#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rk7 s THR 2 N 0.00 4.86 -0.38 0.00 2.01 -1.26 -4.90 115.64 115.98 1rk7 s THR 2 Ca 0.00 1.51 -0.07 0.00 0.31 0.00 0.00 61.69 63.44 1rk7 s THR 2 Cb 0.00 -4.09 0.06 0.00 0.01 0.00 0.00 72.50 68.48 1rk7 s THR 2 CO 0.00 -0.06 0.18 -0.75 -0.69 0.00 0.00 174.62 173.30 1rk7 s LYS 3 N 2.78 2.53 0.31 4.92 2.36 -1.26 -2.83 119.74 128.56 1rk7 s LYS 3 Ca 0.34 -1.37 -0.13 0.00 -2.55 0.00 0.00 55.97 52.26 1rk7 s LYS 3 Cb -0.15 -3.60 -0.08 0.00 -1.05 0.00 0.00 37.83 32.95 1rk7 s LYS 3 CO 0.07 -0.83 0.69 0.00 1.55 0.00 0.00 175.35 176.83 1rk7 s ALA 4 N 1.38 3.40 0.08 3.13 0.00 0.45 -2.06 121.76 128.14 1rk7 s ALA 4 Ca 0.01 -0.09 0.06 0.00 0.00 0.00 0.00 51.96 51.95 1rk7 s ALA 4 Cb -0.21 -2.66 -0.03 0.00 0.00 0.00 0.00 23.12 20.21 1rk7 s ALA 4 CO 0.02 0.33 -0.16 0.08 0.00 0.00 0.00 175.76 176.03 1rk7 s VAL 5 N -1.99 1.28 -0.40 0.00 1.01 -0.86 0.11 120.40 119.54 1rk7 s VAL 5 Ca 0.52 -1.41 0.05 0.00 0.00 0.00 0.00 61.98 61.14 1rk7 s VAL 5 Cb -0.10 -1.24 0.17 0.00 0.00 0.00 0.00 36.38 35.21 1rk7 s VAL 5 CO 0.20 -0.21 0.50 0.00 0.00 0.00 0.00 175.10 175.60 1rk7 s ALA 6 N -1.34 -1.25 -0.66 5.51 0.00 0.52 -0.52 121.76 124.03 1rk7 s ALA 6 Ca 0.01 -0.54 -0.25 0.00 0.00 0.00 0.00 51.96 51.19 1rk7 s ALA 6 Cb -0.09 -2.36 0.05 0.00 0.00 0.00 0.00 23.12 20.71 1rk7 s ALA 6 CO 0.03 -2.18 1.09 0.54 0.00 0.00 0.00 175.76 175.24 1rk7 s VAL 7 N 1.48 4.10 0.18 0.00 0.11 -1.26 -0.20 120.40 124.82 1rk7 s VAL 7 Ca 0.18 0.16 -0.33 0.00 -2.93 0.00 0.00 61.98 59.07 1rk7 s VAL 7 Cb -0.09 -4.74 -0.15 0.00 -1.53 0.00 0.00 36.38 29.87 1rk7 s VAL 7 CO -0.05 -1.52 1.30 0.18 -3.33 0.00 0.00 175.10 171.69 1rk7 n LEU 8 N 8.31 2.19 -3.65 2.54 7.99 0.50 -4.22 117.00 130.66 1rk7 n LEU 8 Ca 0.01 1.13 -0.08 0.00 -0.01 0.00 0.00 56.01 57.06 1rk7 n LEU 8 Cb 0.47 -1.30 -0.07 0.00 -0.11 0.00 0.00 43.42 42.41 1rk7 n LEU 8 CO 0.67 -0.92 0.32 -0.75 -1.51 0.00 0.00 177.39 175.21 1rk7 s LYS 9 N -0.15 0.68 0.00 3.23 2.36 -1.20 -3.67 119.74 120.99 1rk7 s LYS 9 Ca 0.74 1.17 0.00 0.00 -2.55 0.00 0.00 55.97 55.32 1rk7 s LYS 9 Cb -0.78 0.14 0.00 0.00 -1.05 0.00 0.00 37.83 36.13 1rk7 s LYS 9 CO 0.49 -0.15 0.00 0.41 1.55 0.00 0.00 175.35 177.66 1rk7 n GLY 10 N 4.22 -1.61 0.34 5.54 0.00 -1.26 -2.11 105.19 110.31 1rk7 n GLY 10 Ca -0.20 0.78 0.03 0.00 0.00 0.00 0.00 46.02 46.62 1rk7 n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 11 N 0.00 -0.44 0.00 1.61 2.03 -0.83 -4.83 116.55 114.08 1rk7 n ASP 11 Ca 0.00 1.57 0.00 0.00 0.52 0.00 0.00 54.79 56.88 1rk7 n ASP 11 Cb 0.00 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 1rk7 n ASP 11 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rk7 n GLY 12 N -1.51 2.78 0.19 0.27 0.00 -1.26 -4.94 105.19 100.71 1rk7 n GLY 12 Ca 0.12 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.58 1rk7 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 h PRO 13 N 0.00 0.64 -5.15 1.61 0.13 -1.88 -3.39 132.00 123.97 1rk7 h PRO 13 Ca 0.00 -0.63 -0.12 0.00 -0.87 0.00 0.00 66.00 64.38 1rk7 h PRO 13 Cb 0.00 0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1rk7 h PRO 13 CO 0.00 1.23 0.37 0.28 -0.23 0.00 0.00 178.00 179.65 1rk7 n VAL 14 N -4.00 0.45 -1.58 1.56 0.31 -1.13 -4.24 118.33 109.71 1rk7 n VAL 14 Ca -0.10 -0.46 -0.26 0.00 -0.01 0.00 0.00 64.34 63.51 1rk7 n VAL 14 Cb 0.77 -2.04 0.09 0.00 -0.91 0.00 0.00 33.84 31.75 1rk7 n VAL 14 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1rk7 n GLN 15 N 8.14 2.84 -0.65 5.55 7.27 -1.03 -3.23 117.38 136.27 1rk7 n GLN 15 Ca 0.42 -3.55 -0.31 0.00 0.07 0.00 0.00 57.00 53.63 1rk7 n GLN 15 Cb 0.46 -2.21 0.18 0.00 2.41 0.00 0.00 30.24 31.09 1rk7 n GLN 15 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1rk7 n GLY 16 N -0.90 -1.71 2.61 1.69 0.00 -1.24 -4.56 105.19 101.08 1rk7 n GLY 16 Ca 0.52 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 1rk7 n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk7 s ILE 17 N -2.42 -0.15 -0.16 -0.61 1.01 0.24 0.19 121.20 119.29 1rk7 s ILE 17 Ca 0.63 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.71 1rk7 s ILE 17 Cb -0.21 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 1rk7 s ILE 17 CO 0.64 -0.55 -0.04 -0.51 0.00 0.00 0.00 174.94 174.49 1rk7 s ILE 18 N 2.17 3.88 0.00 2.92 1.10 0.73 -1.20 121.20 130.79 1rk7 s ILE 18 Ca 0.07 -0.36 0.06 0.00 -0.51 0.00 0.00 60.65 59.92 1rk7 s ILE 18 Cb -0.16 -2.70 -0.02 0.00 0.15 0.00 0.00 42.46 39.73 1rk7 s ILE 18 CO -0.28 0.49 -0.19 0.20 -2.11 0.00 0.00 174.94 173.04 1rk7 s ASN 19 N 0.40 2.29 -0.29 4.50 -0.87 0.15 0.20 114.94 121.31 1rk7 s ASN 19 Ca -0.04 -0.40 -0.03 0.00 -1.57 0.00 0.00 52.86 50.82 1rk7 s ASN 19 Cb -0.14 -0.23 0.04 0.00 -0.02 0.00 0.00 41.25 40.89 1rk7 s ASN 19 CO 0.03 0.21 0.01 -0.36 -2.57 0.00 0.00 177.10 174.42 1rk7 s PHE 20 N -0.56 3.20 -0.07 2.20 0.40 0.30 -2.47 117.98 120.98 1rk7 s PHE 20 Ca 0.07 -1.61 0.01 0.00 -0.60 0.00 0.00 56.93 54.80 1rk7 s PHE 20 Cb -0.08 -2.14 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 1rk7 s PHE 20 CO 0.00 -0.75 -0.07 -2.00 0.70 0.00 0.00 175.22 173.10 1rk7 s GLU 21 N 1.33 2.75 -0.41 0.44 2.12 -0.84 0.17 118.70 124.25 1rk7 s GLU 21 Ca -0.02 -0.56 0.04 0.00 0.36 0.00 0.00 54.97 54.79 1rk7 s GLU 21 Cb -0.19 -2.58 0.17 0.00 0.26 0.00 0.00 34.13 31.79 1rk7 s GLU 21 CO -0.01 0.65 0.34 -1.14 -0.54 0.00 0.00 175.26 174.56 1rk7 s GLN 22 N -0.78 0.90 -0.93 4.30 0.74 -1.13 0.18 119.66 122.95 1rk7 s GLN 22 Ca 0.12 -2.10 -0.06 0.00 0.05 0.00 0.00 55.36 53.36 1rk7 s GLN 22 Cb -0.11 -1.41 -0.08 0.00 1.10 0.00 0.00 33.01 32.51 1rk7 s GLN 22 CO 0.01 -1.39 2.39 1.17 -0.55 0.00 0.00 175.29 176.92 1rk7 n LYS 23 N 2.85 2.34 0.00 1.67 4.81 -1.26 0.19 118.16 128.75 1rk7 n LYS 23 Ca 0.30 -1.50 0.00 0.00 -0.87 0.00 0.00 58.31 56.24 1rk7 n LYS 23 Cb 0.48 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.10 1rk7 n LYS 23 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1rk7 n GLU 24 N 3.81 0.00 -0.12 1.64 0.00 -1.26 -4.71 120.64 120.00 1rk7 n GLU 24 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.66 1rk7 n GLU 24 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 31.44 31.65 1rk7 n GLU 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1rk7 n SER 25 N -2.30 0.00 -0.87 4.31 2.88 -1.12 -4.58 113.62 111.94 1rk7 n SER 25 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1rk7 n SER 25 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1rk7 n SER 25 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1rk7 n ASN 26 N 0.00 -0.72 0.00 -3.46 3.02 -1.26 -5.05 115.26 107.79 1rk7 n ASN 26 Ca 0.00 -1.73 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 1rk7 n ASN 26 Cb 0.00 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rk7 n GLY 27 N 0.00 5.88 3.74 7.41 0.00 -1.26 -5.12 105.19 115.85 1rk7 n GLY 27 Ca -0.20 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1rk7 n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rk7 s PRO 28 N 1.50 4.59 -0.36 1.61 0.04 -1.26 -4.69 135.00 136.44 1rk7 s PRO 28 Ca 0.00 1.75 -0.20 0.00 0.04 0.00 0.00 61.00 62.59 1rk7 s PRO 28 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1rk7 s PRO 28 CO 0.00 0.09 0.61 0.08 0.04 0.00 0.00 177.00 177.82 1rk7 s VAL 29 N -0.43 4.92 -0.82 -0.36 1.01 0.28 -4.63 120.40 120.37 1rk7 s VAL 29 Ca 0.49 0.49 -0.25 0.00 0.00 0.00 0.00 61.98 62.70 1rk7 s VAL 29 Cb -0.30 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1rk7 s VAL 29 CO 0.36 -0.31 1.80 -0.54 0.00 0.00 0.00 175.10 176.41 1rk7 s LYS 30 N 2.64 2.77 -0.09 2.72 1.02 0.48 -2.81 119.74 126.47 1rk7 s LYS 30 Ca 0.23 -0.13 -0.21 0.00 0.02 0.00 0.00 55.97 55.88 1rk7 s LYS 30 Cb -0.15 -4.83 -0.04 0.00 -0.52 0.00 0.00 37.83 32.30 1rk7 s LYS 30 CO 0.15 -2.93 0.60 0.08 -0.92 0.00 0.00 175.35 172.33 1rk7 s VAL 31 N 8.74 5.10 -0.08 3.17 1.01 0.91 -1.99 120.40 137.26 1rk7 s VAL 31 Ca 0.63 1.23 -0.29 0.00 0.00 0.00 0.00 61.98 63.55 1rk7 s VAL 31 Cb -0.08 -3.94 0.07 0.00 0.00 0.00 0.00 36.38 32.43 1rk7 s VAL 31 CO 0.06 0.29 0.67 -1.66 0.00 0.00 0.00 175.10 174.45 1rk7 s TRP 32 N 0.70 -0.66 0.07 5.22 -2.14 -1.03 -0.40 118.94 120.71 1rk7 s TRP 32 Ca 0.33 1.20 -0.05 0.00 2.66 0.00 0.00 56.10 60.24 1rk7 s TRP 32 Cb -0.17 0.38 0.02 0.00 -3.10 0.00 0.00 33.47 30.60 1rk7 s TRP 32 CO 0.15 -0.57 0.23 0.41 -2.66 0.00 0.00 176.95 174.51 1rk7 n GLY 33 N 1.17 1.41 3.50 3.67 0.00 -1.15 -0.68 105.19 113.11 1rk7 n GLY 33 Ca -0.18 -1.02 -0.05 0.00 0.00 0.00 0.00 46.02 44.77 1rk7 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rk7 s SER 34 N -1.56 -0.79 0.52 1.61 1.04 -0.35 -1.55 113.70 112.62 1rk7 s SER 34 Ca 0.05 1.34 -0.02 0.00 0.48 0.00 0.00 55.95 57.80 1rk7 s SER 34 Cb -0.01 1.82 0.01 0.00 0.10 0.00 0.00 66.02 67.94 1rk7 s SER 34 CO 0.02 -0.22 0.78 -0.63 0.98 0.00 0.00 173.24 174.16 1rk7 s ILE 35 N 2.61 3.57 -0.19 -1.02 1.01 0.30 0.82 121.20 128.29 1rk7 s ILE 35 Ca -0.05 -0.36 -0.05 0.00 0.00 0.00 0.00 60.65 60.19 1rk7 s ILE 35 Cb -0.11 -3.36 0.10 0.00 0.01 0.00 0.00 42.46 39.09 1rk7 s ILE 35 CO -0.17 -0.30 0.33 -0.54 0.00 0.00 0.00 174.94 174.27 1rk7 s LYS 36 N -4.76 0.26 0.00 2.79 1.02 -1.26 -2.71 119.74 115.08 1rk7 s LYS 36 Ca 0.52 0.68 0.00 0.00 0.02 0.00 0.00 55.97 57.19 1rk7 s LYS 36 Cb -0.10 -0.25 0.00 0.00 -0.52 0.00 0.00 37.83 36.96 1rk7 s LYS 36 CO 0.41 -0.44 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 1rk7 n GLY 37 N 5.36 3.65 3.53 -3.33 0.00 -1.24 -2.45 105.19 110.71 1rk7 n GLY 37 Ca -0.06 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 1rk7 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rk7 n LEU 38 N 0.00 1.07 -3.67 0.99 4.32 -1.00 -4.77 117.00 113.95 1rk7 n LEU 38 Ca 0.00 -2.25 -0.33 0.00 -0.02 0.00 0.00 56.01 53.40 1rk7 n LEU 38 Cb 0.00 -1.62 0.02 0.00 -1.62 0.00 0.00 43.42 40.20 1rk7 n LEU 38 CO 0.00 -3.38 -0.81 0.35 -1.22 0.00 0.00 177.39 172.33 1rk7 n THR 39 N 8.67 0.00 -1.63 -5.08 -2.24 -1.25 -4.03 114.28 108.72 1rk7 n THR 39 Ca 0.39 -0.44 -0.59 0.00 -2.27 0.00 0.00 64.05 61.14 1rk7 n THR 39 Cb 0.46 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.62 1rk7 n THR 39 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1rk7 n GLU 40 N 1.67 0.57 0.00 -0.78 0.28 -1.26 -4.48 120.64 116.65 1rk7 n GLU 40 Ca 0.04 0.21 0.00 0.00 -0.16 0.00 0.00 57.16 57.24 1rk7 n GLU 40 Cb 0.45 -1.79 0.00 0.00 1.43 0.00 0.00 31.44 31.53 1rk7 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1rk7 n GLY 41 N 2.96 2.93 3.79 -1.84 0.00 -1.26 -4.87 105.19 106.90 1rk7 n GLY 41 Ca 0.24 -1.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rk7 s LEU 42 N 0.00 3.39 -0.48 0.99 1.02 -1.26 -2.60 118.68 119.74 1rk7 s LEU 42 Ca 0.00 1.88 0.06 0.00 0.02 0.00 0.00 54.13 56.09 1rk7 s LEU 42 Cb 0.00 -4.54 0.21 0.00 0.02 0.00 0.00 46.19 41.89 1rk7 s LEU 42 CO 0.00 -1.45 0.70 1.41 0.02 0.00 0.00 176.35 177.04 1rk7 n HIS 43 N -2.39 -2.79 0.00 0.29 8.25 -0.39 -4.05 115.22 114.13 1rk7 n HIS 43 Ca 0.09 -2.07 0.00 0.00 -0.26 0.00 0.00 57.72 55.48 1rk7 n HIS 43 Cb 0.53 1.10 0.00 0.00 1.12 0.00 0.00 29.99 32.73 1rk7 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rk7 n GLY 44 N 2.25 0.93 3.55 -1.41 0.00 -1.16 -3.23 105.19 106.13 1rk7 n GLY 44 Ca 0.17 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1rk7 n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1rk7 s PHE 45 N 0.00 0.66 0.60 1.61 5.36 -1.26 -2.43 117.98 122.52 1rk7 s PHE 45 Ca 0.00 -0.99 0.03 0.00 -0.96 0.00 0.00 56.93 55.01 1rk7 s PHE 45 Cb 0.00 0.10 0.07 0.00 -0.34 0.00 0.00 43.02 42.85 1rk7 s PHE 45 CO 0.00 -1.08 0.83 -3.38 -1.46 0.00 0.00 175.22 170.13 1rk7 s HIS 46 N -3.50 2.11 -0.27 10.12 -3.43 -1.24 -4.22 115.29 114.85 1rk7 s HIS 46 Ca 0.26 -0.30 -0.02 0.00 -0.80 0.00 0.00 55.06 54.21 1rk7 s HIS 46 Cb -0.01 -2.68 -0.02 0.00 -1.43 0.00 0.00 32.58 28.44 1rk7 s HIS 46 CO 0.14 -1.17 0.24 0.28 -2.00 0.00 0.00 174.74 172.22 1rk7 n VAL 47 N -2.44 -3.15 -3.37 -5.38 0.31 -1.24 -4.64 118.33 98.42 1rk7 n VAL 47 Ca 0.12 -0.34 -0.11 0.00 -0.01 0.00 0.00 64.34 64.00 1rk7 n VAL 47 Cb 0.60 -3.94 -0.09 0.00 -0.91 0.00 0.00 33.84 29.51 1rk7 n VAL 47 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1rk7 s HIS 48 N -3.10 -0.73 -0.82 3.52 -3.43 -1.26 -4.58 115.29 104.89 1rk7 s HIS 48 Ca 0.12 0.63 -0.15 0.00 -0.80 0.00 0.00 55.06 54.85 1rk7 s HIS 48 Cb -0.02 -0.09 0.19 0.00 -1.43 0.00 0.00 32.58 31.24 1rk7 s HIS 48 CO 0.19 -0.74 0.82 -1.21 -2.00 0.00 0.00 174.74 171.80 1rk7 s GLU 49 N 2.50 3.54 -0.66 -0.38 8.01 -1.26 -4.93 118.70 125.52 1rk7 s GLU 49 Ca 0.11 -2.22 0.06 0.00 0.01 0.00 0.00 54.97 52.93 1rk7 s GLU 49 Cb -0.15 -4.51 0.23 0.00 -4.31 0.00 0.00 34.13 25.39 1rk7 s GLU 49 CO -0.18 -1.40 0.67 0.39 0.01 0.00 0.00 175.26 174.76 1rk7 n GLU 50 N 4.68 2.31 -2.76 1.61 1.02 -1.26 -4.66 120.64 121.58 1rk7 n GLU 50 Ca 0.13 -4.60 0.01 0.00 -0.02 0.00 0.00 57.16 52.68 1rk7 n GLU 50 Cb 0.47 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.64 1rk7 n GLU 50 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1rk7 n GLU 51 N 1.17 0.04 0.00 3.49 1.02 -1.26 -4.78 120.64 120.32 1rk7 n GLU 51 Ca 0.27 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1rk7 n GLU 51 Cb 0.40 0.47 0.00 0.00 -0.02 0.00 0.00 31.44 32.29 1rk7 n GLU 51 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1rk7 n ASP 52 N -0.48 0.00 -1.09 1.62 2.03 -1.26 -4.84 116.55 112.53 1rk7 n ASP 52 Ca 0.02 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.33 1rk7 n ASP 52 Cb 0.23 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 1rk7 n ASP 52 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1rk7 n ASN 53 N 0.00 -2.01 -0.12 1.67 5.15 -1.26 -5.01 115.26 113.68 1rk7 n ASN 53 Ca 0.00 -0.01 -0.24 0.00 -0.60 0.00 0.00 54.58 53.73 1rk7 n ASN 53 Cb 0.00 -0.58 -0.11 0.00 -0.53 0.00 0.00 39.78 38.56 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1rk7 n THR 54 N -1.10 1.54 -1.07 -0.44 5.66 -1.26 -5.11 114.28 112.50 1rk7 n THR 54 Ca -0.00 -0.44 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 1rk7 n THR 54 Cb 0.50 -1.72 0.00 0.00 -1.55 0.00 0.00 70.33 67.56 1rk7 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rk7 n ALA 55 N -3.70 -2.69 0.00 1.79 0.00 -1.26 -4.83 120.51 109.81 1rk7 n ALA 55 Ca -0.47 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1rk7 n ALA 55 Cb 0.92 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1rk7 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk7 n GLY 56 N 0.61 3.11 0.00 0.00 0.00 -1.26 -5.02 105.19 102.64 1rk7 n GLY 56 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1rk7 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk7 s THR 58 N 2.65 -0.16 -0.45 0.00 -4.23 -1.26 -5.06 115.64 107.13 1rk7 s THR 58 Ca 0.00 0.27 0.04 0.00 -1.18 0.00 0.00 61.69 60.82 1rk7 s THR 58 Cb 0.00 -0.30 0.19 0.00 1.34 0.00 0.00 72.50 73.73 1rk7 s THR 58 CO 0.00 0.06 0.78 -0.44 -0.54 0.00 0.00 174.62 174.48 1rk7 s SER 59 N 2.21 -1.23 -0.00 3.99 0.01 -1.26 -5.00 113.70 112.42 1rk7 s SER 59 Ca 0.04 -1.16 0.00 0.00 1.31 0.00 0.00 55.95 56.14 1rk7 s SER 59 Cb -0.13 1.60 -0.00 0.00 0.21 0.00 0.00 66.02 67.70 1rk7 s SER 59 CO -0.05 -0.08 -0.00 0.00 0.41 0.00 0.00 173.24 173.52 1rk7 n ALA 60 N 3.36 2.01 -3.43 1.44 0.00 -1.26 -4.42 120.51 118.22 1rk7 n ALA 60 Ca 0.14 -0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.38 1rk7 n ALA 60 Cb 0.58 0.49 -0.11 0.00 0.00 0.00 0.00 19.45 20.42 1rk7 n ALA 60 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 61 N -4.04 -0.01 0.11 0.00 0.00 -1.26 -5.13 107.32 96.98 1rk7 s GLY 61 Ca -0.00 -0.49 -0.30 0.00 0.00 0.00 0.00 44.72 43.92 1rk7 s GLY 61 CO 0.01 2.54 1.14 2.56 0.00 0.00 0.00 173.10 179.35 1rk7 s PRO 62 N 2.28 4.50 -0.45 2.90 0.04 -1.26 -4.98 135.00 138.03 1rk7 s PRO 62 Ca 0.10 1.73 0.06 0.00 0.04 0.00 0.00 61.00 62.92 1rk7 s PRO 62 Cb -0.14 -3.32 0.20 0.00 0.04 0.00 0.00 34.50 31.27 1rk7 s PRO 62 CO -0.33 -0.11 0.56 0.72 0.04 0.00 0.00 177.00 177.88 1rk7 n HIS 63 N 3.26 -1.96 0.00 0.56 8.25 -1.26 -5.06 115.22 119.01 1rk7 n HIS 63 Ca 0.06 -2.61 0.00 0.00 -0.26 0.00 0.00 57.72 54.92 1rk7 n HIS 63 Cb 0.47 0.66 0.00 0.00 1.12 0.00 0.00 29.99 32.24 1rk7 n HIS 63 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1rk7 n PHE 64 N 2.40 -0.61 -3.31 4.41 3.72 -1.26 -4.91 117.46 117.90 1rk7 n PHE 64 Ca 0.22 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.22 1rk7 n PHE 64 Cb 0.53 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.99 1rk7 n PHE 64 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1rk7 s ASN 65 N -2.01 6.33 -1.23 4.37 -0.87 -1.26 -4.98 114.94 115.29 1rk7 s ASN 65 Ca 0.00 0.34 -0.20 0.00 -1.57 0.00 0.00 52.86 51.43 1rk7 s ASN 65 Cb 0.00 -2.25 -0.01 0.00 -0.02 0.00 0.00 41.25 38.97 1rk7 s ASN 65 CO 0.00 -0.26 1.86 -0.81 -2.57 0.00 0.00 177.10 175.32 1rk7 n PRO 66 N 5.47 2.39 0.00 -0.60 -0.04 -1.26 -2.99 135.00 137.97 1rk7 n PRO 66 Ca -0.06 -2.81 0.00 0.00 -0.04 0.00 0.00 63.50 60.59 1rk7 n PRO 66 Cb 0.50 -3.55 0.00 0.00 -0.04 0.00 0.00 33.50 30.41 1rk7 n PRO 66 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1rk7 n LEU 67 N 10.77 0.00 0.00 1.53 -0.00 -1.26 -5.03 117.00 123.01 1rk7 n LEU 67 Ca 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.48 1rk7 n LEU 67 Cb 0.45 0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.90 1rk7 n LEU 67 CO 0.76 -0.03 0.16 -0.24 -0.00 0.00 0.00 177.39 178.04 1rk7 n SER 68 N -1.05 0.00 0.00 1.96 2.88 -1.16 -4.02 113.62 112.23 1rk7 n SER 68 Ca 0.00 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 1rk7 n SER 68 Cb 0.00 -0.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 1rk7 n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1rk7 n ARG 69 N -1.22 0.00 -3.37 -1.46 1.74 -1.26 -3.56 116.66 107.53 1rk7 n ARG 69 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1rk7 n ARG 69 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1rk7 n LYS 70 N 0.00 1.26 0.00 5.56 5.02 -1.26 -4.87 118.16 123.87 1rk7 n LYS 70 Ca 0.00 -2.05 0.00 0.00 -2.02 0.00 0.00 58.31 54.24 1rk7 n LYS 70 Cb 0.00 0.49 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 1rk7 n LYS 70 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1rk7 n HIS 71 N -0.81 0.00 0.00 2.13 1.44 0.49 -4.62 115.22 113.85 1rk7 n HIS 71 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 1rk7 n HIS 71 Cb 0.36 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.47 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1rk7 n GLY 72 N 0.00 3.59 0.00 -1.39 0.00 -1.26 -3.69 105.19 102.44 1rk7 n GLY 72 Ca 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1rk7 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk7 n GLY 73 N -0.61 0.52 0.00 -0.02 0.00 -0.75 -4.78 105.19 99.55 1rk7 n GLY 73 Ca 0.00 -1.15 0.10 0.00 0.00 0.00 0.00 46.02 44.97 1rk7 n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 74 N 0.00 0.75 -2.93 1.61 -0.04 -1.26 -3.23 135.00 129.90 1rk7 n PRO 74 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1rk7 n PRO 74 Cb 0.00 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 1rk7 n PRO 74 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1rk7 n LYS 75 N -0.91 1.05 0.00 0.54 2.85 -1.26 -5.04 118.16 115.39 1rk7 n LYS 75 Ca 0.15 -3.27 0.00 0.00 -1.05 0.00 0.00 58.31 54.13 1rk7 n LYS 75 Cb 0.07 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 32.99 1rk7 n LYS 75 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1rk7 n ASP 76 N 0.11 0.00 -0.00 -5.58 -0.08 -1.20 -4.58 116.55 105.22 1rk7 n ASP 76 Ca 0.17 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.58 1rk7 n ASP 76 Cb 0.74 0.00 0.43 0.00 2.34 0.00 0.00 41.12 44.63 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1rk7 n GLU 77 N 0.00 0.02 0.00 -0.67 0.00 -1.26 -1.81 120.64 116.91 1rk7 n GLU 77 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.15 1rk7 n GLU 77 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 29.94 1rk7 n GLU 77 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1rk7 n GLU 78 N -1.49 1.55 -4.07 5.31 4.07 -1.26 -4.98 120.64 119.78 1rk7 n GLU 78 Ca 0.06 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.92 1rk7 n GLU 78 Cb 0.34 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.67 1rk7 n GLU 78 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1rk7 s ARG 79 N 0.00 3.03 -0.59 5.31 3.00 -1.23 -4.79 118.95 123.68 1rk7 s ARG 79 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 55.73 54.87 1rk7 s ARG 79 Cb 0.00 -2.68 0.39 0.00 0.00 0.00 0.00 34.95 32.66 1rk7 s ARG 79 CO 0.00 0.46 1.45 1.58 0.00 0.00 0.00 175.30 178.79 1rk7 n HIS 80 N -0.76 3.25 -4.25 -0.53 -0.00 -1.24 -4.09 115.22 107.61 1rk7 n HIS 80 Ca -0.08 -2.82 -0.33 0.00 0.46 0.00 0.00 57.72 54.95 1rk7 n HIS 80 Cb 0.56 -0.49 -0.06 0.00 -0.12 0.00 0.00 29.99 29.88 1rk7 n HIS 80 CO 0.00 0.00 0.00 1.55 0.46 0.00 0.00 176.34 178.35 1rk7 n VAL 81 N -0.51 -1.33 0.00 3.57 3.14 -1.26 -4.06 118.33 117.88 1rk7 n VAL 81 Ca 0.45 -0.29 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 1rk7 n VAL 81 Cb 0.51 -1.47 0.00 0.00 -1.06 0.00 0.00 33.84 31.82 1rk7 n VAL 81 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1rk7 n GLY 82 N -1.88 0.22 1.80 7.55 0.00 -1.26 -4.67 105.19 106.94 1rk7 n GLY 82 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 1rk7 n GLY 82 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 83 N 0.00 -3.37 0.00 1.61 2.03 -1.26 -4.99 116.55 110.58 1rk7 n ASP 83 Ca 0.00 0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.51 1rk7 n ASP 83 Cb 0.00 -2.00 0.00 0.00 -0.72 0.00 0.00 41.12 38.40 1rk7 n ASP 83 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1rk7 n LEU 84 N -0.21 0.00 0.00 -2.67 -0.00 -1.26 -4.97 117.00 107.89 1rk7 n LEU 84 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.03 1rk7 n LEU 84 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.48 1rk7 n LEU 84 CO 0.11 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.11 1rk7 n GLY 85 N 0.00 -0.33 2.91 -3.96 0.00 -1.26 -4.88 105.19 97.67 1rk7 n GLY 85 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1rk7 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rk7 s ASN 86 N -4.00 0.66 0.34 1.61 0.01 -1.26 -4.38 114.94 107.93 1rk7 s ASN 86 Ca 0.00 -0.09 -0.13 0.00 -0.71 0.00 0.00 52.86 51.93 1rk7 s ASN 86 Cb 0.00 -0.22 -0.08 0.00 0.41 0.00 0.00 41.25 41.36 1rk7 s ASN 86 CO 0.00 -0.01 0.73 0.68 -1.51 0.00 0.00 177.10 176.99 1rk7 s VAL 87 N 0.44 4.73 0.04 1.60 -7.23 -1.02 -4.88 120.40 114.08 1rk7 s VAL 87 Ca -0.05 0.80 0.03 0.00 -1.81 0.00 0.00 61.98 60.95 1rk7 s VAL 87 Cb -0.08 -3.65 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 1rk7 s VAL 87 CO -0.00 -0.28 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.52 1rk7 s THR 88 N -2.10 0.65 0.78 5.32 2.01 -1.26 -1.27 115.64 119.77 1rk7 s THR 88 Ca 0.53 -0.99 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1rk7 s THR 88 Cb -0.10 -0.67 0.11 0.00 0.01 0.00 0.00 72.50 71.85 1rk7 s THR 88 CO 0.22 -0.26 1.09 0.00 -0.69 0.00 0.00 174.62 174.98 1rk7 s ALA 89 N -1.15 3.02 0.00 7.40 0.00 -1.07 -4.47 121.76 125.49 1rk7 s ALA 89 Ca -0.06 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.75 1rk7 s ALA 89 Cb -0.09 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1rk7 s ALA 89 CO 0.01 -1.63 0.00 -3.47 0.00 0.00 0.00 175.76 170.66 1rk7 n ASP 90 N -3.13 0.00 -0.08 0.00 2.03 0.37 -4.36 116.55 111.38 1rk7 n ASP 90 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 1rk7 n ASP 90 Cb 0.60 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 1rk7 n ASP 90 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1rk7 n LYS 91 N 0.00 0.32 -0.16 -0.67 2.85 -1.26 -4.67 118.16 114.57 1rk7 n LYS 91 Ca 0.00 -0.72 0.00 0.00 -1.05 0.00 0.00 58.31 56.55 1rk7 n LYS 91 Cb 0.00 -0.57 0.01 0.00 -0.65 0.00 0.00 35.03 33.82 1rk7 n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1rk7 n ASP 92 N -0.08 0.24 0.00 -5.58 9.92 -1.26 -4.90 116.55 114.89 1rk7 n ASP 92 Ca 0.00 -1.47 0.00 0.00 -0.53 0.00 0.00 54.79 52.79 1rk7 n ASP 92 Cb 0.51 -0.08 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1rk7 n GLY 93 N -0.10 1.82 3.74 0.44 0.00 -1.26 -4.43 105.19 105.40 1rk7 n GLY 93 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1rk7 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rk7 s VAL 94 N -3.03 4.27 -0.17 1.61 1.01 -1.26 -2.36 120.40 120.47 1rk7 s VAL 94 Ca 0.00 1.99 0.00 0.00 0.00 0.00 0.00 61.98 63.97 1rk7 s VAL 94 Cb 0.00 -4.27 0.03 0.00 0.00 0.00 0.00 36.38 32.14 1rk7 s VAL 94 CO 0.00 0.35 -0.12 0.00 0.00 0.00 0.00 175.10 175.34 1rk7 s ALA 95 N -0.34 1.87 0.11 5.51 0.00 -1.10 0.14 121.76 127.94 1rk7 s ALA 95 Ca 0.46 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.44 1rk7 s ALA 95 Cb -0.25 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.69 1rk7 s ALA 95 CO 0.31 -0.58 0.19 0.16 0.00 0.00 0.00 175.76 175.85 1rk7 s ASP 96 N 1.47 6.05 0.19 0.00 -4.77 -1.26 0.11 116.67 118.46 1rk7 s ASP 96 Ca 0.02 0.12 0.07 0.00 -3.30 0.00 0.00 52.55 49.46 1rk7 s ASP 96 Cb -0.14 -1.76 -0.05 0.00 -1.09 0.00 0.00 42.92 39.88 1rk7 s ASP 96 CO -0.09 0.12 -0.14 -0.69 0.70 0.00 0.00 175.17 175.07 1rk7 s VAL 97 N -1.59 1.64 -0.34 2.11 1.01 -0.60 -4.91 120.40 117.73 1rk7 s VAL 97 Ca 0.33 -2.15 -0.03 0.00 0.00 0.00 0.00 61.98 60.13 1rk7 s VAL 97 Cb -0.12 -1.98 0.19 0.00 0.00 0.00 0.00 36.38 34.47 1rk7 s VAL 97 CO 0.26 -0.59 0.88 -0.94 0.00 0.00 0.00 175.10 174.71 1rk7 s SER 98 N -3.21 -0.84 0.08 3.32 1.04 -1.21 -2.92 113.70 109.96 1rk7 s SER 98 Ca 0.21 -0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.37 1rk7 s SER 98 Cb -0.01 1.19 -0.04 0.00 0.10 0.00 0.00 66.02 67.26 1rk7 s SER 98 CO 0.06 -0.11 -0.06 -0.63 0.98 0.00 0.00 173.24 173.48 1rk7 s ILE 99 N 2.18 0.59 -0.38 -1.02 1.01 0.47 -4.99 121.20 119.06 1rk7 s ILE 99 Ca 0.17 -1.82 0.02 0.00 0.00 0.00 0.00 60.65 59.02 1rk7 s ILE 99 Cb -0.01 -1.53 0.11 0.00 0.01 0.00 0.00 42.46 41.04 1rk7 s ILE 99 CO -0.15 -0.84 0.14 -1.83 0.00 0.00 0.00 174.94 172.26 1rk7 s GLU 100 N -3.59 1.24 -0.10 2.79 -1.05 -1.26 -0.06 118.70 116.66 1rk7 s GLU 100 Ca 0.09 -1.74 -0.17 0.00 -0.15 0.00 0.00 54.97 53.00 1rk7 s GLU 100 Cb 0.04 -2.58 -0.05 0.00 -0.44 0.00 0.00 34.13 31.10 1rk7 s GLU 100 CO -0.05 -1.04 0.43 -0.51 0.95 0.00 0.00 175.26 175.05 1rk7 s ASP 101 N 0.84 6.67 -0.10 0.83 1.11 -1.12 -4.79 116.67 120.11 1rk7 s ASP 101 Ca 0.13 0.79 -0.03 0.00 0.18 0.00 0.00 52.55 53.62 1rk7 s ASP 101 Cb -0.21 -2.26 -0.05 0.00 1.07 0.00 0.00 42.92 41.47 1rk7 s ASP 101 CO -0.10 0.08 -0.11 -1.54 1.18 0.00 0.00 175.17 174.67 1rk7 n SER 102 N 3.29 1.45 -0.24 0.27 3.41 -1.26 1.00 113.62 121.54 1rk7 n SER 102 Ca -0.09 0.07 -0.03 0.00 -0.26 0.00 0.00 58.87 58.56 1rk7 n SER 102 Cb 0.52 -0.24 0.04 0.00 -0.26 0.00 0.00 64.21 64.26 1rk7 n SER 102 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1rk7 h VAL 103 N -0.25 0.18 -3.49 -3.33 2.07 -1.92 -3.41 116.25 106.11 1rk7 h VAL 103 Ca -0.23 0.00 -0.41 0.00 0.82 0.00 0.00 66.70 66.87 1rk7 h VAL 103 Cb 1.24 0.18 0.19 0.00 -1.52 0.00 0.00 31.29 31.39 1rk7 h VAL 103 CO -0.12 0.00 0.11 0.27 0.02 0.00 0.00 177.57 177.86 1rk7 s ILE 104 N -6.07 1.61 0.09 4.57 -5.25 -1.26 -4.97 121.20 109.92 1rk7 s ILE 104 Ca -0.14 0.00 -0.16 0.00 -0.99 0.00 0.00 60.65 59.35 1rk7 s ILE 104 Cb 0.18 -2.45 0.03 0.00 2.95 0.00 0.00 42.46 43.18 1rk7 s ILE 104 CO 0.71 0.00 0.39 -0.44 -1.79 0.00 0.00 174.94 173.81 1rk7 s SER 105 N -3.77 -0.23 0.23 4.36 0.01 -1.03 -4.92 113.70 108.34 1rk7 s SER 105 Ca 0.70 -0.22 0.11 0.00 1.31 0.00 0.00 55.95 57.85 1rk7 s SER 105 Cb -0.11 0.45 0.12 0.00 0.21 0.00 0.00 66.02 66.69 1rk7 s SER 105 CO 0.56 -0.78 1.46 -0.07 0.41 0.00 0.00 173.24 174.83 1rk7 h LEU 106 N 2.63 0.00 -7.32 2.44 3.38 -1.93 1.06 115.31 115.56 1rk7 h LEU 106 Ca -0.33 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 1rk7 h LEU 106 Cb 1.23 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.85 1rk7 h LEU 106 CO 0.46 0.71 -0.03 -0.55 0.09 0.00 0.00 178.44 179.13 1rk7 s SER 107 N -6.65 -0.30 0.00 -0.43 0.15 -1.26 -3.78 113.70 101.43 1rk7 s SER 107 Ca 0.01 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.47 1rk7 s SER 107 Cb 0.10 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 1rk7 s SER 107 CO 0.77 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1rk7 n GLY 108 N -0.09 2.10 1.79 9.45 0.00 -1.26 -4.66 105.19 112.52 1rk7 n GLY 108 Ca -0.17 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1rk7 n GLY 108 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rk7 n ASP 109 N 0.00 0.00 -1.94 1.61 9.92 -1.26 -4.82 116.55 120.06 1rk7 n ASP 109 Ca 0.00 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 54.06 1rk7 n ASP 109 Cb 0.00 0.00 0.07 0.00 -0.64 0.00 0.00 41.12 40.55 1rk7 n ASP 109 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1rk7 n HIS 110 N -2.60 2.01 -1.63 1.24 8.25 -1.26 -4.96 115.22 116.27 1rk7 n HIS 110 Ca 0.00 -1.97 -0.55 0.00 -0.26 0.00 0.00 57.72 54.94 1rk7 n HIS 110 Cb 0.10 -0.96 -0.07 0.00 1.12 0.00 0.00 29.99 30.18 1rk7 n HIS 110 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1rk7 n SER 111 N -0.20 2.37 0.10 0.41 2.88 -1.19 -2.47 113.62 115.51 1rk7 n SER 111 Ca 0.39 0.90 0.03 0.00 -1.33 0.00 0.00 58.87 58.86 1rk7 n SER 111 Cb 0.82 -1.18 -0.01 0.00 -0.75 0.00 0.00 64.21 63.09 1rk7 n SER 111 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1rk7 h ILE 112 N 5.77 0.56 -1.95 2.46 3.07 0.11 -3.47 117.51 124.07 1rk7 h ILE 112 Ca -0.41 -1.91 -0.65 0.00 1.55 0.00 0.00 64.86 63.44 1rk7 h ILE 112 Cb 1.32 2.13 0.07 0.00 -0.27 0.00 0.00 36.82 40.07 1rk7 h ILE 112 CO 0.98 0.32 0.39 -0.38 -1.05 0.00 0.00 178.15 178.41 1rk7 n ILE 113 N -3.02 0.58 0.00 0.16 5.41 -1.25 -2.74 119.36 118.50 1rk7 n ILE 113 Ca -0.03 -0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.58 1rk7 n ILE 113 Cb 0.74 -0.93 0.00 0.00 -0.71 0.00 0.00 39.64 38.74 1rk7 n ILE 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1rk7 n GLY 114 N 2.26 1.37 3.51 7.39 0.00 -1.23 -5.02 105.19 113.47 1rk7 n GLY 114 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1rk7 n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk7 n ARG 115 N -1.52 3.27 -1.53 1.61 1.74 -1.11 -4.82 116.66 114.30 1rk7 n ARG 115 Ca 0.00 -3.50 -0.15 0.00 -0.77 0.00 0.00 57.85 53.43 1rk7 n ARG 115 Cb 0.00 -3.30 -0.11 0.00 -1.02 0.00 0.00 32.46 28.02 1rk7 n ARG 115 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1rk7 n THR 116 N 5.61 0.00 -1.69 0.55 -1.04 -1.26 -4.08 114.28 112.37 1rk7 n THR 116 Ca 0.44 -0.47 -0.43 0.00 -2.04 0.00 0.00 64.05 61.55 1rk7 n THR 116 Cb 0.44 -1.42 -0.03 0.00 -1.82 0.00 0.00 70.33 67.51 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1rk7 s LEU 117 N 10.74 3.73 -0.22 -4.42 2.96 -1.26 -3.72 118.68 126.49 1rk7 s LEU 117 Ca 1.00 2.03 -0.04 0.00 -0.22 0.00 0.00 54.13 56.91 1rk7 s LEU 117 Cb -0.31 -3.52 0.10 0.00 0.50 0.00 0.00 46.19 42.95 1rk7 s LEU 117 CO 0.22 -1.67 0.20 0.54 -1.32 0.00 0.00 176.35 174.32 1rk7 s VAL 118 N 7.03 -0.28 1.19 1.68 0.11 -1.24 -2.41 120.40 126.48 1rk7 s VAL 118 Ca 0.94 -0.23 -0.19 0.00 -2.93 0.00 0.00 61.98 59.56 1rk7 s VAL 118 Cb -0.34 -0.73 0.29 0.00 -1.53 0.00 0.00 36.38 34.06 1rk7 s VAL 118 CO 0.36 -0.30 1.14 0.68 -3.33 0.00 0.00 175.10 173.65 1rk7 s VAL 119 N 2.28 1.61 0.28 2.04 -7.23 -1.26 -3.69 120.40 114.44 1rk7 s VAL 119 Ca 0.07 0.00 0.05 0.00 -1.81 0.00 0.00 61.98 60.28 1rk7 s VAL 119 Cb -0.16 -2.55 -0.02 0.00 0.56 0.00 0.00 36.38 34.21 1rk7 s VAL 119 CO -0.17 0.00 0.42 -1.00 -0.31 0.00 0.00 175.10 174.04 1rk7 s HIS 120 N -3.12 3.38 -0.37 2.82 3.76 -1.20 -4.06 115.29 116.51 1rk7 s HIS 120 Ca 0.72 -0.00 0.05 0.00 -0.15 0.00 0.00 55.06 55.68 1rk7 s HIS 120 Cb -0.08 -1.73 0.54 0.00 1.11 0.00 0.00 32.58 32.41 1rk7 s HIS 120 CO 0.56 0.27 1.60 -1.91 -0.85 0.00 0.00 174.74 174.41 1rk7 n GLU 121 N -1.53 2.57 0.00 1.40 2.13 -0.68 -4.71 120.64 119.82 1rk7 n GLU 121 Ca -0.06 -2.27 0.00 0.00 0.66 0.00 0.00 57.16 55.49 1rk7 n GLU 121 Cb 0.57 -1.94 0.00 0.00 0.27 0.00 0.00 31.44 30.34 1rk7 n GLU 121 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1rk7 n LYS 122 N -0.34 0.00 -2.00 5.31 4.81 -1.26 -4.96 118.16 119.72 1rk7 n LYS 122 Ca 0.37 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.51 1rk7 n LYS 122 Cb 1.24 0.00 0.19 0.00 0.02 0.00 0.00 35.03 36.48 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rk7 s ALA 123 N -2.00 2.33 -0.56 3.14 0.00 -1.26 -2.97 121.76 120.45 1rk7 s ALA 123 Ca 0.00 -1.32 0.01 0.00 0.00 0.00 0.00 51.96 50.65 1rk7 s ALA 123 Cb 0.00 -2.68 0.14 0.00 0.00 0.00 0.00 23.12 20.58 1rk7 s ALA 123 CO 0.00 -2.44 0.33 -0.51 0.00 0.00 0.00 175.76 173.14 1rk7 s ASP 124 N -4.91 4.73 0.66 0.00 1.01 -1.26 -4.51 116.67 112.38 1rk7 s ASP 124 Ca 0.75 -2.90 0.34 0.00 0.71 0.00 0.00 52.55 51.44 1rk7 s ASP 124 Cb -0.03 -1.73 1.86 0.00 1.01 0.00 0.00 42.92 44.02 1rk7 s ASP 124 CO 0.53 -0.30 2.07 -0.78 0.21 0.00 0.00 175.17 176.89 1rk7 h ASP 125 N 6.78 0.00 -1.01 0.27 3.58 -1.88 -3.44 116.42 120.72 1rk7 h ASP 125 Ca -0.05 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.03 1rk7 h ASP 125 Cb 0.92 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 41.83 1rk7 h ASP 125 CO 0.69 0.00 -0.33 0.18 -2.88 0.00 0.00 179.24 176.90 1rk7 n LEU 126 N -3.07 -1.24 0.00 2.28 4.77 -1.26 -4.71 117.00 113.77 1rk7 n LEU 126 Ca -0.01 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1rk7 n LEU 126 Cb 0.30 -2.65 0.00 0.00 -2.33 0.00 0.00 43.42 38.74 1rk7 n LEU 126 CO 0.17 -1.00 0.00 0.61 -1.33 0.00 0.00 177.39 175.84 1rk7 n GLY 127 N -0.27 -1.97 0.08 -0.72 0.00 -1.26 -4.95 105.19 96.10 1rk7 n GLY 127 Ca -0.18 0.93 0.03 0.00 0.00 0.00 0.00 46.02 46.80 1rk7 n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rk7 n LYS 128 N 0.00 0.64 0.00 1.61 5.02 -1.26 -4.99 118.16 119.18 1rk7 n LYS 128 Ca 0.00 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1rk7 n LYS 128 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 1rk7 n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1rk7 n GLY 129 N 1.39 3.13 0.00 0.72 0.00 -1.26 -5.11 105.19 104.06 1rk7 n GLY 129 Ca -0.11 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1rk7 n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk7 n GLY 130 N 0.00 -2.63 3.35 -0.02 0.00 -1.26 -5.09 105.19 99.53 1rk7 n GLY 130 Ca 0.00 -1.41 -0.14 0.00 0.00 0.00 0.00 46.02 44.47 1rk7 n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rk7 s ASN 131 N -1.58 -0.42 -0.55 1.61 0.01 -1.26 -4.79 114.94 107.96 1rk7 s ASN 131 Ca 0.00 0.66 0.00 0.00 -0.71 0.00 0.00 52.86 52.81 1rk7 s ASN 131 Cb 0.00 0.71 0.00 0.00 0.41 0.00 0.00 41.25 42.37 1rk7 s ASN 131 CO 0.00 -0.30 0.00 1.21 -1.51 0.00 0.00 177.10 176.50 1rk7 n GLU 132 N 2.12 -0.50 0.17 -0.60 2.13 -1.26 -4.79 120.64 117.91 1rk7 n GLU 132 Ca -0.16 0.32 0.00 0.00 0.66 0.00 0.00 57.16 57.97 1rk7 n GLU 132 Cb 0.57 -4.17 0.00 0.00 0.27 0.00 0.00 31.44 28.11 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1rk7 n GLN 133 N -1.64 0.00 0.03 5.31 7.27 -1.26 -4.91 117.38 122.18 1rk7 n GLN 133 Ca -0.07 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.12 1rk7 n GLN 133 Cb 0.55 0.00 0.27 0.00 2.41 0.00 0.00 30.24 33.47 1rk7 n GLN 133 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1rk7 n SER 134 N -3.28 0.53 0.18 1.69 3.41 -1.26 -2.08 113.62 112.80 1rk7 n SER 134 Ca 0.00 0.03 0.13 0.00 -0.26 0.00 0.00 58.87 58.77 1rk7 n SER 134 Cb 0.00 0.08 0.30 0.00 -0.26 0.00 0.00 64.21 64.33 1rk7 n SER 134 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1rk7 h THR 135 N 0.00 0.00 0.00 6.66 1.35 -1.91 -3.29 112.91 115.73 1rk7 h THR 135 Ca 0.00 -0.74 -0.21 0.00 -0.55 0.00 0.00 66.41 64.91 1rk7 h THR 135 Cb 0.61 1.73 -0.04 0.00 -1.73 0.00 0.00 68.15 68.72 1rk7 h THR 135 CO 0.00 0.00 -1.79 2.29 -0.25 0.00 0.00 175.52 175.77 1rk7 n LYS 136 N -2.75 1.81 0.00 4.72 2.85 -1.23 0.18 118.16 123.75 1rk7 n LYS 136 Ca 0.04 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.31 1rk7 n LYS 136 Cb 0.47 -1.29 0.00 0.00 -0.65 0.00 0.00 35.03 33.55 1rk7 n LYS 136 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1rk7 n THR 137 N -2.52 0.00 -1.98 0.58 -2.24 -0.88 -4.02 114.28 103.22 1rk7 n THR 137 Ca -0.20 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.53 1rk7 n THR 137 Cb 0.85 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.03 1rk7 n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rk7 n GLY 138 N 0.32 0.56 4.05 3.38 0.00 -1.19 -4.45 105.19 107.85 1rk7 n GLY 138 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1rk7 n GLY 138 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rk7 n ASN 139 N 0.00 -3.87 0.07 1.61 4.05 -1.08 -4.78 115.26 111.26 1rk7 n ASN 139 Ca -0.22 -0.89 0.00 0.00 0.45 0.00 0.00 54.58 53.92 1rk7 n ASN 139 Cb 0.65 -3.37 0.00 0.00 1.23 0.00 0.00 39.78 38.29 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1rk7 n ALA 140 N -4.53 3.00 -2.79 5.20 0.00 -1.26 -4.98 120.51 115.14 1rk7 n ALA 140 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 1rk7 n ALA 140 Cb 0.52 0.13 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk7 n GLY 141 N 2.78 0.02 2.99 0.00 0.00 -1.26 -4.95 105.19 104.76 1rk7 n GLY 141 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 1rk7 n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 s SER 142 N -0.88 -0.28 1.23 1.61 0.01 -1.26 -4.97 113.70 109.16 1rk7 s SER 142 Ca 0.03 0.42 -0.15 0.00 1.31 0.00 0.00 55.95 57.57 1rk7 s SER 142 Cb -0.00 1.45 0.31 0.00 0.21 0.00 0.00 66.02 67.98 1rk7 s SER 142 CO 0.08 -0.29 1.01 -0.13 0.41 0.00 0.00 173.24 174.31 1rk7 s ARG 143 N 2.65 -1.43 0.00 12.44 0.52 -1.26 -1.69 118.95 130.18 1rk7 s ARG 143 Ca 0.15 0.61 0.00 0.00 -0.52 0.00 0.00 55.73 55.97 1rk7 s ARG 143 Cb -0.15 -1.51 0.00 0.00 0.52 0.00 0.00 34.95 33.81 1rk7 s ARG 143 CO -0.18 -4.00 0.00 1.28 0.02 0.00 0.00 175.30 172.42 1rk7 n LEU 144 N -5.08 0.00 -4.55 2.53 4.32 -1.26 -4.74 117.00 108.23 1rk7 n LEU 144 Ca 0.05 0.00 -0.26 0.00 -0.02 0.00 0.00 56.01 55.78 1rk7 n LEU 144 Cb 0.56 0.15 -0.11 0.00 -1.62 0.00 0.00 43.42 42.40 1rk7 n LEU 144 CO 0.54 -0.42 -0.33 0.00 -1.22 0.00 0.00 177.39 175.96 1rk7 s ALA 145 N -1.65 2.89 -0.41 -1.18 0.00 -1.26 -1.97 121.76 118.18 1rk7 s ALA 145 Ca 0.00 -2.14 0.08 0.00 0.00 0.00 0.00 51.96 49.89 1rk7 s ALA 145 Cb 0.00 0.15 0.25 0.00 0.00 0.00 0.00 23.12 23.52 1rk7 s ALA 145 CO 0.00 -0.06 0.62 0.00 0.00 0.00 0.00 175.76 176.32 1rk7 h GLY 147 N 3.93 0.20 -2.90 0.00 0.00 -1.65 -3.43 103.07 99.22 1rk7 h GLY 147 Ca 0.02 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1rk7 h GLY 147 CO 0.43 -0.23 -0.70 -0.62 0.00 0.00 0.00 176.54 175.42 1rk7 n VAL 148 N -5.43 -4.38 -3.29 4.60 0.31 -1.26 -4.11 118.33 104.76 1rk7 n VAL 148 Ca 0.06 1.88 -0.38 0.00 -0.01 0.00 0.00 64.34 65.89 1rk7 n VAL 148 Cb 0.34 -2.61 -0.06 0.00 -0.91 0.00 0.00 33.84 30.60 1rk7 n VAL 148 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1rk7 s ILE 149 N -2.88 5.17 -0.03 2.52 1.09 -1.25 -3.72 121.20 122.11 1rk7 s ILE 149 Ca 0.00 0.99 -0.00 0.00 -1.10 0.00 0.00 60.65 60.54 1rk7 s ILE 149 Cb 0.00 -3.83 0.03 0.00 -1.06 0.00 0.00 42.46 37.59 1rk7 s ILE 149 CO 0.00 0.32 0.02 -0.83 -0.10 0.00 0.00 174.94 174.35 1rk7 s GLY 150 N 0.62 0.16 0.25 6.18 0.00 0.33 -3.57 107.32 111.29 1rk7 s GLY 150 Ca 0.27 0.25 -0.29 0.00 0.00 0.00 0.00 44.72 44.95 1rk7 s GLY 150 CO 0.11 0.72 0.95 1.39 0.00 0.00 0.00 173.10 176.27 1rk7 n ILE 151 N 4.26 1.80 -4.19 0.90 2.08 -1.26 -2.04 119.36 120.92 1rk7 n ILE 151 Ca -0.25 -0.45 -0.13 0.00 0.56 0.00 0.00 62.75 62.48 1rk7 n ILE 151 Cb 0.50 -0.79 -0.09 0.00 -0.75 0.00 0.00 39.64 38.51 1rk7 n ILE 151 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rk7 s ALA 152 N -0.90 1.12 0.00 -1.39 0.00 -0.87 -4.86 121.76 114.86 1rk7 s ALA 152 Ca 0.62 -1.67 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1rk7 s ALA 152 Cb -0.77 1.37 0.00 0.00 0.00 0.00 0.00 23.12 23.72 1rk7 s ALA 152 CO 0.58 -0.63 0.00 0.94 0.00 0.00 0.00 175.76 176.65