#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 4.42 -0.69 0.00 -4.23 -1.25 -4.90 115.64 108.99 1rk7 s THR 2 Ca 0.00 0.63 -0.03 0.00 -1.18 0.00 0.00 61.69 61.10 1rk7 s THR 2 Cb 0.00 -4.48 0.18 0.00 1.34 0.00 0.00 72.50 69.54 1rk7 s THR 2 CO 0.00 -0.94 0.52 -0.75 -0.54 0.00 0.00 174.62 172.91 1rk7 s LYS 3 N 3.88 2.76 0.62 3.99 2.20 -1.24 -1.89 119.74 130.06 1rk7 s LYS 3 Ca 0.36 -2.69 -0.07 0.00 -0.36 0.00 0.00 55.97 53.21 1rk7 s LYS 3 Cb -0.11 -3.81 0.01 0.00 -1.51 0.00 0.00 37.83 32.42 1rk7 s LYS 3 CO 0.24 -1.20 0.94 0.00 -0.36 0.00 0.00 175.35 174.98 1rk7 s ALA 4 N -0.33 3.21 0.04 3.13 0.00 0.48 -1.63 121.76 126.67 1rk7 s ALA 4 Ca 0.19 -0.61 -0.06 0.00 0.00 0.00 0.00 51.96 51.47 1rk7 s ALA 4 Cb -0.17 -2.70 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1rk7 s ALA 4 CO -0.05 -0.87 0.12 0.08 0.00 0.00 0.00 175.76 175.03 1rk7 s VAL 5 N -3.07 0.13 -0.36 0.00 1.01 0.27 -0.06 120.40 118.32 1rk7 s VAL 5 Ca 0.55 -1.10 0.05 0.00 0.00 0.00 0.00 61.98 61.48 1rk7 s VAL 5 Cb -0.11 -0.97 0.17 0.00 0.00 0.00 0.00 36.38 35.48 1rk7 s VAL 5 CO 0.47 -0.61 0.52 0.00 0.00 0.00 0.00 175.10 175.48 1rk7 s ALA 6 N -2.77 -1.66 -0.74 5.51 0.00 0.25 -2.11 121.76 120.24 1rk7 s ALA 6 Ca -0.04 0.03 -0.26 0.00 0.00 0.00 0.00 51.96 51.70 1rk7 s ALA 6 Cb -0.00 -2.41 0.04 0.00 0.00 0.00 0.00 23.12 20.75 1rk7 s ALA 6 CO -0.05 -2.06 1.22 0.08 0.00 0.00 0.00 175.76 174.96 1rk7 s VAL 7 N 2.02 3.85 0.41 0.00 1.01 -1.26 -1.50 120.40 124.93 1rk7 s VAL 7 Ca 0.14 0.21 -0.23 0.00 0.00 0.00 0.00 61.98 62.10 1rk7 s VAL 7 Cb -0.09 -4.88 -0.13 0.00 0.00 0.00 0.00 36.38 31.28 1rk7 s VAL 7 CO -0.13 -1.78 0.56 0.18 0.00 0.00 0.00 175.10 173.92 1rk7 n LEU 8 N 9.03 -0.02 -3.65 3.92 7.99 0.10 -4.66 117.00 129.71 1rk7 n LEU 8 Ca 0.03 0.92 -0.01 0.00 -0.01 0.00 0.00 56.01 56.94 1rk7 n LEU 8 Cb 0.48 -1.11 -0.07 0.00 -0.11 0.00 0.00 43.42 42.61 1rk7 n LEU 8 CO 0.69 -2.85 1.09 -0.75 -1.51 0.00 0.00 177.39 174.06 1rk7 s LYS 9 N -1.56 0.07 0.00 3.23 2.20 -1.15 -4.07 119.74 118.46 1rk7 s LYS 9 Ca 0.63 0.09 0.00 0.00 -0.36 0.00 0.00 55.97 56.33 1rk7 s LYS 9 Cb -0.61 0.03 0.00 0.00 -1.51 0.00 0.00 37.83 35.73 1rk7 s LYS 9 CO 0.58 -0.01 0.00 0.41 -0.36 0.00 0.00 175.35 175.97 1rk7 n GLY 10 N 2.19 -1.67 0.32 5.54 0.00 -1.26 -1.79 105.19 108.53 1rk7 n GLY 10 Ca -0.13 0.67 0.15 0.00 0.00 0.00 0.00 46.02 46.71 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 -0.07 0.00 1.61 2.03 -1.25 -4.82 116.55 114.04 1rk7 n ASP 11 Ca 0.00 1.56 0.00 0.00 0.52 0.00 0.00 54.79 56.87 1rk7 n ASP 11 Cb 0.00 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 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 -1.45 2.38 0.20 0.27 0.00 -1.26 -4.92 105.19 100.42 1rk7 n GLY 12 Ca 0.23 -0.33 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 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 0.67 -5.42 1.61 0.13 -1.87 -3.41 132.00 123.71 1rk7 h PRO 13 Ca 0.00 -0.66 -0.13 0.00 -0.87 0.00 0.00 66.00 64.34 1rk7 h PRO 13 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1rk7 h PRO 13 CO 0.00 1.25 0.46 0.08 -0.23 0.00 0.00 178.00 179.56 1rk7 s VAL 14 N -3.46 3.00 -0.25 1.56 1.01 -1.16 -4.14 120.40 116.95 1rk7 s VAL 14 Ca -0.09 -0.00 0.09 0.00 0.00 0.00 0.00 61.98 61.98 1rk7 s VAL 14 Cb 0.08 -3.00 0.44 0.00 0.00 0.00 0.00 36.38 33.90 1rk7 s VAL 14 CO 0.90 -0.00 1.20 1.67 0.00 0.00 0.00 175.10 178.87 1rk7 n GLN 15 N 8.87 2.68 -0.85 2.72 7.27 0.22 -2.91 117.38 135.37 1rk7 n GLN 15 Ca 0.44 -3.77 -0.36 0.00 0.07 0.00 0.00 57.00 53.39 1rk7 n GLN 15 Cb 0.46 -1.96 0.09 0.00 2.41 0.00 0.00 30.24 31.25 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 -0.87 -2.85 2.63 1.69 0.00 -1.26 -4.44 105.19 100.09 1rk7 n GLY 16 Ca 0.32 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.11 -0.18 -0.13 -0.61 1.01 0.43 0.00 121.20 119.60 1rk7 s ILE 17 Ca 0.45 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.62 1rk7 s ILE 17 Cb -0.01 -0.85 -0.01 0.00 0.01 0.00 0.00 42.46 41.60 1rk7 s ILE 17 CO 0.67 -0.51 -0.15 -0.51 0.00 0.00 0.00 174.94 174.44 1rk7 s ILE 18 N 2.19 2.83 0.06 2.92 1.10 -0.56 -0.40 121.20 129.33 1rk7 s ILE 18 Ca 0.07 -0.73 0.08 0.00 -0.51 0.00 0.00 60.65 59.56 1rk7 s ILE 18 Cb -0.16 -2.18 -0.03 0.00 0.15 0.00 0.00 42.46 40.25 1rk7 s ILE 18 CO -0.27 0.52 -0.22 0.20 -2.11 0.00 0.00 174.94 173.07 1rk7 s ASN 19 N 0.49 2.63 -0.28 4.50 -0.87 -0.75 0.86 114.94 121.51 1rk7 s ASN 19 Ca -0.10 -0.57 -0.02 0.00 -1.57 0.00 0.00 52.86 50.60 1rk7 s ASN 19 Cb -0.16 -0.21 0.04 0.00 -0.02 0.00 0.00 41.25 40.90 1rk7 s ASN 19 CO 0.05 0.16 -0.02 -0.36 -2.57 0.00 0.00 177.10 174.36 1rk7 s PHE 20 N -0.87 3.19 -0.04 2.20 0.40 0.92 -3.03 117.98 120.75 1rk7 s PHE 20 Ca 0.08 -1.74 0.04 0.00 -0.60 0.00 0.00 56.93 54.71 1rk7 s PHE 20 Cb -0.09 -2.09 -0.03 0.00 0.51 0.00 0.00 43.02 41.32 1rk7 s PHE 20 CO 0.02 -0.77 -0.16 -2.00 0.70 0.00 0.00 175.22 173.01 1rk7 s GLU 21 N 1.28 2.42 -0.38 0.44 2.56 -0.96 0.18 118.70 124.24 1rk7 s GLU 21 Ca -0.03 -0.74 0.10 0.00 0.00 0.00 0.00 54.97 54.30 1rk7 s GLU 21 Cb -0.19 -2.32 0.32 0.00 2.00 0.00 0.00 34.13 33.95 1rk7 s GLU 21 CO -0.02 0.61 0.72 0.94 -0.56 0.00 0.00 175.26 176.95 1rk7 n GLN 22 N 2.29 0.91 -0.98 4.30 7.27 -0.79 0.14 117.38 130.52 1rk7 n GLN 22 Ca -0.17 -3.18 -0.29 0.00 0.07 0.00 0.00 57.00 53.43 1rk7 n GLN 22 Cb 0.52 -1.54 -0.02 0.00 2.41 0.00 0.00 30.24 31.60 1rk7 n GLN 22 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1rk7 n LYS 23 N 0.56 2.78 -3.69 3.69 5.02 -1.26 -0.43 118.16 124.82 1rk7 n LYS 23 Ca 0.22 -1.77 -0.13 0.00 -2.02 0.00 0.00 58.31 54.62 1rk7 n LYS 23 Cb 0.64 -2.59 -0.09 0.00 -0.02 0.00 0.00 35.03 32.96 1rk7 n LYS 23 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1rk7 s GLU 24 N 2.84 0.60 0.06 1.97 0.41 -1.26 -4.75 118.70 118.57 1rk7 s GLU 24 Ca 0.53 0.74 0.25 0.00 -0.41 0.00 0.00 54.97 56.08 1rk7 s GLU 24 Cb 0.14 0.28 0.56 0.00 -1.78 0.00 0.00 34.13 33.33 1rk7 s GLU 24 CO -0.04 -0.08 1.47 0.43 -0.49 0.00 0.00 175.26 176.55 1rk7 n SER 25 N 2.92 0.53 -1.85 -0.19 7.64 -1.26 -4.13 113.62 117.28 1rk7 n SER 25 Ca -0.14 0.06 -0.02 0.00 1.01 0.00 0.00 58.87 59.77 1rk7 n SER 25 Cb 0.56 0.04 0.02 0.00 -1.01 0.00 0.00 64.21 63.83 1rk7 n SER 25 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1rk7 n ASN 26 N -1.79 -0.34 -4.52 6.43 0.23 -1.26 -5.13 115.26 108.88 1rk7 n ASN 26 Ca 0.05 -2.06 -0.25 0.00 -0.53 0.00 0.00 54.58 51.79 1rk7 n ASN 26 Cb 0.38 0.17 -0.11 0.00 -2.08 0.00 0.00 39.78 38.15 1rk7 n ASN 26 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1rk7 s GLY 27 N -1.66 2.19 0.89 4.83 0.00 -1.26 -5.15 107.32 107.16 1rk7 s GLY 27 Ca 0.13 -2.12 -0.12 0.00 0.00 0.00 0.00 44.72 42.61 1rk7 s GLY 27 CO -0.08 -1.96 1.13 2.56 0.00 0.00 0.00 173.10 174.75 1rk7 s PRO 28 N -3.74 1.34 -0.38 2.90 0.04 -1.26 -4.83 135.00 129.07 1rk7 s PRO 28 Ca 0.34 0.36 -0.21 0.00 0.04 0.00 0.00 61.00 61.53 1rk7 s PRO 28 Cb 0.07 -1.86 0.01 0.00 0.04 0.00 0.00 34.50 32.76 1rk7 s PRO 28 CO 0.16 -2.08 0.68 0.08 0.04 0.00 0.00 177.00 175.88 1rk7 s VAL 29 N -3.25 4.82 -0.67 -0.36 1.01 0.30 -4.74 120.40 117.51 1rk7 s VAL 29 Ca 0.63 0.57 -0.26 0.00 0.00 0.00 0.00 61.98 62.93 1rk7 s VAL 29 Cb -0.15 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 1rk7 s VAL 29 CO 0.53 -0.42 1.93 -0.54 0.00 0.00 0.00 175.10 176.61 1rk7 s LYS 30 N 2.87 2.55 -0.21 2.72 1.02 0.37 -2.93 119.74 126.12 1rk7 s LYS 30 Ca 0.26 0.47 -0.15 0.00 0.02 0.00 0.00 55.97 56.57 1rk7 s LYS 30 Cb -0.14 -4.56 -0.04 0.00 -0.52 0.00 0.00 37.83 32.57 1rk7 s LYS 30 CO 0.17 -2.96 0.38 0.08 -0.92 0.00 0.00 175.35 172.09 1rk7 s VAL 31 N 9.67 5.21 -0.19 3.17 1.01 0.64 -2.27 120.40 137.64 1rk7 s VAL 31 Ca 0.71 0.65 -0.26 0.00 0.00 0.00 0.00 61.98 63.08 1rk7 s VAL 31 Cb -0.12 -3.71 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1rk7 s VAL 31 CO 0.16 0.25 0.67 -1.66 0.00 0.00 0.00 175.10 174.52 1rk7 s TRP 32 N 1.37 -0.71 0.00 5.22 -2.14 -1.17 -0.16 118.94 121.36 1rk7 s TRP 32 Ca 0.18 1.59 0.00 0.00 2.66 0.00 0.00 56.10 60.52 1rk7 s TRP 32 Cb -0.15 0.30 0.00 0.00 -3.10 0.00 0.00 33.47 30.52 1rk7 s TRP 32 CO 0.08 -0.44 0.00 0.41 -2.66 0.00 0.00 176.95 174.34 1rk7 n GLY 33 N 2.14 2.40 3.50 3.67 0.00 -1.08 -1.82 105.19 114.01 1rk7 n GLY 33 Ca -0.16 -1.07 -0.05 0.00 0.00 0.00 0.00 46.02 44.74 1rk7 n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 s SER 34 N -0.66 -0.80 0.65 1.61 0.01 0.46 -1.82 113.70 113.15 1rk7 s SER 34 Ca 0.00 1.34 -0.09 0.00 1.31 0.00 0.00 55.95 58.51 1rk7 s SER 34 Cb 0.00 1.72 0.01 0.00 0.21 0.00 0.00 66.02 67.97 1rk7 s SER 34 CO 0.00 -0.22 1.01 -0.63 0.41 0.00 0.00 173.24 173.80 1rk7 s ILE 35 N 2.44 3.52 -0.28 1.44 1.01 0.36 0.16 121.20 129.85 1rk7 s ILE 35 Ca -0.06 0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.84 1rk7 s ILE 35 Cb -0.10 -3.45 0.17 0.00 0.01 0.00 0.00 42.46 39.08 1rk7 s ILE 35 CO -0.17 -0.53 0.49 -0.54 0.00 0.00 0.00 174.94 174.19 1rk7 s LYS 36 N -5.19 0.47 0.00 2.79 1.02 -1.26 -3.43 119.74 114.14 1rk7 s LYS 36 Ca 0.56 0.59 0.00 0.00 0.02 0.00 0.00 55.97 57.14 1rk7 s LYS 36 Cb -0.11 0.01 0.00 0.00 -0.52 0.00 0.00 37.83 37.22 1rk7 s LYS 36 CO 0.48 -0.81 0.00 0.41 -0.92 0.00 0.00 175.35 174.52 1rk7 n GLY 37 N 5.39 3.76 0.28 -3.33 0.00 -1.26 -0.61 105.19 109.43 1rk7 n GLY 37 Ca -0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 -3.93 0.99 4.32 -1.26 -4.87 117.00 112.25 1rk7 n LEU 38 Ca 0.00 -0.05 -0.11 0.00 -0.02 0.00 0.00 56.01 55.83 1rk7 n LEU 38 Cb 0.00 -0.08 -0.13 0.00 -1.62 0.00 0.00 43.42 41.60 1rk7 n LEU 38 CO 0.00 -1.43 -0.36 0.42 -1.22 0.00 0.00 177.39 174.79 1rk7 s THR 39 N -0.77 0.09 -0.99 -5.08 -4.23 -1.26 -3.56 115.64 99.84 1rk7 s THR 39 Ca 0.04 -0.40 -0.22 0.00 -1.18 0.00 0.00 61.69 59.93 1rk7 s THR 39 Cb -0.01 -0.15 -0.27 0.00 1.34 0.00 0.00 72.50 73.41 1rk7 s THR 39 CO 0.03 -0.20 2.47 1.21 -0.54 0.00 0.00 174.62 177.59 1rk7 n GLU 40 N 2.44 0.02 -0.06 3.99 2.13 -1.26 -4.52 120.64 123.38 1rk7 n GLU 40 Ca -0.17 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.64 1rk7 n GLU 40 Cb 0.58 -1.34 0.00 0.00 0.27 0.00 0.00 31.44 30.95 1rk7 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rk7 n GLY 41 N 6.08 0.98 3.69 8.31 0.00 -1.26 -4.93 105.19 118.06 1rk7 n GLY 41 Ca 0.66 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 3.78 -0.03 0.99 1.02 -1.26 -2.23 118.68 120.95 1rk7 s LEU 42 Ca 0.00 0.17 -0.01 0.00 0.02 0.00 0.00 54.13 54.31 1rk7 s LEU 42 Cb 0.00 -1.91 0.03 0.00 0.02 0.00 0.00 46.19 44.33 1rk7 s LEU 42 CO 0.00 0.31 0.04 -1.38 0.02 0.00 0.00 176.35 175.34 1rk7 s HIS 43 N -0.47 0.11 0.62 0.29 -3.43 -1.25 -3.92 115.29 107.25 1rk7 s HIS 43 Ca 0.09 0.15 -0.16 0.00 -0.80 0.00 0.00 55.06 54.34 1rk7 s HIS 43 Cb -0.12 -0.38 -0.13 0.00 -1.43 0.00 0.00 32.58 30.51 1rk7 s HIS 43 CO 0.02 -0.15 -0.35 0.41 -2.00 0.00 0.00 174.74 172.67 1rk7 n GLY 44 N 4.65 -3.38 3.88 -1.38 0.00 -1.25 -2.92 105.19 104.77 1rk7 n GLY 44 Ca -0.17 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.78 3.53 1.30 1.61 2.19 -0.87 -3.74 117.98 120.22 1rk7 s PHE 45 Ca 0.45 1.13 -0.17 0.00 0.33 0.00 0.00 56.93 58.67 1rk7 s PHE 45 Cb -0.33 -2.55 0.33 0.00 -1.31 0.00 0.00 43.02 39.16 1rk7 s PHE 45 CO 0.65 -0.35 0.94 -2.39 1.83 0.00 0.00 175.22 175.90 1rk7 n HIS 46 N -1.97 -2.23 -2.53 10.12 1.44 -1.23 -4.52 115.22 114.30 1rk7 n HIS 46 Ca 0.04 -0.40 -0.05 0.00 -2.01 0.00 0.00 57.72 55.30 1rk7 n HIS 46 Cb 0.54 -1.56 0.01 0.00 0.12 0.00 0.00 29.99 29.10 1rk7 n HIS 46 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1rk7 n VAL 47 N -5.33 -8.52 -3.20 0.61 0.31 -1.26 -4.74 118.33 96.21 1rk7 n VAL 47 Ca 0.06 0.47 -0.00 0.00 -0.01 0.00 0.00 64.34 64.85 1rk7 n VAL 47 Cb 0.56 -6.35 -0.02 0.00 -0.91 0.00 0.00 33.84 27.12 1rk7 n VAL 47 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1rk7 s HIS 48 N -2.38 -1.56 -0.18 3.52 3.76 -1.26 -4.87 115.29 112.31 1rk7 s HIS 48 Ca 0.14 0.91 -0.02 0.00 -0.15 0.00 0.00 55.06 55.93 1rk7 s HIS 48 Cb -0.04 0.19 0.05 0.00 1.11 0.00 0.00 32.58 33.90 1rk7 s HIS 48 CO 0.56 -1.03 0.03 -1.21 -0.85 0.00 0.00 174.74 172.24 1rk7 s GLU 49 N 2.74 0.69 0.04 1.40 2.02 -1.26 -4.89 118.70 119.44 1rk7 s GLU 49 Ca 0.11 -0.36 -0.28 0.00 0.02 0.00 0.00 54.97 54.46 1rk7 s GLU 49 Cb -0.11 -1.96 -0.16 0.00 0.10 0.00 0.00 34.13 32.00 1rk7 s GLU 49 CO -0.27 -0.59 1.42 0.93 0.02 0.00 0.00 175.26 176.78 1rk7 h GLU 50 N 8.25 -0.98 -4.22 1.61 5.08 -1.99 -3.17 114.58 119.16 1rk7 h GLU 50 Ca -0.17 0.07 -0.26 0.00 -1.00 0.00 0.00 59.36 57.99 1rk7 h GLU 50 Cb 1.12 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.49 1rk7 h GLU 50 CO 0.33 -0.65 -0.28 -1.83 -1.00 0.00 0.00 179.01 175.58 1rk7 s GLU 51 N -5.21 1.74 0.00 2.33 -1.05 -1.25 -4.57 118.70 110.68 1rk7 s GLU 51 Ca -0.15 -1.70 0.00 0.00 -0.15 0.00 0.00 54.97 52.97 1rk7 s GLU 51 Cb 0.01 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.11 1rk7 s GLU 51 CO 0.45 -0.69 0.00 -3.47 0.95 0.00 0.00 175.26 172.49 1rk7 n ASP 52 N -1.11 0.00 -0.10 0.83 2.03 -1.26 -4.95 116.55 111.98 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 0.62 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.03 1rk7 n ASP 52 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1rk7 n ASN 53 N 0.00 0.35 -0.05 1.67 6.94 -1.26 -4.71 115.26 118.20 1rk7 n ASN 53 Ca 0.00 -1.40 -0.06 0.00 -0.02 0.00 0.00 54.58 53.10 1rk7 n ASN 53 Cb 0.00 -0.06 -0.07 0.00 -2.36 0.00 0.00 39.78 37.30 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 1rk7 n THR 54 N -0.12 0.66 -1.22 5.53 5.66 -1.26 -5.12 114.28 118.42 1rk7 n THR 54 Ca 0.01 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 1rk7 n THR 54 Cb 0.51 -0.80 0.00 0.00 -1.55 0.00 0.00 70.33 68.49 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 -2.51 -2.65 -0.04 1.79 0.00 -1.26 -5.01 120.51 110.84 1rk7 n ALA 55 Ca -0.17 0.18 -0.04 0.00 0.00 0.00 0.00 53.44 53.41 1rk7 n ALA 55 Cb 0.78 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 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 0.69 -0.36 0.70 0.00 0.00 -1.26 -4.92 105.19 100.04 1rk7 n GLY 56 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1rk7 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk7 n THR 58 N -2.16 0.00 -3.16 0.00 -2.24 -1.26 -5.13 114.28 100.33 1rk7 n THR 58 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1rk7 n THR 58 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 1rk7 n THR 58 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1rk7 s SER 59 N 0.47 -0.10 0.32 3.42 0.15 -1.26 -4.66 113.70 112.04 1rk7 s SER 59 Ca 0.00 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1rk7 s SER 59 Cb 0.00 1.09 0.00 0.00 -1.71 0.00 0.00 66.02 65.40 1rk7 s SER 59 CO 0.00 -0.02 0.00 0.00 1.20 0.00 0.00 173.24 174.42 1rk7 n ALA 60 N 5.32 0.05 -3.14 5.45 0.00 -1.26 -5.10 120.51 121.83 1rk7 n ALA 60 Ca -0.09 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.41 1rk7 n ALA 60 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 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 -2.05 -0.93 -0.80 0.00 0.00 -1.26 -5.04 107.32 97.23 1rk7 s GLY 61 Ca 0.00 2.17 -0.06 0.00 0.00 0.00 0.00 44.72 46.83 1rk7 s GLY 61 CO 0.00 4.15 2.60 -1.55 0.00 0.00 0.00 173.10 178.31 1rk7 n PRO 62 N 5.03 2.34 -2.23 2.90 -0.04 -1.26 -3.52 135.00 138.22 1rk7 n PRO 62 Ca 0.10 -1.42 -0.02 0.00 -0.04 0.00 0.00 63.50 62.11 1rk7 n PRO 62 Cb 0.58 -2.35 0.06 0.00 -0.04 0.00 0.00 33.50 31.75 1rk7 n PRO 62 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1rk7 n HIS 63 N 3.49 -0.83 -4.61 0.54 8.25 -1.20 -3.75 115.22 117.12 1rk7 n HIS 63 Ca 0.50 -1.43 0.00 0.00 -0.26 0.00 0.00 57.72 56.53 1rk7 n HIS 63 Cb 0.35 0.86 0.00 0.00 1.12 0.00 0.00 29.99 32.32 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 -0.87 0.00 -4.18 4.41 3.72 -1.23 -4.84 117.46 114.47 1rk7 n PHE 64 Ca -0.14 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.08 1rk7 n PHE 64 Cb 0.85 0.06 -0.12 0.00 -0.94 0.00 0.00 39.48 39.33 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 -4.00 1.57 0.00 4.37 0.01 -1.26 -4.86 114.94 110.77 1rk7 s ASN 65 Ca 0.00 -0.58 0.24 0.00 -0.71 0.00 0.00 52.86 51.81 1rk7 s ASN 65 Cb 0.00 -0.05 1.41 0.00 0.41 0.00 0.00 41.25 43.02 1rk7 s ASN 65 CO 0.00 -0.07 1.80 -0.81 -1.51 0.00 0.00 177.10 176.50 1rk7 n PRO 66 N 1.40 0.71 0.13 -0.60 -0.04 -1.26 -1.37 135.00 133.97 1rk7 n PRO 66 Ca -0.21 0.01 -0.24 0.00 -0.04 0.00 0.00 63.50 63.02 1rk7 n PRO 66 Cb 0.54 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.35 1rk7 n PRO 66 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1rk7 h LEU 67 N 0.00 0.80 0.08 1.53 -0.00 -1.95 -3.36 115.31 112.41 1rk7 h LEU 67 Ca 0.00 -0.90 -0.37 0.00 -0.00 0.00 0.00 57.88 56.61 1rk7 h LEU 67 Cb 0.02 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 40.39 1rk7 h LEU 67 CO 0.00 1.72 -2.12 -1.54 -0.00 0.00 0.00 178.44 176.50 1rk7 n SER 68 N -3.69 1.95 0.00 -0.43 3.41 -1.11 -2.74 113.62 111.02 1rk7 n SER 68 Ca -0.18 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1rk7 n SER 68 Cb 1.10 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1rk7 n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rk7 n ARG 69 N -3.38 0.00 -4.25 4.33 1.74 -0.47 -2.90 116.66 111.73 1rk7 n ARG 69 Ca -0.35 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.58 1rk7 n ARG 69 Cb 1.04 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 32.37 1rk7 n ARG 69 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1rk7 s LYS 70 N 0.00 1.05 0.42 5.56 1.02 -1.26 -4.93 119.74 121.59 1rk7 s LYS 70 Ca 0.00 -1.37 0.29 0.00 0.02 0.00 0.00 55.97 54.91 1rk7 s LYS 70 Cb 0.00 -0.73 1.45 0.00 -0.52 0.00 0.00 37.83 38.02 1rk7 s LYS 70 CO 0.00 0.11 1.58 1.12 -0.92 0.00 0.00 175.35 177.24 1rk7 h HIS 71 N 3.06 0.62 -1.27 3.18 2.07 -1.44 -3.39 115.15 117.99 1rk7 h HIS 71 Ca -0.38 0.03 0.12 0.00 -2.85 0.00 0.00 60.37 57.30 1rk7 h HIS 71 Cb 1.19 -0.14 -0.03 0.00 2.57 0.00 0.00 27.41 31.00 1rk7 h HIS 71 CO 0.65 -0.34 -0.17 0.41 -3.07 0.00 0.00 177.93 175.41 1rk7 n GLY 72 N -1.44 -0.71 0.00 6.13 0.00 -1.26 -4.12 105.19 103.79 1rk7 n GLY 72 Ca 0.40 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.55 1.57 0.12 -0.02 0.00 -1.26 -4.57 105.19 99.49 1rk7 n GLY 73 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 46.02 45.54 1rk7 n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 h PRO 74 N 0.00 0.00 0.00 1.61 0.13 -1.93 -3.17 132.00 128.64 1rk7 h PRO 74 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.90 1rk7 h PRO 74 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1rk7 h PRO 74 CO 0.00 0.69 -1.64 1.63 -0.23 0.00 0.00 178.00 178.44 1rk7 n LYS 75 N -3.60 0.63 -2.86 0.86 5.02 -1.26 -5.04 118.16 111.91 1rk7 n LYS 75 Ca -0.00 0.22 -0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1rk7 n LYS 75 Cb 0.70 -1.77 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1rk7 n LYS 75 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1rk7 n ASP 76 N -2.92 -7.36 -0.00 4.39 9.92 -1.20 -4.96 116.55 114.41 1rk7 n ASP 76 Ca -0.15 1.12 0.02 0.00 -0.53 0.00 0.00 54.79 55.26 1rk7 n ASP 76 Cb 0.95 -4.16 -0.03 0.00 -0.64 0.00 0.00 41.12 37.24 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1rk7 n GLU 77 N 0.94 1.93 0.00 -1.24 4.07 -1.26 -4.94 120.64 120.14 1rk7 n GLU 77 Ca -0.01 -0.03 0.00 0.00 -0.06 0.00 0.00 57.16 57.06 1rk7 n GLU 77 Cb 0.17 -0.97 0.00 0.00 -0.06 0.00 0.00 31.44 30.58 1rk7 n GLU 77 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1rk7 n GLU 78 N -1.47 0.00 -3.35 5.31 2.13 -1.26 -4.98 120.64 117.02 1rk7 n GLU 78 Ca -0.00 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 57.62 1rk7 n GLU 78 Cb 0.10 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.76 1rk7 n GLU 78 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1rk7 n ARG 79 N 0.00 -0.91 0.05 5.31 0.00 -1.14 -4.69 116.66 115.28 1rk7 n ARG 79 Ca 0.00 0.06 0.12 0.00 -0.00 0.00 0.00 57.85 58.04 1rk7 n ARG 79 Cb 0.00 -2.23 0.30 0.00 -0.00 0.00 0.00 32.46 30.53 1rk7 n ARG 79 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1rk7 n HIS 80 N -2.73 0.47 -1.58 2.89 8.25 -1.11 -4.78 115.22 116.64 1rk7 n HIS 80 Ca -0.07 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1rk7 n HIS 80 Cb 0.32 -0.63 0.00 0.00 1.12 0.00 0.00 29.99 30.81 1rk7 n HIS 80 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1rk7 n VAL 81 N -1.95 0.00 -0.74 1.59 3.14 -1.26 -4.87 118.33 114.24 1rk7 n VAL 81 Ca 0.05 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.29 1rk7 n VAL 81 Cb 0.41 -0.87 0.04 0.00 -1.06 0.00 0.00 33.84 32.36 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 5.00 3.81 2.85 7.55 0.00 -1.26 -4.66 105.19 118.49 1rk7 n GLY 82 Ca 0.00 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 1rk7 n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rk7 s ASP 83 N 0.35 4.07 0.00 1.61 1.01 -1.26 -4.61 116.67 117.84 1rk7 s ASP 83 Ca 0.27 -2.94 0.00 0.00 0.71 0.00 0.00 52.55 50.58 1rk7 s ASP 83 Cb 0.21 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.74 1rk7 s ASP 83 CO 0.00 -0.23 0.00 0.18 0.21 0.00 0.00 175.17 175.33 1rk7 n LEU 84 N 3.17 0.31 0.00 1.23 7.99 -1.26 -4.57 117.00 123.87 1rk7 n LEU 84 Ca 0.08 0.12 0.00 0.00 -0.01 0.00 0.00 56.01 56.19 1rk7 n LEU 84 Cb 0.33 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 43.30 1rk7 n LEU 84 CO 0.30 -0.35 0.00 0.61 -1.51 0.00 0.00 177.39 176.44 1rk7 n GLY 85 N 1.92 -2.25 3.26 -0.72 0.00 -1.26 -4.26 105.19 101.88 1rk7 n GLY 85 Ca 0.00 0.79 -0.09 0.00 0.00 0.00 0.00 46.02 46.72 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 2.00 0.05 0.00 1.61 -0.87 -1.26 -2.04 114.94 114.43 1rk7 s ASN 86 Ca 0.00 -0.67 0.00 0.00 -1.57 0.00 0.00 52.86 50.62 1rk7 s ASN 86 Cb 0.00 0.39 0.00 0.00 -0.02 0.00 0.00 41.25 41.62 1rk7 s ASN 86 CO 0.00 -0.79 0.00 1.33 -2.57 0.00 0.00 177.10 175.07 1rk7 n VAL 87 N -0.13 0.00 -3.67 1.60 0.24 -1.15 -4.91 118.33 110.31 1rk7 n VAL 87 Ca -0.13 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.03 1rk7 n VAL 87 Cb 0.63 -0.08 -0.08 0.00 -1.47 0.00 0.00 33.84 32.84 1rk7 n VAL 87 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1rk7 s THR 88 N 1.46 0.01 0.80 3.34 -1.32 -1.26 -3.81 115.64 114.87 1rk7 s THR 88 Ca 0.00 -0.09 -0.08 0.00 -1.21 0.00 0.00 61.69 60.31 1rk7 s THR 88 Cb 0.00 -0.78 0.13 0.00 -1.51 0.00 0.00 72.50 70.34 1rk7 s THR 88 CO 0.00 -0.05 1.12 0.00 -2.21 0.00 0.00 174.62 173.48 1rk7 s ALA 89 N -0.34 2.99 0.00 11.08 0.00 -0.95 -4.61 121.76 129.93 1rk7 s ALA 89 Ca -0.05 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.65 1rk7 s ALA 89 Cb -0.03 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.60 1rk7 s ALA 89 CO 0.03 -1.75 0.00 -3.47 0.00 0.00 0.00 175.76 170.57 1rk7 n ASP 90 N -3.20 0.00 0.00 0.00 2.03 -0.47 -4.66 116.55 110.26 1rk7 n ASP 90 Ca 0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.44 1rk7 n ASP 90 Cb 0.60 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.00 1rk7 n ASP 90 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1rk7 n LYS 91 N 0.00 0.53 -0.71 -0.67 5.02 -1.26 -4.75 118.16 116.32 1rk7 n LYS 91 Ca 0.00 -0.66 -0.01 0.00 -2.02 0.00 0.00 58.31 55.62 1rk7 n LYS 91 Cb 0.00 -0.59 -0.01 0.00 -0.02 0.00 0.00 35.03 34.40 1rk7 n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1rk7 n ASP 92 N -0.09 -0.11 0.00 4.39 9.92 -1.26 -4.75 116.55 124.64 1rk7 n ASP 92 Ca 0.00 -1.54 0.00 0.00 -0.53 0.00 0.00 54.79 52.72 1rk7 n ASP 92 Cb 0.44 -0.01 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 0.05 2.52 3.46 0.44 0.00 -1.23 -4.46 105.19 105.97 1rk7 n GLY 93 Ca -0.05 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1rk7 n GLY 93 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rk7 n VAL 94 N 0.00 0.00 -3.67 1.61 0.31 -1.26 -4.18 118.33 111.15 1rk7 n VAL 94 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.95 1rk7 n VAL 94 Cb 0.00 -0.50 -0.12 0.00 -0.91 0.00 0.00 33.84 32.31 1rk7 n VAL 94 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rk7 s ALA 95 N 8.64 3.27 0.08 3.52 0.00 -1.22 -1.36 121.76 134.68 1rk7 s ALA 95 Ca 1.34 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1rk7 s ALA 95 Cb -1.28 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1rk7 s ALA 95 CO 0.51 -0.83 0.09 0.34 0.00 0.00 0.00 175.76 175.87 1rk7 s ASP 96 N 1.62 5.59 0.17 0.00 -1.08 -1.26 0.13 116.67 121.84 1rk7 s ASP 96 Ca 0.05 0.00 0.07 0.00 -0.52 0.00 0.00 52.55 52.15 1rk7 s ASP 96 Cb -0.17 -1.52 -0.04 0.00 -1.46 0.00 0.00 42.92 39.73 1rk7 s ASP 96 CO 0.06 0.17 -0.15 -0.69 0.52 0.00 0.00 175.17 175.08 1rk7 s VAL 97 N -1.41 1.60 -0.29 1.11 1.01 -0.76 -4.92 120.40 116.75 1rk7 s VAL 97 Ca 0.30 -2.02 0.00 0.00 0.00 0.00 0.00 61.98 60.26 1rk7 s VAL 97 Cb -0.12 -1.86 0.19 0.00 0.00 0.00 0.00 36.38 34.59 1rk7 s VAL 97 CO 0.22 -0.51 0.73 -0.94 0.00 0.00 0.00 175.10 174.60 1rk7 s SER 98 N -2.96 -1.26 0.15 3.32 1.04 -1.23 -2.62 113.70 110.15 1rk7 s SER 98 Ca 0.17 0.20 -0.05 0.00 0.48 0.00 0.00 55.95 56.75 1rk7 s SER 98 Cb -0.02 1.82 -0.02 0.00 0.10 0.00 0.00 66.02 67.89 1rk7 s SER 98 CO 0.05 -0.23 0.18 -0.63 0.98 0.00 0.00 173.24 173.60 1rk7 s ILE 99 N 2.87 0.08 -0.23 -1.02 1.01 0.78 -5.00 121.20 119.68 1rk7 s ILE 99 Ca 0.15 -1.63 -0.02 0.00 0.00 0.00 0.00 60.65 59.15 1rk7 s ILE 99 Cb -0.08 -1.96 0.07 0.00 0.01 0.00 0.00 42.46 40.50 1rk7 s ILE 99 CO -0.24 -0.36 0.05 -1.83 0.00 0.00 0.00 174.94 172.56 1rk7 s GLU 100 N -4.01 0.73 -0.20 2.79 1.03 -1.26 -0.26 118.70 117.51 1rk7 s GLU 100 Ca 0.21 -0.62 -0.08 0.00 0.03 0.00 0.00 54.97 54.51 1rk7 s GLU 100 Cb 0.05 -2.08 -0.04 0.00 -0.80 0.00 0.00 34.13 31.26 1rk7 s GLU 100 CO 0.01 -0.73 0.08 -0.51 -1.33 0.00 0.00 175.26 172.77 1rk7 s ASP 101 N 1.78 5.63 -0.11 0.83 1.11 -1.15 -4.81 116.67 119.94 1rk7 s ASP 101 Ca 0.01 0.05 -0.02 0.00 0.18 0.00 0.00 52.55 52.78 1rk7 s ASP 101 Cb -0.17 -1.98 -0.06 0.00 1.07 0.00 0.00 42.92 41.78 1rk7 s ASP 101 CO -0.13 0.14 -0.11 -1.54 1.18 0.00 0.00 175.17 174.70 1rk7 n SER 102 N 3.80 2.32 -0.31 0.27 3.41 -1.26 0.11 113.62 121.96 1rk7 n SER 102 Ca -0.16 0.01 0.14 0.00 -0.26 0.00 0.00 58.87 58.60 1rk7 n SER 102 Cb 0.52 -0.23 0.32 0.00 -0.26 0.00 0.00 64.21 64.56 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 -0.15 0.51 -4.12 -3.33 2.07 -1.96 -3.40 116.25 105.86 1rk7 h VAL 103 Ca -0.25 -0.16 -0.45 0.00 0.82 0.00 0.00 66.70 66.66 1rk7 h VAL 103 Cb 1.32 0.01 0.15 0.00 -1.52 0.00 0.00 31.29 31.26 1rk7 h VAL 103 CO -0.09 0.08 0.36 0.27 0.02 0.00 0.00 177.57 178.22 1rk7 s ILE 104 N -5.87 1.95 -0.23 4.57 -5.25 -1.26 -4.90 121.20 110.20 1rk7 s ILE 104 Ca -0.11 0.00 -0.22 0.00 -0.99 0.00 0.00 60.65 59.33 1rk7 s ILE 104 Cb 0.25 -2.89 0.06 0.00 2.95 0.00 0.00 42.46 42.83 1rk7 s ILE 104 CO 0.78 0.00 0.63 -0.44 -1.79 0.00 0.00 174.94 174.12 1rk7 s SER 105 N -4.55 -0.65 0.26 4.36 0.01 -0.75 -4.91 113.70 107.47 1rk7 s SER 105 Ca 0.69 1.23 -0.03 0.00 1.31 0.00 0.00 55.95 59.16 1rk7 s SER 105 Cb -0.08 1.25 0.54 0.00 0.21 0.00 0.00 66.02 67.94 1rk7 s SER 105 CO 0.53 -0.23 1.66 -0.07 0.41 0.00 0.00 173.24 175.53 1rk7 h LEU 106 N 5.06 -0.07 -7.87 2.44 -0.00 -1.95 -0.68 115.31 112.25 1rk7 h LEU 106 Ca -0.28 0.17 -0.13 0.00 -0.00 0.00 0.00 57.88 57.64 1rk7 h LEU 106 Cb 1.17 0.25 -0.19 0.00 -0.00 0.00 0.00 40.66 41.89 1rk7 h LEU 106 CO 0.12 -0.11 -0.53 -0.94 -0.00 0.00 0.00 178.44 176.98 1rk7 s SER 107 N -5.18 0.15 0.00 -0.43 1.04 -1.26 -2.26 113.70 105.76 1rk7 s SER 107 Ca -0.13 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.85 1rk7 s SER 107 Cb 0.23 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1rk7 s SER 107 CO 0.76 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 175.14 1rk7 n GLY 108 N 1.01 0.36 0.16 7.32 0.00 -1.26 -4.72 105.19 108.06 1rk7 n GLY 108 Ca -0.20 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.38 1rk7 n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1rk7 h ASP 109 N 0.00 0.68 -2.34 1.61 5.19 -1.99 -3.34 116.42 116.23 1rk7 h ASP 109 Ca 0.00 -0.75 -0.68 0.00 -0.62 0.00 0.00 57.03 54.99 1rk7 h ASP 109 Cb 0.00 -0.21 -0.36 0.00 0.18 0.00 0.00 39.33 38.94 1rk7 h ASP 109 CO 0.00 1.34 -0.02 1.41 -3.12 0.00 0.00 179.24 178.85 1rk7 n HIS 110 N -4.08 3.41 -2.02 4.55 8.25 -1.26 -5.03 115.22 119.04 1rk7 n HIS 110 Ca -0.10 -3.49 -0.43 0.00 -0.26 0.00 0.00 57.72 53.44 1rk7 n HIS 110 Cb 0.75 -0.78 -0.03 0.00 1.12 0.00 0.00 29.99 31.05 1rk7 n HIS 110 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1rk7 s SER 111 N -2.51 5.99 0.00 0.41 1.04 -1.22 -1.81 113.70 115.60 1rk7 s SER 111 Ca 0.42 1.38 0.26 0.00 0.48 0.00 0.00 55.95 58.49 1rk7 s SER 111 Cb 0.20 -2.53 0.64 0.00 0.10 0.00 0.00 66.02 64.43 1rk7 s SER 111 CO -0.08 -1.61 1.51 2.30 0.98 0.00 0.00 173.24 176.34 1rk7 n ILE 112 N 7.23 0.00 -1.76 -1.02 -5.35 -0.26 -4.79 119.36 113.41 1rk7 n ILE 112 Ca 0.22 -0.00 -0.37 0.00 -0.27 0.00 0.00 62.75 62.32 1rk7 n ILE 112 Cb 0.46 0.13 -0.03 0.00 -1.74 0.00 0.00 39.64 38.47 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1rk7 s ILE 113 N -2.98 3.15 0.00 7.28 -1.09 -0.96 -2.97 121.20 123.64 1rk7 s ILE 113 Ca 0.12 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.63 1rk7 s ILE 113 Cb 0.18 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 1rk7 s ILE 113 CO 0.66 -0.38 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 1rk7 n GLY 114 N 5.87 0.49 3.26 6.18 0.00 -1.19 -5.05 105.19 114.75 1rk7 n GLY 114 Ca 0.30 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.88 1rk7 n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rk7 s ARG 115 N 0.00 3.05 -0.90 1.61 1.81 -1.16 -4.89 118.95 118.47 1rk7 s ARG 115 Ca 0.00 -2.14 -0.25 0.00 -1.72 0.00 0.00 55.73 51.61 1rk7 s ARG 115 Cb 0.00 -4.18 -0.19 0.00 -0.45 0.00 0.00 34.95 30.13 1rk7 s ARG 115 CO 0.00 -1.26 2.24 2.41 -0.68 0.00 0.00 175.30 178.01 1rk7 n THR 116 N 4.40 0.00 -2.01 0.02 -1.04 -1.26 -3.50 114.28 110.89 1rk7 n THR 116 Ca 0.02 -0.28 -0.43 0.00 -2.04 0.00 0.00 64.05 61.31 1rk7 n THR 116 Cb 0.43 -1.87 -0.03 0.00 -1.82 0.00 0.00 70.33 67.04 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 15.13 3.84 0.17 -4.42 0.20 -1.13 -4.11 118.68 128.36 1rk7 s LEU 117 Ca 0.87 1.69 0.01 0.00 0.69 0.00 0.00 54.13 57.39 1rk7 s LEU 117 Cb -0.12 -3.53 -0.05 0.00 -0.43 0.00 0.00 46.19 42.07 1rk7 s LEU 117 CO 0.14 -1.37 0.01 0.54 -0.29 0.00 0.00 176.35 175.38 1rk7 s VAL 118 N 5.67 0.57 0.06 1.68 0.11 -1.26 0.22 120.40 127.45 1rk7 s VAL 118 Ca 0.77 -1.97 0.08 0.00 -2.93 0.00 0.00 61.98 57.93 1rk7 s VAL 118 Cb -0.27 -2.11 -0.03 0.00 -1.53 0.00 0.00 36.38 32.44 1rk7 s VAL 118 CO 0.31 -0.47 -0.20 0.68 -3.33 0.00 0.00 175.10 172.09 1rk7 s VAL 119 N -3.73 2.69 0.18 2.04 -7.23 -1.26 -3.52 120.40 109.57 1rk7 s VAL 119 Ca 0.24 -1.31 -0.23 0.00 -1.81 0.00 0.00 61.98 58.87 1rk7 s VAL 119 Cb 0.06 -2.15 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 1rk7 s VAL 119 CO 0.04 0.28 0.75 -1.00 -0.31 0.00 0.00 175.10 174.85 1rk7 s HIS 120 N -0.96 3.81 -1.19 2.82 3.76 -1.25 -4.06 115.29 118.22 1rk7 s HIS 120 Ca 0.15 1.53 -0.06 0.00 -0.15 0.00 0.00 55.06 56.53 1rk7 s HIS 120 Cb -0.10 -2.71 0.23 0.00 1.11 0.00 0.00 32.58 31.11 1rk7 s HIS 120 CO 0.06 0.45 1.79 -1.91 -0.85 0.00 0.00 174.74 174.28 1rk7 n GLU 121 N 1.27 4.24 0.00 1.40 2.13 -1.06 -4.38 120.64 124.25 1rk7 n GLU 121 Ca -0.05 -4.02 0.00 0.00 0.66 0.00 0.00 57.16 53.76 1rk7 n GLU 121 Cb 0.50 -2.69 0.00 0.00 0.27 0.00 0.00 31.44 29.52 1rk7 n GLU 121 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1rk7 n LYS 122 N 2.26 -2.57 -3.98 5.31 4.76 -1.26 -4.77 118.16 117.92 1rk7 n LYS 122 Ca 0.38 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.48 1rk7 n LYS 122 Cb 0.33 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.37 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1rk7 s ALA 123 N -2.00 2.66 -0.69 7.82 0.00 -1.25 -3.96 121.76 124.34 1rk7 s ALA 123 Ca 0.00 -1.44 0.14 0.00 0.00 0.00 0.00 51.96 50.66 1rk7 s ALA 123 Cb 0.00 -1.63 0.66 0.00 0.00 0.00 0.00 23.12 22.14 1rk7 s ALA 123 CO 0.00 -0.77 1.43 -3.47 0.00 0.00 0.00 175.76 172.95 1rk7 n ASP 124 N 4.66 0.29 -2.81 0.00 2.03 -1.25 -4.81 116.55 114.65 1rk7 n ASP 124 Ca -0.17 0.60 -0.20 0.00 0.52 0.00 0.00 54.79 55.55 1rk7 n ASP 124 Cb 0.47 -0.65 0.01 0.00 -0.72 0.00 0.00 41.12 40.23 1rk7 n ASP 124 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1rk7 n ASP 125 N -1.85 -5.01 -1.64 1.67 2.03 -1.26 0.24 116.55 110.74 1rk7 n ASP 125 Ca 0.01 -0.13 -0.13 0.00 0.52 0.00 0.00 54.79 55.06 1rk7 n ASP 125 Cb 0.10 -4.13 -0.04 0.00 -0.72 0.00 0.00 41.12 36.32 1rk7 n ASP 125 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1rk7 n LEU 126 N -3.44 -1.01 0.00 -2.67 4.77 -1.26 -4.57 117.00 108.82 1rk7 n LEU 126 Ca -0.13 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1rk7 n LEU 126 Cb 0.62 -2.03 0.00 0.00 -2.33 0.00 0.00 43.42 39.68 1rk7 n LEU 126 CO 0.36 -0.54 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 1rk7 n GLY 127 N -0.38 4.03 0.12 -0.72 0.00 0.14 -4.98 105.19 103.40 1rk7 n GLY 127 Ca -0.14 -0.99 0.02 0.00 0.00 0.00 0.00 46.02 44.92 1rk7 n GLY 127 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1rk7 h LYS 128 N 0.00 0.00 0.00 1.61 2.10 -1.80 -3.48 116.57 115.00 1rk7 h LYS 128 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1rk7 h LYS 128 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1rk7 h LYS 128 CO 0.00 0.43 0.00 0.41 -2.00 0.00 0.00 179.45 178.29 1rk7 n GLY 129 N 1.27 3.24 0.00 0.07 0.00 -1.26 -5.07 105.19 103.45 1rk7 n GLY 129 Ca -0.02 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.43 3.06 -0.02 0.00 -1.26 -5.09 105.19 99.45 1rk7 n GLY 130 Ca 0.00 -1.38 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 1rk7 n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk7 s ASN 131 N -1.59 0.03 0.00 1.61 2.20 -1.26 -4.78 114.94 111.15 1rk7 s ASN 131 Ca 0.00 -0.16 0.00 0.00 -0.94 0.00 0.00 52.86 51.76 1rk7 s ASN 131 Cb 0.00 0.20 0.00 0.00 -2.00 0.00 0.00 41.25 39.45 1rk7 s ASN 131 CO 0.00 -0.29 0.00 1.21 -2.94 0.00 0.00 177.10 175.08 1rk7 n GLU 132 N 1.80 0.00 0.13 3.55 2.13 -1.26 -4.88 120.64 122.11 1rk7 n GLU 132 Ca -0.21 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.61 1rk7 n GLU 132 Cb 0.56 -1.96 0.00 0.00 0.27 0.00 0.00 31.44 30.32 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 -0.92 0.00 0.05 5.31 -0.06 -1.26 -4.91 117.38 115.58 1rk7 n GLN 133 Ca 0.00 0.00 0.13 0.00 -2.00 0.00 0.00 57.00 55.13 1rk7 n GLN 133 Cb 0.29 0.00 0.42 0.00 -4.06 0.00 0.00 30.24 26.89 1rk7 n GLN 133 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1rk7 n SER 134 N -3.04 0.47 0.20 1.69 3.41 -1.26 -0.50 113.62 114.59 1rk7 n SER 134 Ca 0.00 0.36 0.10 0.00 -0.26 0.00 0.00 58.87 59.07 1rk7 n SER 134 Cb 0.00 -0.39 0.14 0.00 -0.26 0.00 0.00 64.21 63.70 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 0.22 0.00 6.66 1.35 -1.91 -3.35 112.91 115.88 1rk7 h THR 135 Ca 0.00 -1.30 -0.19 0.00 -0.55 0.00 0.00 66.41 64.37 1rk7 h THR 135 Cb 0.62 2.10 -0.03 0.00 -1.73 0.00 0.00 68.15 69.11 1rk7 h THR 135 CO 0.00 0.12 -1.71 2.29 -0.25 0.00 0.00 175.52 175.97 1rk7 n LYS 136 N -3.13 0.31 0.00 4.72 2.85 -1.19 -1.38 118.16 120.34 1rk7 n LYS 136 Ca 0.03 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 1rk7 n LYS 136 Cb 0.58 -1.24 0.00 0.00 -0.65 0.00 0.00 35.03 33.71 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 -2.88 0.00 -2.58 0.58 -2.24 0.34 -4.42 114.28 103.08 1rk7 n THR 137 Ca -0.22 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.55 1rk7 n THR 137 Cb 0.73 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.02 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 3.99 0.22 3.81 3.38 0.00 -1.07 -4.68 105.19 110.84 1rk7 n GLY 138 Ca 0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.63 -4.95 0.00 1.61 5.15 -1.22 -3.93 115.26 111.29 1rk7 n ASN 139 Ca -0.08 -1.03 0.00 0.00 -0.60 0.00 0.00 54.58 52.87 1rk7 n ASN 139 Cb 0.66 -2.36 0.00 0.00 -0.53 0.00 0.00 39.78 37.55 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rk7 n ALA 140 N -3.80 0.00 -2.61 5.20 0.00 -1.26 -4.89 120.51 113.14 1rk7 n ALA 140 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1rk7 n ALA 140 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 0.00 0.00 2.71 0.00 0.00 -1.26 -4.94 105.19 101.70 1rk7 n GLY 141 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.78 3.73 0.27 1.61 0.01 -1.26 -4.92 113.70 112.36 1rk7 s SER 142 Ca 0.00 -2.30 -0.29 0.00 1.31 0.00 0.00 55.95 54.67 1rk7 s SER 142 Cb 0.00 -0.95 -0.09 0.00 0.21 0.00 0.00 66.02 65.18 1rk7 s SER 142 CO 0.00 -0.32 1.19 -0.13 0.41 0.00 0.00 173.24 174.39 1rk7 s ARG 143 N 0.78 4.52 0.00 12.44 0.52 -1.26 -2.55 118.95 133.40 1rk7 s ARG 143 Ca 0.15 1.94 0.00 0.00 -0.52 0.00 0.00 55.73 57.30 1rk7 s ARG 143 Cb -0.22 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.08 1rk7 s ARG 143 CO -0.07 0.02 0.00 1.28 0.02 0.00 0.00 175.30 176.55 1rk7 n LEU 144 N 1.49 0.00 -4.75 2.53 4.77 -1.26 -4.99 117.00 114.78 1rk7 n LEU 144 Ca 0.01 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.70 1rk7 n LEU 144 Cb 0.44 0.05 0.16 0.00 -2.33 0.00 0.00 43.42 41.74 1rk7 n LEU 144 CO 0.56 -0.48 0.70 0.00 -1.33 0.00 0.00 177.39 176.85 1rk7 s ALA 145 N -1.90 1.49 -0.47 -1.18 0.00 -1.26 -3.93 121.76 114.51 1rk7 s ALA 145 Ca 0.00 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.39 1rk7 s ALA 145 Cb 0.00 -3.00 0.25 0.00 0.00 0.00 0.00 23.12 20.38 1rk7 s ALA 145 CO 0.00 -2.61 0.84 0.00 0.00 0.00 0.00 175.76 174.00 1rk7 n GLY 147 N 1.46 4.39 3.76 0.00 0.00 0.60 -4.70 105.19 110.69 1rk7 n GLY 147 Ca 0.11 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 1rk7 n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rk7 n VAL 148 N 4.81 1.33 -2.99 1.61 0.31 -1.26 -2.83 118.33 119.32 1rk7 n VAL 148 Ca 0.57 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 64.14 1rk7 n VAL 148 Cb 0.36 -1.99 -0.06 0.00 -0.91 0.00 0.00 33.84 31.25 1rk7 n VAL 148 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1rk7 s ILE 149 N -0.36 4.74 0.05 2.52 1.10 -1.23 -4.11 121.20 123.91 1rk7 s ILE 149 Ca 0.60 0.67 0.04 0.00 -0.51 0.00 0.00 60.65 61.46 1rk7 s ILE 149 Cb -0.48 -4.22 -0.02 0.00 0.15 0.00 0.00 42.46 37.88 1rk7 s ILE 149 CO 0.53 -0.50 -0.12 -0.83 -2.11 0.00 0.00 174.94 171.91 1rk7 s GLY 150 N 1.92 0.74 0.49 1.50 0.00 -0.90 -3.19 107.32 107.88 1rk7 s GLY 150 Ca 0.29 -0.86 -0.24 0.00 0.00 0.00 0.00 44.72 43.91 1rk7 s GLY 150 CO 0.18 -0.87 1.41 1.39 0.00 0.00 0.00 173.10 175.21 1rk7 n ILE 151 N 1.59 3.19 -4.08 0.90 2.08 -1.26 -0.57 119.36 121.21 1rk7 n ILE 151 Ca -0.20 -0.50 -0.10 0.00 0.56 0.00 0.00 62.75 62.51 1rk7 n ILE 151 Cb 0.55 -1.79 -0.08 0.00 -0.75 0.00 0.00 39.64 37.57 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 -1.23 0.38 -1.69 -1.39 0.00 -0.64 -4.79 121.76 112.41 1rk7 s ALA 152 Ca 0.65 -1.22 0.13 0.00 0.00 0.00 0.00 51.96 51.52 1rk7 s ALA 152 Cb -0.44 1.16 0.11 0.00 0.00 0.00 0.00 23.12 23.95 1rk7 s ALA 152 CO 0.54 -0.71 0.93 0.94 0.00 0.00 0.00 175.76 177.46