 s GLN 9 Cb 0.00 0.05 -0.02 0.00 1.00 0.00 0.00 33.01 34.03 1v27 s GLN 9 CO 0.00 -0.01 -0.21 -1.17 -2.12 0.00 0.00 175.29 171.78 1v27 s LEU 10 N -0.04 2.14 -0.27 2.90 0.20 -0.04 -1.46 118.68 122.10 1v27 s LEU 10 Ca -0.01 -0.49 -0.04 0.00 0.69 0.00 0.00 54.13 54.28 1v27 s LEU 10 Cb -0.01 -1.01 0.02 0.00 -0.43 0.00 0.00 46.19 44.76 1v27 s LEU 10 CO 0.00 0.18 0.00 -0.44 -0.29 0.00 0.00 176.35 175.81 1v27 s SER 11 N -1.04 4.69 -0.09 3.68 0.01 -0.44 0.12 113.70 120.63 1v27 s SER 11 Ca 0.08 -0.82 0.02 0.00 1.31 0.00 0.00 55.95 56.54 1v27 s SER 11 Cb -0.09 -1.76 0.01 0.00 0.21 0.00 0.00 66.02 64.40 1v27 s SER 11 CO 0.01 -0.16 -0.16 -0.63 0.41 0.00 0.00 173.24 172.72 1v27 s ILE 12 N 1.40 1.46 -0.32 1.44 1.01 -1.19 -1.82 121.20 123.19 1v27 s ILE 12 Ca 0.01 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.92 1v27 s ILE 12 Cb -0.17 -1.32 -0.00 0.00 0.01 0.00 0.00 42.46 40.98 1v27 s ILE 12 CO -0.01 0.43 0.15 -0.75 0.00 0.00 0.00 174.94 174.75 1v27 s LYS 13 N 0.72 3.23 0.14 2.79 2.20 0.95 -3.89 119.74 125.89 1v27 s LYS 13 Ca -0.12 -0.79 0.06 0.00 -0.36 0.00 0.00 55.97 54.76 1v27 s LYS 13 Cb -0.16 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 1v27 s LYS 13 CO 0.03 -0.46 0.05 -0.51 -0.36 0.00 0.00 175.35 174.11 1v27 s LEU 14 N 1.59 3.56 -0.00 5.43 1.43 -1.26 0.19 118.68 129.62 1v27 s LEU 14 Ca 0.04 -0.22 -0.27 0.00 -1.03 0.00 0.00 54.13 52.65 1v27 s LEU 14 Cb -0.17 -2.22 0.06 0.00 0.03 0.00 0.00 46.19 43.89 1v27 s LEU 14 CO 0.06 0.11 0.60 0.86 0.23 0.00 0.00 176.35 178.21 1v27 s TRP 15 N -1.61 -0.55 -0.17 0.29 -0.11 0.25 -2.47 118.94 114.56 1v27 s TRP 15 Ca 0.28 0.82 0.01 0.00 1.22 0.00 0.00 56.10 58.43 1v27 s TRP 15 Cb -0.10 0.38 0.02 0.00 -1.50 0.00 0.00 33.47 32.27 1v27 s TRP 15 CO 0.21 -0.63 -0.19 0.12 -4.62 0.00 0.00 176.95 171.84 1v27 s PHE 16 N -1.77 2.65 -0.84 5.86 5.36 -1.26 0.21 117.98 128.18 1v27 s PHE 16 Ca -0.09 -1.56 -0.16 0.00 -0.96 0.00 0.00 56.93 54.16 1v27 s PHE 16 Cb -0.01 -1.85 0.17 0.00 -0.34 0.00 0.00 43.02 41.00 1v27 s PHE 16 CO 0.04 -0.78 0.90 0.34 -1.46 0.00 0.00 175.22 174.26 1v27 s ASP 17 N 1.33 6.65 0.61 6.13 2.15 0.17 -4.84 116.67 128.87 1v27 s ASP 17 Ca 0.05 -2.31 0.39 0.00 0.43 0.00 0.00 52.55 51.11 1v27 s ASP 17 Cb -0.13 -2.29 1.90 0.00 -0.30 0.00 0.00 42.92 42.10 1v27 s ASP 17 CO -0.12 -0.82 2.18 0.07 -0.17 0.00 0.00 175.17 176.31 1v27 h LYS 18 N 8.34 0.00 0.00 4.34 -0.00 -1.94 1.13 116.57 128.44 1v27 h LYS 18 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.73 1v27 h LYS 18 Cb 1.04 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.27 1v27 h LYS 18 CO 0.93 0.00 0.00 0.28 -0.00 0.00 0.00 179.45 180.66 1v27 n VAL 19 N -3.08 0.00 0.70 0.07 0.31 -1.26 -3.37 118.33 111.70 1v27 n VAL 19 Ca -0.01 1.45 0.12 0.00 -0.01 0.00 0.00 64.34 65.89 1v27 n VAL 19 Cb 0.19 -2.32 0.23 0.00 -0.91 0.00 0.00 33.84 31.03 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 -0.96 1.22 2.93 2.92 0.00 -1.19 -4.96 105.19 105.15 1v27 n GLY 20 Ca 0.00 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.88 -5.24 1.61 -0.00 0.37 -4.69 115.22 106.59 1v27 n HIS 21 Ca 0.18 0.72 -0.32 0.00 -0.00 0.00 0.00 57.72 58.30 1v27 n HIS 21 Cb 0.55 -4.15 -0.16 0.00 -0.00 0.00 0.00 29.99 26.23 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 -4.60 2.59 -0.27 -0.41 -0.21 0.32 0.21 119.66 117.29 1v27 s GLN 22 Ca 0.19 -0.89 -0.21 0.00 0.02 0.00 0.00 55.36 54.47 1v27 s GLN 22 Cb -0.02 -2.19 -0.01 0.00 1.00 0.00 0.00 33.01 31.78 1v27 s GLN 22 CO 0.59 0.38 0.65 -1.17 -2.12 0.00 0.00 175.29 173.62 1v27 s LEU 23 N -0.15 4.08 0.07 2.90 2.96 0.25 0.43 118.68 129.23 1v27 s LEU 23 Ca -0.04 0.65 -0.08 0.00 -0.22 0.00 0.00 54.13 54.44 1v27 s LEU 23 Cb -0.14 -2.87 -0.05 0.00 0.50 0.00 0.00 46.19 43.62 1v27 s LEU 23 CO 0.04 -0.42 0.35 -0.63 -1.32 0.00 0.00 176.35 174.37 1v27 s ILE 24 N 2.58 5.17 -0.32 6.68 1.09 0.56 0.15 121.20 137.11 1v27 s ILE 24 Ca 0.27 0.29 0.06 0.00 -1.10 0.00 0.00 60.65 60.16 1v27 s ILE 24 Cb -0.15 -3.62 0.20 0.00 -1.06 0.00 0.00 42.46 37.82 1v27 s ILE 24 CO 0.09 0.27 0.61 0.54 -0.10 0.00 0.00 174.94 176.36 1v27 s VAL 25 N -1.41 -0.97 -0.20 2.92 0.11 0.04 -0.58 120.40 120.30 1v27 s VAL 25 Ca 0.33 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.23 1v27 s VAL 25 Cb -0.13 -0.76 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1v27 s VAL 25 CO 0.19 0.00 0.34 -0.89 -3.33 0.00 0.00 175.10 171.40 1v27 s THR 26 N 2.62 5.25 -0.84 5.04 2.01 0.52 -2.79 115.64 127.45 1v27 s THR 26 Ca 0.12 0.58 -0.21 0.00 0.31 0.00 0.00 61.69 62.50 1v27 s THR 26 Cb -0.08 -3.67 0.10 0.00 0.01 0.00 0.00 72.50 68.86 1v27 s THR 26 CO -0.22 0.30 1.11 -0.63 -0.69 0.00 0.00 174.62 174.48 1v27 s ILE 27 N 1.09 4.50 0.00 1.82 -1.09 -1.15 -0.03 121.20 126.33 1v27 s ILE 27 Ca 0.17 -1.06 0.00 0.00 -2.23 0.00 0.00 60.65 57.53 1v27 s ILE 27 Cb -0.14 -4.78 0.00 0.00 -1.58 0.00 0.00 42.46 35.96 1v27 s ILE 27 CO 0.07 -1.54 0.00 0.18 -1.23 0.00 0.00 174.94 172.42 1v27 n LEU 28 N 7.22 0.00 -3.86 2.97 4.77 -0.75 0.13 117.00 127.47 1v27 n LEU 28 Ca 0.15 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.06 1v27 n LEU 28 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1v27 n LEU 28 CO 0.57 0.00 0.46 -0.83 -1.33 0.00 0.00 177.39 176.26 1v27 s GLY 29 N 0.00 -0.04 0.29 -0.72 0.00 -1.21 0.64 107.32 106.29 1v27 s GLY 29 Ca 0.00 -0.36 0.09 0.00 0.00 0.00 0.00 44.72 44.45 1v27 s GLY 29 CO 0.00 -0.13 0.08 0.00 0.00 0.00 0.00 173.10 173.05 1v27 s ALA 30 N -3.85 3.35 0.06 3.20 0.00 -0.32 -1.33 121.76 122.88 1v27 s ALA 30 Ca 0.12 -1.70 -0.07 0.00 0.00 0.00 0.00 51.96 50.32 1v27 s ALA 30 Cb -0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 1v27 s ALA 30 CO 0.07 0.17 0.12 -1.59 0.00 0.00 0.00 175.76 174.54 1v27 s LYS 31 N -3.76 0.69 -0.64 0.00 0.00 -0.54 -3.13 119.74 112.36 1v27 s LYS 31 Ca 0.34 -0.88 -0.06 0.00 0.00 0.00 0.00 55.97 55.38 1v27 s LYS 31 Cb -0.05 0.27 0.01 0.00 0.00 0.00 0.00 37.83 38.06 1v27 s LYS 31 CO 0.22 -0.19 0.67 -0.25 0.00 0.00 0.00 175.35 175.79 1v27 n ASP 32 N 0.37 -7.72 -4.68 0.03 9.92 -1.26 -2.49 116.55 110.72 1v27 n ASP 32 Ca -0.17 0.09 -0.25 0.00 -0.53 0.00 0.00 54.79 53.92 1v27 n ASP 32 Cb 0.60 -5.17 -0.07 0.00 -0.64 0.00 0.00 41.12 35.84 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 -3.58 3.34 -0.35 0.64 1.02 -1.23 -3.76 118.68 114.76 1v27 s LEU 33 Ca 0.08 -0.43 -0.29 0.00 0.02 0.00 0.00 54.13 53.51 1v27 s LEU 33 Cb -0.02 -1.95 0.00 0.00 0.02 0.00 0.00 46.19 44.24 1v27 s LEU 33 CO 0.76 0.06 1.38 -2.16 0.02 0.00 0.00 176.35 176.41 1v27 s PRO 34 N -3.19 3.73 -0.10 1.29 0.04 -1.26 -4.81 135.00 130.71 1v27 s PRO 34 Ca 0.29 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.50 1v27 s PRO 34 Cb -0.09 -3.96 -0.10 0.00 0.04 0.00 0.00 34.50 30.39 1v27 s PRO 34 CO 0.19 -1.36 -0.01 0.43 0.04 0.00 0.00 177.00 176.29 1v27 n SER 35 N 8.29 2.91 0.00 6.66 7.64 -1.26 -4.65 113.62 133.21 1v27 n SER 35 Ca 0.16 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1v27 n SER 35 Cb 0.47 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 1v27 n SER 35 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1v27 n ARG 36 N -2.49 0.00 -0.89 1.43 1.74 -1.26 -4.62 116.66 110.57 1v27 n ARG 36 Ca -0.16 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.03 1v27 n ARG 36 Cb 0.77 -0.98 -0.03 0.00 -1.02 0.00 0.00 32.46 31.19 1v27 n ARG 36 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1v27 n GLU 37 N -2.00 -1.68 0.00 5.56 1.02 -1.26 -4.70 120.64 117.58 1v27 n GLU 37 Ca 0.00 1.16 0.00 0.00 -0.02 0.00 0.00 57.16 58.30 1v27 n GLU 37 Cb 0.00 -2.11 0.00 0.00 -0.02 0.00 0.00 31.44 29.31 1v27 n GLU 37 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1v27 n ASP 38 N -4.32 0.00 0.00 1.62 -0.08 -1.26 -4.71 116.55 107.80 1v27 n ASP 38 Ca -0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1v27 n ASP 38 Cb 0.60 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.06 1v27 n ASP 38 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1v27 n GLY 39 N 0.00 0.60 3.28 0.27 0.00 -1.26 -5.14 105.19 102.94 1v27 n GLY 39 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1v27 n GLY 39 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1v27 s ARG 40 N 3.00 1.17 0.53 1.61 3.03 -1.26 -5.13 118.95 121.89 1v27 s ARG 40 Ca 0.00 -1.53 -0.09 0.00 2.03 0.00 0.00 55.73 56.14 1v27 s ARG 40 Cb 0.00 -0.66 0.13 0.00 -1.03 0.00 0.00 34.95 33.39 1v27 s ARG 40 CO 0.00 0.03 0.58 -0.35 -1.13 0.00 0.00 175.30 174.43 1v27 n PRO 41 N -0.28 -1.32 -2.70 3.89 -0.04 -1.26 -4.81 135.00 128.48 1v27 n PRO 41 Ca -0.08 -0.91 -0.12 0.00 -0.04 0.00 0.00 63.50 62.34 1v27 n PRO 41 Cb 0.62 -0.72 -0.01 0.00 -0.04 0.00 0.00 33.50 33.35 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 -2.72 1.21 -3.73 0.54 1.85 -1.26 -4.59 116.66 107.96 1v27 n ARG 42 Ca 0.08 -1.56 -0.37 0.00 -1.00 0.00 0.00 57.85 55.00 1v27 n ARG 42 Cb 0.28 0.23 -0.10 0.00 -1.05 0.00 0.00 32.46 31.82 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 -2.39 5.28 0.81 2.89 0.01 -1.26 -0.88 114.94 119.40 1v27 s ASN 43 Ca 0.10 -2.46 -0.12 0.00 -0.71 0.00 0.00 52.86 49.68 1v27 s ASN 43 Cb -0.01 -1.85 0.07 0.00 0.41 0.00 0.00 41.25 39.87 1v27 s ASN 43 CO 0.07 -0.46 1.10 -2.16 -1.51 0.00 0.00 177.10 174.14 1v27 s PRO 44 N 0.51 2.01 -0.30 -0.60 0.04 -0.98 -0.24 135.00 135.45 1v27 s PRO 44 Ca 0.13 0.61 -0.17 0.00 0.04 0.00 0.00 61.00 61.60 1v27 s PRO 44 Cb -0.22 -1.91 0.20 0.00 0.04 0.00 0.00 34.50 32.61 1v27 s PRO 44 CO -0.04 -1.66 1.23 1.52 0.04 0.00 0.00 177.00 178.09 1v27 s TYR 45 N -3.17 -0.15 0.52 0.56 -0.85 -1.16 -1.77 117.35 111.33 1v27 s TYR 45 Ca 0.61 0.28 -0.09 0.00 -0.52 0.00 0.00 57.07 57.35 1v27 s TYR 45 Cb -0.14 0.09 -0.05 0.00 0.38 0.00 0.00 41.96 42.24 1v27 s TYR 45 CO 0.54 -0.07 0.88 0.08 -1.52 0.00 0.00 175.55 175.46 1v27 s VAL 46 N 1.60 4.78 -0.24 -3.49 1.01 -1.26 -3.07 120.40 119.73 1v27 s VAL 46 Ca -0.04 0.60 -0.03 0.00 0.00 0.00 0.00 61.98 62.51 1v27 s VAL 46 Cb -0.02 -3.83 0.12 0.00 0.00 0.00 0.00 36.38 32.65 1v27 s VAL 46 CO -0.13 -0.88 0.32 -0.75 0.00 0.00 0.00 175.10 173.66 1v27 s LYS 47 N -4.67 0.30 0.38 2.72 2.20 -0.77 -3.39 119.74 116.51 1v27 s LYS 47 Ca 0.52 0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 56.43 1v27 s LYS 47 Cb -0.10 -0.73 -0.04 0.00 -1.51 0.00 0.00 37.83 35.45 1v27 s LYS 47 CO 0.44 -0.71 0.62 0.42 -0.36 0.00 0.00 175.35 175.76 1v27 s ILE 48 N 2.45 5.04 -0.30 5.43 1.01 -0.03 -2.67 121.20 132.13 1v27 s ILE 48 Ca 0.10 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.57 1v27 s ILE 48 Cb -0.15 -3.85 0.17 0.00 0.01 0.00 0.00 42.46 38.64 1v27 s ILE 48 CO -0.17 -0.63 0.47 -0.31 0.00 0.00 0.00 174.94 174.29 1v27 s TYR 49 N -2.43 -1.23 -0.90 3.97 2.02 -1.15 -3.58 117.35 114.05 1v27 s TYR 49 Ca 0.43 0.43 -0.25 0.00 -0.37 0.00 0.00 57.07 57.31 1v27 s TYR 49 Cb -0.10 -0.03 -0.06 0.00 -0.40 0.00 0.00 41.96 41.38 1v27 s TYR 49 CO 0.38 -1.02 2.00 0.12 -1.57 0.00 0.00 175.55 175.46 1v27 s PHE 50 N 2.50 1.73 0.83 2.71 5.36 -1.22 -3.39 117.98 126.50 1v27 s PHE 50 Ca 0.11 0.80 -0.14 0.00 -0.96 0.00 0.00 56.93 56.74 1v27 s PHE 50 Cb -0.11 -3.97 0.05 0.00 -0.34 0.00 0.00 43.02 38.65 1v27 s PHE 50 CO -0.26 -1.70 0.83 1.28 -1.46 0.00 0.00 175.22 173.90 1v27 n LEU 51 N 14.59 2.27 0.23 6.12 4.32 -1.10 -2.31 117.00 141.12 1v27 n LEU 51 Ca 0.41 0.51 0.12 0.00 -0.02 0.00 0.00 56.01 57.03 1v27 n LEU 51 Cb 0.46 -1.36 0.38 0.00 -1.62 0.00 0.00 43.42 41.29 1v27 n LEU 51 CO 0.59 -2.58 0.83 1.55 -1.22 0.00 0.00 177.39 176.57 1v27 h PRO 52 N -1.01 0.00 -6.10 3.23 0.13 -1.87 -3.39 132.00 122.98 1v27 h PRO 52 Ca -0.45 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.00 1v27 h PRO 52 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1v27 h PRO 52 CO 0.42 0.10 1.17 -0.25 -0.23 0.00 0.00 178.00 179.22 1v27 n ASP 53 N -3.17 2.50 -2.93 1.44 8.00 -0.98 -4.85 116.55 116.56 1v27 n ASP 53 Ca 0.02 0.76 -0.24 0.00 0.71 0.00 0.00 54.79 56.05 1v27 n ASP 53 Cb 0.46 -1.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.29 1v27 n ASP 53 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1v27 n ARG 54 N 6.91 2.54 -3.90 -1.24 0.63 -1.26 -3.65 116.66 116.69 1v27 n ARG 54 Ca 0.32 -4.33 -0.10 0.00 -0.92 0.00 0.00 57.85 52.83 1v27 n ARG 54 Cb 0.21 -2.04 -0.01 0.00 0.45 0.00 0.00 32.46 31.07 1v27 n ARG 54 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1v27 s SER 55 N -3.19 0.11 1.01 6.15 0.15 -1.26 -5.08 113.70 111.60 1v27 s SER 55 Ca 0.45 -1.06 -0.18 0.00 0.70 0.00 0.00 55.95 55.86 1v27 s SER 55 Cb 0.32 0.75 0.05 0.00 -1.71 0.00 0.00 66.02 65.44 1v27 s SER 55 CO -0.12 -1.47 -0.24 -0.90 1.20 0.00 0.00 173.24 171.72 1v27 n ASP 56 N -1.06 -2.70 0.00 5.45 5.68 -1.26 -2.05 116.55 120.61 1v27 n ASP 56 Ca -0.05 -0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.06 1v27 n ASP 56 Cb 0.60 -0.76 0.00 0.00 -1.14 0.00 0.00 41.12 39.83 1v27 n ASP 56 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1v27 n LYS 57 N -0.68 0.00 -0.70 0.11 0.00 -1.26 -4.03 118.16 111.60 1v27 n LYS 57 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 58.31 58.38 1v27 n LYS 57 Cb 0.52 0.00 0.32 0.00 0.00 0.00 0.00 35.03 35.86 1v27 n LYS 57 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1v27 n ASN 58 N 3.93 4.63 -4.13 3.14 3.02 -1.18 -4.84 115.26 119.84 1v27 n ASN 58 Ca 0.00 -3.05 -0.36 0.00 -0.03 0.00 0.00 54.58 51.14 1v27 n ASN 58 Cb 0.00 -0.63 -0.12 0.00 -0.61 0.00 0.00 39.78 38.42 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 -2.86 2.04 -0.16 3.52 2.20 -0.87 -3.39 119.74 120.23 1v27 s LYS 59 Ca 0.49 -1.75 -0.23 0.00 -0.36 0.00 0.00 55.97 54.12 1v27 s LYS 59 Cb 0.39 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1v27 s LYS 59 CO 0.12 -1.01 0.70 1.03 -0.36 0.00 0.00 175.35 175.82 1v27 s ARG 60 N 1.15 4.29 -0.03 4.03 1.81 -1.24 -4.86 118.95 124.11 1v27 s ARG 60 Ca 0.07 0.79 0.03 0.00 -1.72 0.00 0.00 55.73 54.89 1v27 s ARG 60 Cb -0.22 -3.54 0.00 0.00 -0.45 0.00 0.00 34.95 30.74 1v27 s ARG 60 CO -0.04 -0.18 -0.10 0.50 -0.68 0.00 0.00 175.30 174.80 1v27 s ARG 61 N 1.69 1.04 0.59 3.54 3.52 -1.26 -0.85 118.95 127.22 1v27 s ARG 61 Ca 0.33 -0.34 -0.07 0.00 -0.13 0.00 0.00 55.73 55.52 1v27 s ARG 61 Cb -0.16 -0.96 -0.01 0.00 -1.56 0.00 0.00 34.95 32.26 1v27 s ARG 61 CO 0.13 0.13 0.93 0.95 -0.81 0.00 0.00 175.30 176.62 1v27 s THR 62 N 0.18 4.05 0.46 4.11 -4.23 -1.22 -5.02 115.64 113.98 1v27 s THR 62 Ca -0.03 0.26 -0.25 0.00 -1.18 0.00 0.00 61.69 60.49 1v27 s THR 62 Cb -0.09 -3.61 -0.08 0.00 1.34 0.00 0.00 72.50 70.06 1v27 s THR 62 CO 0.01 -0.68 1.41 2.29 -0.54 0.00 0.00 174.62 177.10 1v27 n LYS 63 N -2.61 2.14 -2.61 3.99 2.85 -1.26 -4.69 118.16 115.96 1v27 n LYS 63 Ca 0.04 0.76 -0.43 0.00 -1.05 0.00 0.00 58.31 57.64 1v27 n LYS 63 Cb 0.56 -2.60 -0.02 0.00 -0.65 0.00 0.00 35.03 32.33 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 -1.21 4.20 0.27 0.58 2.01 -1.26 -4.78 115.64 115.45 1v27 s THR 64 Ca 0.63 1.18 -0.29 0.00 0.31 0.00 0.00 61.69 63.52 1v27 s THR 64 Cb -0.45 -4.61 -0.09 0.00 0.01 0.00 0.00 72.50 67.36 1v27 s THR 64 CO 0.56 -1.03 0.95 -0.69 -0.69 0.00 0.00 174.62 173.72 1v27 s VAL 65 N 4.46 4.10 -0.10 3.82 1.01 -0.73 -4.98 120.40 127.99 1v27 s VAL 65 Ca 0.47 1.97 0.01 0.00 0.00 0.00 0.00 61.98 64.43 1v27 s VAL 65 Cb -0.07 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1v27 s VAL 65 CO 0.31 0.36 -0.12 -0.54 0.00 0.00 0.00 175.10 175.11 1v27 s LYS 66 N -1.51 3.04 -0.25 2.72 -0.14 -1.26 -2.31 119.74 120.02 1v27 s LYS 66 Ca 0.45 -0.66 -0.13 0.00 -1.36 0.00 0.00 55.97 54.26 1v27 s LYS 66 Cb -0.24 -2.56 0.02 0.00 -1.68 0.00 0.00 37.83 33.37 1v27 s LYS 66 CO 0.29 0.40 0.26 1.63 -0.76 0.00 0.00 175.35 177.18 1v27 n LYS 67 N 2.98 -1.75 -3.16 1.68 5.02 -0.06 -4.93 118.16 117.92 1v27 n LYS 67 Ca -0.18 1.61 0.05 0.00 -2.02 0.00 0.00 58.31 57.77 1v27 n LYS 67 Cb 0.53 -2.97 -0.03 0.00 -0.02 0.00 0.00 35.03 32.53 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 -1.51 -0.06 -0.51 -0.18 -1.32 -1.06 -4.94 115.64 106.05 1v27 s THR 68 Ca 0.14 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.87 1v27 s THR 68 Cb -0.02 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.29 1v27 s THR 68 CO 0.52 0.00 1.70 -0.07 -2.21 0.00 0.00 174.62 174.56 1v27 h LEU 69 N 7.58 0.00 -6.95 9.08 3.38 -1.92 -3.38 115.31 123.11 1v27 h LEU 69 Ca -0.11 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.24 1v27 h LEU 69 Cb 1.16 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.50 1v27 h LEU 69 CO -0.10 0.00 -0.70 -1.61 0.09 0.00 0.00 178.44 176.11 1v27 s GLU 70 N -3.21 1.81 0.41 1.13 2.02 -1.26 -3.51 118.70 116.09 1v27 s GLU 70 Ca 0.08 -2.69 -0.24 0.00 0.02 0.00 0.00 54.97 52.14 1v27 s GLU 70 Cb 0.08 -2.74 -0.09 0.00 0.10 0.00 0.00 34.13 31.48 1v27 s GLU 70 CO 0.62 -1.26 1.05 -1.25 0.02 0.00 0.00 175.26 174.45 1v27 s PRO 71 N -0.58 4.13 -0.33 0.39 0.04 -1.18 -4.82 135.00 132.64 1v27 s PRO 71 Ca 0.24 1.52 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 1v27 s PRO 71 Cb -0.10 -2.51 0.10 0.00 0.04 0.00 0.00 34.50 32.03 1v27 s PRO 71 CO -0.11 -0.17 0.11 0.15 0.04 0.00 0.00 177.00 177.01 1v27 s LYS 72 N -2.54 0.84 -0.18 4.56 1.02 -1.26 -1.17 119.74 121.00 1v27 s LYS 72 Ca 0.58 -1.25 -0.12 0.00 0.02 0.00 0.00 55.97 55.20 1v27 s LYS 72 Cb -0.22 -2.12 -0.21 0.00 -0.52 0.00 0.00 37.83 34.75 1v27 s LYS 72 CO 0.27 -1.01 0.19 0.91 -0.92 0.00 0.00 175.35 174.79 1v27 n TRP 73 N 4.64 0.94 -4.01 3.18 8.01 0.21 -4.93 117.44 125.47 1v27 n TRP 73 Ca -0.00 0.28 -0.32 0.00 -1.31 0.00 0.00 57.50 56.16 1v27 n TRP 73 Cb 0.41 -1.11 -0.06 0.00 -2.01 0.00 0.00 31.31 28.54 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 -3.90 -1.68 -3.69 -0.99 4.13 0.34 -4.88 115.26 104.60 1v27 n ASN 74 Ca -0.35 -0.79 -0.21 0.00 1.68 0.00 0.00 54.58 54.90 1v27 n ASN 74 Cb 0.89 -1.49 0.14 0.00 -1.54 0.00 0.00 39.78 37.77 1v27 n ASN 74 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1v27 n GLN 75 N -3.67 -0.61 -4.28 3.52 1.13 -1.09 -4.86 117.38 107.52 1v27 n GLN 75 Ca 0.09 -1.82 -0.19 0.00 -1.94 0.00 0.00 57.00 53.14 1v27 n GLN 75 Cb 0.46 -0.86 -0.13 0.00 0.11 0.00 0.00 30.24 29.82 1v27 n GLN 75 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1v27 s THR 76 N -2.93 1.04 -0.15 5.09 2.01 -1.26 -2.95 115.64 116.48 1v27 s THR 76 Ca 0.56 -1.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 1v27 s THR 76 Cb -0.02 -0.96 0.07 0.00 0.01 0.00 0.00 72.50 71.60 1v27 s THR 76 CO 0.39 -0.07 0.31 -0.36 -0.69 0.00 0.00 174.62 174.20 1v27 s PHE 77 N -0.95 -0.53 -0.00 4.92 0.08 -1.12 -4.96 117.98 115.42 1v27 s PHE 77 Ca -0.00 1.13 0.02 0.00 0.12 0.00 0.00 56.93 58.20 1v27 s PHE 77 Cb -0.08 0.08 -0.04 0.00 -0.57 0.00 0.00 43.02 42.41 1v27 s PHE 77 CO 0.01 -0.38 -0.02 0.42 -0.10 0.00 0.00 175.22 175.15 1v27 s ILE 78 N 2.32 3.98 -0.20 0.64 1.01 -1.26 -0.78 121.20 126.91 1v27 s ILE 78 Ca -0.01 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.95 1v27 s ILE 78 Cb -0.12 -2.76 0.06 0.00 0.01 0.00 0.00 42.46 39.66 1v27 s ILE 78 CO -0.10 0.39 0.05 -0.31 0.00 0.00 0.00 174.94 174.97 1v27 s TYR 79 N -1.05 0.87 0.09 3.97 2.02 0.12 -4.89 117.35 118.48 1v27 s TYR 79 Ca 0.19 -0.80 -0.08 0.00 -0.37 0.00 0.00 57.07 56.00 1v27 s TYR 79 Cb -0.11 -0.99 -0.01 0.00 -0.40 0.00 0.00 41.96 40.45 1v27 s TYR 79 CO 0.09 -0.62 0.18 -1.54 -1.57 0.00 0.00 175.55 172.09 1v27 s SER 80 N 1.91 0.15 0.32 2.29 1.04 -1.26 0.87 113.70 119.01 1v27 s SER 80 Ca 0.01 -0.71 -0.28 0.00 0.48 0.00 0.00 55.95 55.45 1v27 s SER 80 Cb -0.17 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.19 1v27 s SER 80 CO -0.10 -0.73 1.07 -2.16 0.98 0.00 0.00 173.24 172.30 1v27 s PRO 81 N -3.88 4.49 -0.17 4.02 0.04 -1.26 -5.06 135.00 133.18 1v27 s PRO 81 Ca 0.07 1.69 -0.02 0.00 0.04 0.00 0.00 61.00 62.77 1v27 s PRO 81 Cb 0.05 -2.98 0.05 0.00 0.04 0.00 0.00 34.50 31.67 1v27 s PRO 81 CO -0.10 0.11 0.02 0.08 0.04 0.00 0.00 177.00 177.15 1v27 s VAL 82 N -1.33 0.60 0.64 -0.36 1.01 0.55 -5.00 120.40 116.52 1v27 s VAL 82 Ca 0.49 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 1v27 s VAL 82 Cb -0.28 -1.01 0.05 0.00 0.00 0.00 0.00 36.38 35.14 1v27 s VAL 82 CO 0.36 -0.09 0.91 -1.00 0.00 0.00 0.00 175.10 175.28 1v27 s HIS 83 N 1.83 2.88 0.09 5.22 3.76 -1.26 -4.18 115.29 123.63 1v27 s HIS 83 Ca 0.00 0.24 0.02 0.00 -0.15 0.00 0.00 55.06 55.17 1v27 s HIS 83 Cb -0.16 -3.01 -0.25 0.00 1.11 0.00 0.00 32.58 30.28 1v27 s HIS 83 CO -0.07 -1.18 1.18 -0.09 -0.85 0.00 0.00 174.74 173.72 1v27 h ARG 84 N -0.31 0.13 0.00 1.40 9.65 -2.00 -3.16 114.38 120.09 1v27 h ARG 84 Ca -0.43 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.22 1v27 h ARG 84 Cb 1.31 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.97 1v27 h ARG 84 CO 0.57 1.09 -0.02 2.89 2.80 0.00 0.00 179.97 187.29 1v27 n ARG 85 N -3.43 0.06 0.00 0.20 -4.01 -1.26 -2.74 116.66 105.49 1v27 n ARG 85 Ca -0.05 0.05 0.13 0.00 -1.04 0.00 0.00 57.85 56.94 1v27 n ARG 85 Cb 0.99 -1.57 0.41 0.00 -3.04 0.00 0.00 32.46 29.24 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 -1.69 0.75 0.08 2.89 -0.58 -1.19 -4.08 120.64 116.81 1v27 n GLU 86 Ca 0.07 -0.41 -0.13 0.00 -0.42 0.00 0.00 57.16 56.26 1v27 n GLU 86 Cb 0.36 -1.49 -0.08 0.00 -0.57 0.00 0.00 31.44 29.66 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 1.00 -0.14 0.00 -0.32 -1.00 -1.57 0.98 116.94 115.89 1v27 h PHE 87 Ca 0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1v27 h PHE 87 Cb 0.48 0.05 0.00 0.00 3.61 0.00 0.00 35.95 40.09 1v27 h PHE 87 CO 0.00 0.07 0.00 0.07 -1.61 0.00 0.00 178.31 176.84 1v27 h ARG 88 N -0.34 0.00 0.00 1.51 0.11 -1.78 -1.14 114.38 112.73 1v27 h ARG 88 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1v27 h ARG 88 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1v27 h ARG 88 CO 0.03 0.00 -1.91 0.39 0.10 0.00 0.00 179.97 178.58 1v27 n GLU 89 N -2.31 0.65 -4.00 0.08 1.02 -0.83 -4.87 120.64 110.38 1v27 n GLU 89 Ca 0.01 -0.17 -0.27 0.00 -0.02 0.00 0.00 57.16 56.70 1v27 n GLU 89 Cb 0.16 -1.55 -0.17 0.00 -0.02 0.00 0.00 31.44 29.87 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 -3.50 1.75 0.13 3.49 0.52 0.33 -4.82 118.95 116.85 1v27 s ARG 90 Ca -0.07 -0.35 0.10 0.00 -0.52 0.00 0.00 55.73 54.89 1v27 s ARG 90 Cb 0.14 -1.71 -0.04 0.00 0.52 0.00 0.00 34.95 33.86 1v27 s ARG 90 CO 0.90 -0.23 -0.25 1.41 0.02 0.00 0.00 175.30 177.15 1v27 s MET 91 N 1.55 1.50 0.27 3.54 -2.45 -1.26 -3.92 119.30 118.53 1v27 s MET 91 Ca 0.03 -1.31 -0.06 0.00 -1.25 0.00 0.00 55.69 53.11 1v27 s MET 91 Cb -0.13 -1.95 -0.06 0.00 1.25 0.00 0.00 34.83 33.94 1v27 s MET 91 CO -0.08 0.46 0.54 -0.51 1.05 0.00 0.00 175.02 176.48 1v27 s LEU 92 N -2.08 4.09 -0.31 4.11 1.43 0.10 -2.71 118.68 123.32 1v27 s LEU 92 Ca 0.15 0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 53.97 1v27 s LEU 92 Cb -0.10 -3.54 0.12 0.00 0.03 0.00 0.00 46.19 42.70 1v27 s LEU 92 CO 0.07 -0.16 0.19 -0.70 0.23 0.00 0.00 176.35 175.98 1v27 s GLU 93 N -3.36 0.34 -0.05 1.70 2.12 -1.22 -2.58 118.70 115.65 1v27 s GLU 93 Ca 0.44 -0.75 -0.11 0.00 0.36 0.00 0.00 54.97 54.92 1v27 s GLU 93 Cb -0.11 -1.12 -0.05 0.00 0.26 0.00 0.00 34.13 33.11 1v27 s GLU 93 CO 0.28 -1.09 0.28 0.42 -0.54 0.00 0.00 175.26 174.61 1v27 s ILE 94 N 1.78 5.26 -0.03 -3.70 1.09 0.02 -2.95 121.20 122.66 1v27 s ILE 94 Ca 0.12 0.50 -0.05 0.00 -1.10 0.00 0.00 60.65 60.12 1v27 s ILE 94 Cb -0.18 -3.56 0.01 0.00 -1.06 0.00 0.00 42.46 37.67 1v27 s ILE 94 CO -0.23 0.57 0.12 0.42 -0.10 0.00 0.00 174.94 175.72 1v27 s THR 95 N -1.09 0.02 -0.02 2.92 -4.23 -1.09 0.11 115.64 112.27 1v27 s THR 95 Ca 0.21 -0.17 0.03 0.00 -1.18 0.00 0.00 61.69 60.57 1v27 s THR 95 Cb -0.14 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.44 1v27 s THR 95 CO 0.10 -0.09 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.77 1v27 s LEU 96 N -0.27 3.05 0.00 4.79 2.96 -0.44 -1.85 118.68 126.92 1v27 s LEU 96 Ca -0.03 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.73 1v27 s LEU 96 Cb -0.03 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.96 1v27 s LEU 96 CO 0.00 0.31 0.00 0.79 -1.32 0.00 0.00 176.35 176.14 1v27 n TRP 97 N 1.88 -0.22 -3.65 5.38 7.02 -1.17 -1.62 117.44 125.06 1v27 n TRP 97 Ca -0.16 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.16 1v27 n TRP 97 Cb 0.53 0.00 -0.14 0.00 -2.42 0.00 0.00 31.31 29.27 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 -0.37 0.61 -0.20 -0.99 2.15 -0.34 -3.01 116.67 114.53 1v27 s ASP 98 Ca 0.00 0.41 -0.29 0.00 0.43 0.00 0.00 52.55 53.10 1v27 s ASP 98 Cb 0.00 0.49 0.00 0.00 -0.30 0.00 0.00 42.92 43.11 1v27 s ASP 98 CO 0.00 -0.25 1.08 -1.58 -0.17 0.00 0.00 175.17 174.25 1v27 s GLN 99 N 2.36 4.28 0.31 4.34 -0.44 0.67 -2.66 119.66 128.51 1v27 s GLN 99 Ca 0.03 1.42 0.00 0.00 -2.50 0.00 0.00 55.36 54.31 1v27 s GLN 99 Cb -0.12 -3.64 -0.00 0.00 -1.64 0.00 0.00 33.01 27.60 1v27 s GLN 99 CO -0.08 -0.60 0.01 0.00 0.50 0.00 0.00 175.29 175.13 1v27 n ALA 100 N 6.16 0.28 -0.57 1.58 0.00 -1.23 -4.12 120.51 122.61 1v27 n ALA 100 Ca 0.12 -1.39 0.06 0.00 0.00 0.00 0.00 53.44 52.22 1v27 n ALA 100 Cb 0.46 0.78 -0.01 0.00 0.00 0.00 0.00 19.45 20.68 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 -0.76 -0.83 -0.05 0.00 5.12 -1.26 -4.73 116.66 114.15 1v27 n ARG 101 Ca -0.12 0.55 -0.07 0.00 -1.93 0.00 0.00 57.85 56.28 1v27 n ARG 101 Cb 0.39 -1.02 -0.06 0.00 -1.16 0.00 0.00 32.46 30.62 1v27 n ARG 101 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 1v27 n VAL 102 N -1.70 0.64 0.00 1.55 0.24 -1.26 -4.94 118.33 112.86 1v27 n VAL 102 Ca 0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 1v27 n VAL 102 Cb 0.19 -0.86 0.00 0.00 -1.47 0.00 0.00 33.84 31.70 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 -2.67 0.00 -1.60 7.34 1.74 -1.26 -5.00 116.66 115.21 1v27 n ARG 103 Ca -0.18 0.00 -0.61 0.00 -0.77 0.00 0.00 57.85 56.28 1v27 n ARG 103 Cb 0.74 -0.02 -0.08 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 -1.32 0.12 -0.39 5.56 -0.58 -1.26 -4.80 120.64 117.97 1v27 n GLU 104 Ca 0.00 0.04 -0.10 0.00 -0.42 0.00 0.00 57.16 56.68 1v27 n GLU 104 Cb 0.00 -1.56 -0.09 0.00 -0.57 0.00 0.00 31.44 29.22 1v27 n GLU 104 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1v27 h GLU 105 N 3.91 -0.01 -7.03 3.49 5.08 -1.95 -3.42 114.58 114.66 1v27 h GLU 105 Ca -0.48 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.26 1v27 h GLU 105 Cb 1.40 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.53 1v27 h GLU 105 CO 0.78 -0.00 -0.99 0.39 -1.00 0.00 0.00 179.01 178.18 1v27 n GLU 106 N -5.13 -0.67 -3.32 2.33 -0.58 -1.26 -4.16 120.64 107.85 1v27 n GLU 106 Ca 0.02 0.08 -0.40 0.00 -0.42 0.00 0.00 57.16 56.44 1v27 n GLU 106 Cb 0.25 -3.13 -0.09 0.00 -0.57 0.00 0.00 31.44 27.91 1v27 n GLU 106 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1v27 s SER 107 N -4.03 6.28 -0.17 1.62 0.01 -1.26 -3.47 113.70 112.68 1v27 s SER 107 Ca 0.21 0.12 -0.16 0.00 1.31 0.00 0.00 55.95 57.42 1v27 s SER 107 Cb -0.12 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 1v27 s SER 107 CO 0.99 -0.32 0.42 -0.70 0.41 0.00 0.00 173.24 174.03 1v27 s GLU 108 N 2.19 4.23 -0.07 12.44 2.12 -1.09 -4.90 118.70 133.63 1v27 s GLU 108 Ca 0.16 0.27 -0.30 0.00 0.36 0.00 0.00 54.97 55.47 1v27 s GLU 108 Cb -0.16 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 1v27 s GLU 108 CO 0.11 0.04 1.10 0.12 -0.54 0.00 0.00 175.26 176.09 1v27 s PHE 109 N 1.06 3.37 -0.17 5.30 5.36 -1.26 -1.20 117.98 130.44 1v27 s PHE 109 Ca 0.21 1.41 -0.00 0.00 -0.96 0.00 0.00 56.93 57.59 1v27 s PHE 109 Cb -0.15 -3.30 -0.23 0.00 -0.34 0.00 0.00 43.02 39.01 1v27 s PHE 109 CO 0.08 -0.76 0.16 1.28 -1.46 0.00 0.00 175.22 174.52 1v27 n LEU 110 N 5.03 2.42 0.00 6.12 4.77 -0.64 -4.48 117.00 130.23 1v27 n LEU 110 Ca 0.10 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1v27 n LEU 110 Cb 0.48 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1v27 n LEU 110 CO 0.54 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 178.03 1v27 n GLY 111 N 2.04 -1.45 2.98 -0.72 0.00 -1.09 -3.40 105.19 103.55 1v27 n GLY 111 Ca -0.36 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.68 0.14 -0.35 1.61 -1.05 -0.84 -1.32 118.70 115.22 1v27 s GLU 112 Ca 0.00 0.41 0.01 0.00 -0.15 0.00 0.00 54.97 55.23 1v27 s GLU 112 Cb 0.00 -0.12 0.09 0.00 -0.44 0.00 0.00 34.13 33.66 1v27 s GLU 112 CO 0.00 -0.15 0.07 0.42 0.95 0.00 0.00 175.26 176.56 1v27 s ILE 113 N 1.05 2.70 -0.14 1.83 1.01 0.31 -2.75 121.20 125.22 1v27 s ILE 113 Ca -0.08 -2.03 -0.13 0.00 0.00 0.00 0.00 60.65 58.41 1v27 s ILE 113 Cb -0.10 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 1v27 s ILE 113 CO -0.06 -0.49 0.30 -0.76 0.00 0.00 0.00 174.94 173.93 1v27 s LEU 114 N 1.05 4.29 -0.01 2.97 2.01 -1.26 -0.80 118.68 126.92 1v27 s LEU 114 Ca 0.05 0.57 0.01 0.00 0.01 0.00 0.00 54.13 54.77 1v27 s LEU 114 Cb -0.20 -2.39 0.01 0.00 0.01 0.00 0.00 46.19 43.62 1v27 s LEU 114 CO -0.05 0.15 -0.02 -0.63 1.01 0.00 0.00 176.35 176.81 1v27 s ILE 115 N 0.15 0.24 -0.23 -0.59 1.01 -1.07 -4.99 121.20 115.72 1v27 s ILE 115 Ca 0.18 -0.06 -0.08 0.00 0.00 0.00 0.00 60.65 60.68 1v27 s ILE 115 Cb -0.13 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 1v27 s ILE 115 CO 0.05 0.10 0.10 -1.61 0.00 0.00 0.00 174.94 173.58 1v27 s GLU 116 N 0.34 3.83 0.55 2.79 2.02 -1.26 -0.72 118.70 126.24 1v27 s GLU 116 Ca -0.03 -0.39 0.31 0.00 0.02 0.00 0.00 54.97 54.87 1v27 s GLU 116 Cb -0.06 -3.37 1.47 0.00 0.10 0.00 0.00 34.13 32.28 1v27 s GLU 116 CO -0.01 -0.03 1.88 -0.07 0.02 0.00 0.00 175.26 177.06 1v27 h LEU 117 N 7.74 0.00 -0.33 1.80 3.38 -1.74 0.62 115.31 126.79 1v27 h LEU 117 Ca -0.37 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.67 1v27 h LEU 117 Cb 1.18 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.85 1v27 h LEU 117 CO 0.61 0.00 -0.21 -0.08 0.09 0.00 0.00 178.44 178.85 1v27 h GLU 118 N 0.00 -0.16 -0.11 1.13 4.81 -1.82 -2.72 114.58 115.70 1v27 h GLU 118 Ca 0.38 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.54 1v27 h GLU 118 Cb 1.62 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.97 1v27 h GLU 118 CO -0.00 -0.11 -0.55 0.25 -0.73 0.00 0.00 179.01 177.86 1v27 n THR 119 N -5.37 2.24 -2.38 0.32 -2.24 0.07 -4.96 114.28 101.97 1v27 n THR 119 Ca 0.01 -3.38 -0.40 0.00 -2.27 0.00 0.00 64.05 58.01 1v27 n THR 119 Cb 0.28 -0.36 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 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 -3.27 3.39 -1.02 6.98 0.00 0.20 -4.86 121.76 123.19 1v27 s ALA 120 Ca 0.40 0.98 -0.23 0.00 0.00 0.00 0.00 51.96 53.11 1v27 s ALA 120 Cb 0.38 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 20.16 1v27 s ALA 120 CO -0.05 -0.30 1.57 -0.51 0.00 0.00 0.00 175.76 176.46 1v27 s LEU 121 N -1.67 3.45 -0.41 0.00 1.43 -1.26 -4.93 118.68 115.29 1v27 s LEU 121 Ca 0.47 -1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 52.08 1v27 s LEU 121 Cb -0.33 -2.57 0.05 0.00 0.03 0.00 0.00 46.19 43.37 1v27 s LEU 121 CO 0.43 -1.74 0.27 -0.76 0.23 0.00 0.00 176.35 174.78 1v27 s LEU 122 N 5.96 5.08 -0.05 1.79 1.43 -1.26 -4.20 118.68 127.43 1v27 s LEU 122 Ca 0.51 -1.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.39 1v27 s LEU 122 Cb -0.01 -2.05 0.06 0.00 0.03 0.00 0.00 46.19 44.22 1v27 s LEU 122 CO -0.07 -0.50 0.55 -0.67 0.23 0.00 0.00 176.35 175.90 1v27 n ASP 123 N 5.02 -0.41 -4.27 2.29 -0.08 -1.15 -4.80 116.55 113.16 1v27 n ASP 123 Ca -0.11 -0.98 -0.31 0.00 -1.51 0.00 0.00 54.79 51.87 1v27 n ASP 123 Cb 0.44 0.16 -0.09 0.00 2.34 0.00 0.00 41.12 43.97 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 -0.22 0.49 -4.06 1.67 -0.08 -1.03 -4.91 116.55 108.42 1v27 n ASP 124 Ca -0.08 -1.22 -0.26 0.00 -1.51 0.00 0.00 54.79 51.72 1v27 n ASP 124 Cb 0.50 -1.52 -0.17 0.00 2.34 0.00 0.00 41.12 42.27 1v27 n ASP 124 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1v27 s GLU 125 N -7.16 1.97 -0.10 -0.67 2.02 -1.26 -5.03 118.70 108.48 1v27 s GLU 125 Ca 0.13 -0.50 -0.30 0.00 0.02 0.00 0.00 54.97 54.32 1v27 s GLU 125 Cb -0.08 -1.61 -0.03 0.00 0.10 0.00 0.00 34.13 32.52 1v27 s GLU 125 CO 0.96 0.03 1.24 -1.25 0.02 0.00 0.00 175.26 176.26 1v27 s PRO 126 N 0.68 4.30 -0.06 0.39 0.04 -1.26 -4.50 135.00 134.59 1v27 s PRO 126 Ca -0.14 1.69 0.04 0.00 0.04 0.00 0.00 61.00 62.63 1v27 s PRO 126 Cb -0.16 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.74 1v27 s PRO 126 CO 0.04 -0.56 -0.16 -1.01 0.04 0.00 0.00 177.00 175.34 1v27 s HIS 127 N 2.75 1.74 -0.58 0.56 3.76 -1.25 -5.02 115.29 117.24 1v27 s HIS 127 Ca 0.56 -0.59 -0.27 0.00 -0.15 0.00 0.00 55.06 54.61 1v27 s HIS 127 Cb -0.24 -1.20 0.03 0.00 1.11 0.00 0.00 32.58 32.28 1v27 s HIS 127 CO 0.19 -0.24 1.13 -1.58 -0.85 0.00 0.00 174.74 173.39 1v27 s TRP 128 N 0.31 2.64 -0.08 1.40 0.52 -1.26 -3.17 118.94 119.30 1v27 s TRP 128 Ca -0.10 0.27 -0.18 0.00 0.02 0.00 0.00 56.10 56.11 1v27 s TRP 128 Cb -0.14 -4.40 -0.05 0.00 -1.15 0.00 0.00 33.47 27.73 1v27 s TRP 128 CO 0.04 -1.55 0.47 0.71 0.02 0.00 0.00 176.95 176.64 1v27 s TYR 129 N 4.71 3.57 0.34 -1.98 2.02 0.33 -4.86 117.35 121.48 1v27 s TYR 129 Ca 0.39 0.93 -0.28 0.00 -0.37 0.00 0.00 57.07 57.74 1v27 s TYR 129 Cb -0.09 -2.50 -0.09 0.00 -0.40 0.00 0.00 41.96 38.88 1v27 s TYR 129 CO 0.23 0.28 1.16 0.15 -1.57 0.00 0.00 175.55 175.80 1v27 s LYS 130 N 0.20 4.37 0.05 -0.62 1.02 -1.26 -0.86 119.74 122.64 1v27 s LYS 130 Ca 0.26 1.87 -0.18 0.00 0.02 0.00 0.00 55.97 57.94 1v27 s LYS 130 Cb -0.16 -2.96 -0.06 0.00 -0.52 0.00 0.00 37.83 34.13 1v27 s LYS 130 CO 0.11 -0.05 0.52 -0.51 -0.92 0.00 0.00 175.35 174.50 1v27 s LEU 131 N -1.92 4.50 -0.30 3.17 1.43 -1.19 -4.80 118.68 119.58 1v27 s LEU 131 Ca 0.50 1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 1v27 s LEU 131 Cb -0.32 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 1v27 s LEU 131 CO 0.41 0.28 0.18 -1.10 0.23 0.00 0.00 176.35 176.36 1v27 s GLN 132 N -1.14 3.58 0.35 1.70 -1.52 -1.11 -4.77 119.66 116.76 1v27 s GLN 132 Ca 0.28 -0.56 0.08 0.00 -1.95 0.00 0.00 55.36 53.21 1v27 s GLN 132 Cb -0.18 -3.63 -0.04 0.00 -0.22 0.00 0.00 33.01 28.94 1v27 s GLN 132 CO 0.17 -0.33 0.17 0.95 -0.25 0.00 0.00 175.29 176.00 1v27 s THR 133 N 1.68 2.98 -0.33 -0.19 -4.23 -1.26 -1.98 115.64 112.31 1v27 s THR 133 Ca 0.06 -1.64 -0.44 0.00 -1.18 0.00 0.00 61.69 58.49 1v27 s THR 133 Cb -0.17 -3.00 -0.19 0.00 1.34 0.00 0.00 72.50 70.49 1v27 s THR 133 CO 0.08 -0.15 1.53 1.57 -0.54 0.00 0.00 174.62 177.11 1v27 n HIS 134 N -1.20 1.63 -3.04 3.99 -0.00 -1.26 -4.88 115.22 110.46 1v27 n HIS 134 Ca -0.02 0.96 0.03 0.00 0.46 0.00 0.00 57.72 59.15 1v27 n HIS 134 Cb 0.61 -2.27 0.00 0.00 -0.12 0.00 0.00 29.99 28.22 1v27 n HIS 134 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1v27 s ASP 135 N 2.49 -0.78 0.95 0.26 2.15 -1.26 -4.98 116.67 115.50 1v27 s ASP 135 Ca 1.00 -0.14 -0.16 0.00 0.43 0.00 0.00 52.55 53.68 1v27 s ASP 135 Cb -1.33 1.25 -0.12 0.00 -0.30 0.00 0.00 42.92 42.41 1v27 s ASP 135 CO 0.72 -0.12 -0.58 -1.20 -0.17 0.00 0.00 175.17 173.82 1v27 n SER 136 N 4.60 -5.29 -3.87 -0.34 7.64 -1.26 -5.01 113.62 110.09 1v27 n SER 136 Ca 0.08 0.24 -0.17 0.00 1.01 0.00 0.00 58.87 60.03 1v27 n SER 136 Cb 0.59 -0.83 -0.09 0.00 -1.01 0.00 0.00 64.21 62.86 1v27 n SER 136 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v27 s GLY 137 N -1.14 1.98 -0.08 0.23 0.00 -1.26 -5.08 107.32 101.97 1v27 s GLY 137 Ca 0.44 -1.82 -0.23 0.00 0.00 0.00 0.00 44.72 43.10 1v27 s GLY 137 CO 0.79 -1.51 0.87 -0.56 0.00 0.00 0.00 173.10 172.70 1v27 h PRO 138 N 2.30 -0.08 -0.09 2.90 0.13 -2.05 -3.47 132.00 131.64 1v27 h PRO 138 Ca -0.32 0.01 0.28 0.00 -0.87 0.00 0.00 66.00 65.09 1v27 h PRO 138 Cb 1.24 0.02 -0.20 0.00 0.13 0.00 0.00 31.00 32.19 1v27 h PRO 138 CO 0.48 0.53 0.20 0.45 -0.23 0.00 0.00 178.00 179.43 1v27 s SER 139 N -5.78 -0.13 0.04 1.44 0.15 -1.26 -5.10 113.70 103.05 1v27 s SER 139 Ca -0.15 0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1v27 s SER 139 Cb -0.00 1.10 0.00 0.00 -1.71 0.00 0.00 66.02 65.41 1v27 s SER 139 CO 0.56 -0.02 0.00 -0.24 1.20 0.00 0.00 173.24 174.74 1v27 n SER 140 N 5.32 -9.12 0.00 5.45 2.88 -1.26 -5.33 113.62 111.57 1v27 n SER 140 Ca -0.02 1.71 0.00 0.00 -1.33 0.00 0.00 58.87 59.24 1v27 n SER 140 Cb 0.56 -4.97 0.00 0.00 -0.75 0.00 0.00 64.21 59.05 1v27 n SER 140 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42