#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 0.70 -0.09 0.00 2.01 -1.26 -5.07 115.64 111.93 1rk7 s THR 2 Ca 0.00 -1.26 0.01 0.00 0.31 0.00 0.00 61.69 60.75 1rk7 s THR 2 Cb 0.00 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 1rk7 s THR 2 CO 0.00 -0.67 -0.10 -0.75 -0.69 0.00 0.00 174.62 172.41 1rk7 s LYS 3 N 1.71 2.93 0.23 4.92 2.20 -1.26 -3.23 119.74 127.25 1rk7 s LYS 3 Ca 0.09 -0.61 0.09 0.00 -0.36 0.00 0.00 55.97 55.18 1rk7 s LYS 3 Cb -0.17 -2.59 -0.04 0.00 -1.51 0.00 0.00 37.83 33.52 1rk7 s LYS 3 CO -0.27 0.51 0.01 0.00 -0.36 0.00 0.00 175.35 175.23 1rk7 s ALA 4 N -0.40 3.19 0.04 3.13 0.00 0.62 -1.07 121.76 127.26 1rk7 s ALA 4 Ca 0.05 -1.54 0.01 0.00 0.00 0.00 0.00 51.96 50.48 1rk7 s ALA 4 Cb -0.12 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1rk7 s ALA 4 CO 0.02 0.34 -0.05 0.08 0.00 0.00 0.00 175.76 176.15 1rk7 s VAL 5 N -2.08 0.34 -0.40 0.00 1.01 0.10 0.14 120.40 119.51 1rk7 s VAL 5 Ca 0.30 -1.11 0.06 0.00 0.00 0.00 0.00 61.98 61.23 1rk7 s VAL 5 Cb -0.08 -0.58 0.17 0.00 0.00 0.00 0.00 36.38 35.89 1rk7 s VAL 5 CO 0.19 -0.51 0.53 0.00 0.00 0.00 0.00 175.10 175.32 1rk7 s ALA 6 N -1.73 -1.60 -0.52 5.51 0.00 0.17 -1.00 121.76 122.59 1rk7 s ALA 6 Ca -0.10 -0.27 -0.28 0.00 0.00 0.00 0.00 51.96 51.31 1rk7 s ALA 6 Cb -0.08 -2.47 0.03 0.00 0.00 0.00 0.00 23.12 20.60 1rk7 s ALA 6 CO -0.01 -2.19 1.12 0.14 0.00 0.00 0.00 175.76 174.81 1rk7 s VAL 7 N 1.67 4.18 0.29 0.00 -7.23 -1.26 -2.27 120.40 115.77 1rk7 s VAL 7 Ca 0.16 0.96 -0.29 0.00 -1.81 0.00 0.00 61.98 61.00 1rk7 s VAL 7 Cb -0.08 -4.63 -0.14 0.00 0.56 0.00 0.00 36.38 32.09 1rk7 s VAL 7 CO -0.05 -1.13 1.15 0.18 -0.31 0.00 0.00 175.10 174.94 1rk7 n LEU 8 N 7.96 2.45 -3.28 1.32 7.99 0.10 -4.62 117.00 128.93 1rk7 n LEU 8 Ca 0.09 1.18 0.03 0.00 -0.01 0.00 0.00 56.01 57.30 1rk7 n LEU 8 Cb 0.49 -1.36 -0.03 0.00 -0.11 0.00 0.00 43.42 42.41 1rk7 n LEU 8 CO 0.70 -1.01 0.68 -0.75 -1.51 0.00 0.00 177.39 175.49 1rk7 s LYS 9 N -1.43 0.20 0.00 3.23 2.20 -1.25 -3.78 119.74 118.91 1rk7 s LYS 9 Ca 0.60 0.47 0.00 0.00 -0.36 0.00 0.00 55.97 56.68 1rk7 s LYS 9 Cb -0.67 0.28 0.00 0.00 -1.51 0.00 0.00 37.83 35.93 1rk7 s LYS 9 CO 0.59 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.88 1rk7 n GLY 10 N 5.01 -2.03 0.33 5.54 0.00 -1.26 -3.56 105.19 109.22 1rk7 n GLY 10 Ca -0.08 0.70 0.25 0.00 0.00 0.00 0.00 46.02 46.89 1rk7 n GLY 10 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1rk7 h ASP 11 N 0.00 0.01 0.00 1.61 3.58 -1.84 -3.46 116.42 116.32 1rk7 h ASP 11 Ca 0.00 0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.71 1rk7 h ASP 11 Cb 0.00 0.35 0.00 0.00 1.72 0.00 0.00 39.33 41.40 1rk7 h ASP 11 CO 0.00 -0.39 0.00 0.61 -2.88 0.00 0.00 179.24 176.58 1rk7 n GLY 12 N -1.36 2.89 0.07 -0.78 0.00 -1.26 -4.92 105.19 99.84 1rk7 n GLY 12 Ca 0.32 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.03 -5.49 1.61 0.13 -1.90 -3.42 132.00 122.89 1rk7 h PRO 13 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 1rk7 h PRO 13 Cb 0.00 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.12 1rk7 h PRO 13 CO 0.00 0.65 1.64 1.55 -0.23 0.00 0.00 178.00 181.62 1rk7 n VAL 14 N -4.76 -0.02 -2.53 1.56 3.14 -1.23 -4.43 118.33 110.07 1rk7 n VAL 14 Ca -0.09 -0.50 -0.24 0.00 -2.96 0.00 0.00 64.34 60.55 1rk7 n VAL 14 Cb 0.34 -2.01 0.00 0.00 -1.06 0.00 0.00 33.84 31.11 1rk7 n VAL 14 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 1rk7 n GLN 15 N 8.76 3.00 -0.63 1.45 7.27 0.20 -3.84 117.38 133.60 1rk7 n GLN 15 Ca 0.46 -4.28 -0.31 0.00 0.07 0.00 0.00 57.00 52.93 1rk7 n GLN 15 Cb 0.36 -2.06 0.19 0.00 2.41 0.00 0.00 30.24 31.14 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 -0.39 -1.75 2.57 1.69 0.00 -1.25 -4.47 105.19 101.58 1rk7 n GLY 16 Ca 0.33 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.10 -0.03 -0.61 1.01 0.22 0.02 121.20 119.29 1rk7 s ILE 17 Ca 0.63 -0.64 0.07 0.00 0.00 0.00 0.00 60.65 60.72 1rk7 s ILE 17 Cb -0.21 -0.91 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 1rk7 s ILE 17 CO 0.64 -0.63 -0.25 -0.51 0.00 0.00 0.00 174.94 174.19 1rk7 s ILE 18 N 2.12 2.14 0.31 2.92 -1.16 -0.96 -1.47 121.20 125.10 1rk7 s ILE 18 Ca 0.08 -1.07 0.04 0.00 -0.51 0.00 0.00 60.65 59.19 1rk7 s ILE 18 Cb -0.16 -1.75 -0.06 0.00 0.61 0.00 0.00 42.46 41.10 1rk7 s ILE 18 CO -0.32 0.58 0.04 0.20 -2.81 0.00 0.00 174.94 172.63 1rk7 s ASN 19 N -0.52 2.31 -0.05 4.50 -0.87 -0.41 0.42 114.94 120.30 1rk7 s ASN 19 Ca 0.07 -1.34 0.04 0.00 -1.57 0.00 0.00 52.86 50.06 1rk7 s ASN 19 Cb -0.11 -0.07 0.00 0.00 -0.02 0.00 0.00 41.25 41.05 1rk7 s ASN 19 CO 0.00 -0.58 -0.17 -0.36 -2.57 0.00 0.00 177.10 173.43 1rk7 s PHE 20 N -3.30 1.76 -0.12 2.20 0.40 0.37 -2.97 117.98 116.32 1rk7 s PHE 20 Ca 0.35 -0.57 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1rk7 s PHE 20 Cb 0.08 -1.20 0.01 0.00 0.51 0.00 0.00 43.02 42.42 1rk7 s PHE 20 CO 0.14 -0.22 -0.17 -2.00 0.70 0.00 0.00 175.22 173.67 1rk7 s GLU 21 N 0.22 2.46 -0.48 0.44 2.56 -1.01 -0.28 118.70 122.60 1rk7 s GLU 21 Ca -0.08 -0.64 0.06 0.00 0.00 0.00 0.00 54.97 54.31 1rk7 s GLU 21 Cb -0.13 -2.07 0.18 0.00 2.00 0.00 0.00 34.13 34.11 1rk7 s GLU 21 CO 0.03 -0.07 0.62 -1.14 -0.56 0.00 0.00 175.26 174.14 1rk7 s GLN 22 N 1.00 1.01 -0.23 4.30 0.74 -1.20 0.22 119.66 125.51 1rk7 s GLN 22 Ca -0.05 -1.24 -0.04 0.00 0.05 0.00 0.00 55.36 54.08 1rk7 s GLN 22 Cb -0.15 -0.37 -0.07 0.00 1.10 0.00 0.00 33.01 33.52 1rk7 s GLN 22 CO -0.03 -1.33 3.05 1.63 -0.55 0.00 0.00 175.29 178.06 1rk7 n LYS 23 N 3.06 2.12 -3.68 1.67 5.02 -1.26 -4.02 118.16 121.08 1rk7 n LYS 23 Ca 0.20 -1.60 -0.14 0.00 -2.02 0.00 0.00 58.31 54.75 1rk7 n LYS 23 Cb 0.54 -1.99 -0.08 0.00 -0.02 0.00 0.00 35.03 33.47 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 -0.48 0.69 0.02 1.97 0.41 -1.26 -4.99 118.70 115.06 1rk7 s GLU 24 Ca 0.58 0.65 0.28 0.00 -0.41 0.00 0.00 54.97 56.07 1rk7 s GLU 24 Cb 0.33 0.33 1.06 0.00 -1.78 0.00 0.00 34.13 34.07 1rk7 s GLU 24 CO -0.10 -0.11 1.82 0.45 -0.49 0.00 0.00 175.26 176.83 1rk7 n SER 25 N 2.50 0.17 -1.68 -0.19 2.88 -1.26 -3.89 113.62 112.15 1rk7 n SER 25 Ca -0.15 0.38 -0.03 0.00 -1.33 0.00 0.00 58.87 57.74 1rk7 n SER 25 Cb 0.56 -0.39 0.01 0.00 -0.75 0.00 0.00 64.21 63.64 1rk7 n SER 25 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1rk7 n ASN 26 N -1.58 -0.53 -4.66 -3.46 0.23 -1.26 -5.09 115.26 98.92 1rk7 n ASN 26 Ca 0.07 -2.06 -0.26 0.00 -0.53 0.00 0.00 54.58 51.80 1rk7 n ASN 26 Cb 0.35 0.22 -0.01 0.00 -2.08 0.00 0.00 39.78 38.26 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rk7 n GLY 27 N -0.36 2.89 3.81 4.83 0.00 -1.25 -5.09 105.19 110.03 1rk7 n GLY 27 Ca -0.16 -2.30 -0.32 0.00 0.00 0.00 0.00 46.02 43.23 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 -4.07 3.22 -0.51 1.61 0.04 -1.25 -4.80 135.00 129.23 1rk7 s PRO 28 Ca 0.25 1.08 -0.06 0.00 0.04 0.00 0.00 61.00 62.31 1rk7 s PRO 28 Cb -0.02 -2.02 0.13 0.00 0.04 0.00 0.00 34.50 32.63 1rk7 s PRO 28 CO 0.16 -0.88 0.35 0.08 0.04 0.00 0.00 177.00 176.75 1rk7 s VAL 29 N -2.71 3.89 -0.76 -0.36 1.01 -0.35 -4.59 120.40 116.54 1rk7 s VAL 29 Ca 0.61 -2.20 -0.26 0.00 0.00 0.00 0.00 61.98 60.13 1rk7 s VAL 29 Cb -0.15 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1rk7 s VAL 29 CO 0.44 -0.79 2.11 -0.54 0.00 0.00 0.00 175.10 176.32 1rk7 s LYS 30 N 0.87 2.26 -0.01 2.72 1.02 0.13 -4.34 119.74 122.39 1rk7 s LYS 30 Ca 0.10 0.33 -0.16 0.00 0.02 0.00 0.00 55.97 56.26 1rk7 s LYS 30 Cb -0.23 -4.78 -0.06 0.00 -0.52 0.00 0.00 37.83 32.24 1rk7 s LYS 30 CO -0.03 -3.51 0.44 0.08 -0.92 0.00 0.00 175.35 171.41 1rk7 s VAL 31 N 11.39 5.02 -0.01 3.17 1.01 -0.67 -2.40 120.40 137.91 1rk7 s VAL 31 Ca 0.79 0.90 -0.29 0.00 0.00 0.00 0.00 61.98 63.38 1rk7 s VAL 31 Cb -0.11 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.60 1rk7 s VAL 31 CO 0.10 0.53 0.70 -1.66 0.00 0.00 0.00 175.10 174.77 1rk7 s TRP 32 N -0.78 -0.59 0.07 5.22 -2.14 -1.16 -1.40 118.94 118.16 1rk7 s TRP 32 Ca 0.25 0.85 -0.09 0.00 2.66 0.00 0.00 56.10 59.77 1rk7 s TRP 32 Cb -0.17 0.45 0.03 0.00 -3.10 0.00 0.00 33.47 30.69 1rk7 s TRP 32 CO 0.13 -0.64 0.43 0.41 -2.66 0.00 0.00 176.95 174.63 1rk7 n GLY 33 N 0.54 0.97 3.53 3.67 0.00 -1.04 -1.29 105.19 111.56 1rk7 n GLY 33 Ca -0.17 -1.01 -0.06 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.02 -0.85 0.59 1.61 1.04 -0.54 -1.99 113.70 111.55 1rk7 s SER 34 Ca 0.10 1.37 -0.07 0.00 0.48 0.00 0.00 55.95 57.82 1rk7 s SER 34 Cb -0.01 1.61 -0.01 0.00 0.10 0.00 0.00 66.02 67.71 1rk7 s SER 34 CO 0.02 -0.23 0.92 -0.63 0.98 0.00 0.00 173.24 174.31 1rk7 s ILE 35 N 2.19 4.02 -0.28 -1.02 1.01 0.31 0.69 121.20 128.12 1rk7 s ILE 35 Ca -0.07 0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1rk7 s ILE 35 Cb -0.09 -3.59 0.18 0.00 0.01 0.00 0.00 42.46 38.96 1rk7 s ILE 35 CO -0.17 -0.65 0.53 -0.54 0.00 0.00 0.00 174.94 174.10 1rk7 s LYS 36 N -5.02 0.50 0.00 2.79 1.02 -1.26 -3.29 119.74 114.48 1rk7 s LYS 36 Ca 0.53 0.70 0.00 0.00 0.02 0.00 0.00 55.97 57.22 1rk7 s LYS 36 Cb -0.11 0.16 0.00 0.00 -0.52 0.00 0.00 37.83 37.36 1rk7 s LYS 36 CO 0.47 -0.77 0.00 0.41 -0.92 0.00 0.00 175.35 174.54 1rk7 n GLY 37 N 5.40 4.64 0.20 -3.33 0.00 -1.26 0.63 105.19 111.47 1rk7 n GLY 37 Ca -0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.04 0.99 4.32 -1.26 -4.72 117.00 112.29 1rk7 n LEU 38 Ca 0.00 -0.04 -0.22 0.00 -0.02 0.00 0.00 56.01 55.73 1rk7 n LEU 38 Cb 0.00 -0.06 -0.16 0.00 -1.62 0.00 0.00 43.42 41.59 1rk7 n LEU 38 CO 0.00 -1.43 -0.45 0.42 -1.22 0.00 0.00 177.39 174.70 1rk7 s THR 39 N -0.79 0.95 -0.38 -5.08 -4.23 -1.26 -3.54 115.64 101.32 1rk7 s THR 39 Ca 0.03 -0.46 -0.44 0.00 -1.18 0.00 0.00 61.69 59.64 1rk7 s THR 39 Cb -0.01 -0.83 -0.19 0.00 1.34 0.00 0.00 72.50 72.81 1rk7 s THR 39 CO 0.03 0.29 1.43 -1.84 -0.54 0.00 0.00 174.62 173.98 1rk7 n GLU 40 N 3.18 0.00 0.00 3.99 -0.00 -1.26 -4.55 120.64 122.00 1rk7 n GLU 40 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 1rk7 n GLU 40 Cb 0.54 -1.44 0.00 0.00 -0.00 0.00 0.00 31.44 30.54 1rk7 n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1rk7 n GLY 41 N 3.32 -0.21 3.85 -1.84 0.00 -1.26 -4.94 105.19 104.12 1rk7 n GLY 41 Ca 0.27 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 4.07 -0.21 0.99 2.01 -1.26 -1.73 118.68 122.55 1rk7 s LEU 42 Ca 0.00 0.11 -0.05 0.00 0.01 0.00 0.00 54.13 54.20 1rk7 s LEU 42 Cb 0.00 -2.71 0.11 0.00 0.01 0.00 0.00 46.19 43.60 1rk7 s LEU 42 CO 0.00 0.16 0.39 -1.00 1.01 0.00 0.00 176.35 176.90 1rk7 s HIS 43 N -1.49 -0.77 -1.14 0.29 3.76 -1.23 -4.08 115.29 110.63 1rk7 s HIS 43 Ca 0.32 1.19 -0.22 0.00 -0.15 0.00 0.00 55.06 56.20 1rk7 s HIS 43 Cb -0.12 0.16 -0.08 0.00 1.11 0.00 0.00 32.58 33.64 1rk7 s HIS 43 CO 0.25 -0.57 1.91 0.41 -0.85 0.00 0.00 174.74 175.90 1rk7 n GLY 44 N 5.38 1.51 3.63 -2.22 0.00 -1.26 -2.58 105.19 109.64 1rk7 n GLY 44 Ca -0.06 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 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 9.13 2.39 -0.01 1.61 5.36 -1.26 -2.52 117.98 132.68 1rk7 s PHE 45 Ca 0.65 0.71 -0.29 0.00 -0.96 0.00 0.00 56.93 57.03 1rk7 s PHE 45 Cb 0.03 -3.98 0.10 0.00 -0.34 0.00 0.00 43.02 38.83 1rk7 s PHE 45 CO 0.12 -2.29 1.28 -3.38 -1.46 0.00 0.00 175.22 169.49 1rk7 s HIS 46 N 4.89 0.01 0.66 10.12 -3.43 -1.25 -4.67 115.29 121.62 1rk7 s HIS 46 Ca 0.64 -0.13 -0.11 0.00 -0.80 0.00 0.00 55.06 54.66 1rk7 s HIS 46 Cb -0.20 0.56 -0.02 0.00 -1.43 0.00 0.00 32.58 31.49 1rk7 s HIS 46 CO 0.27 -0.30 1.04 0.08 -2.00 0.00 0.00 174.74 173.83 1rk7 s VAL 47 N -2.16 4.38 0.25 -5.38 1.01 -0.99 0.72 120.40 118.23 1rk7 s VAL 47 Ca 0.24 0.77 -0.12 0.00 0.00 0.00 0.00 61.98 62.87 1rk7 s VAL 47 Cb 0.01 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 1rk7 s VAL 47 CO -0.02 -1.01 0.46 -2.28 0.00 0.00 0.00 175.10 172.25 1rk7 s HIS 48 N -3.13 0.45 0.00 5.22 5.04 -1.26 -4.85 115.29 116.75 1rk7 s HIS 48 Ca 0.56 -0.80 0.00 0.00 -1.54 0.00 0.00 55.06 53.29 1rk7 s HIS 48 Cb -0.12 0.14 0.00 0.00 0.04 0.00 0.00 32.58 32.63 1rk7 s HIS 48 CO 0.54 -0.99 0.00 0.39 -2.34 0.00 0.00 174.74 172.35 1rk7 n GLU 49 N -0.39 0.00 -4.27 2.88 -0.58 -1.26 -4.77 120.64 112.25 1rk7 n GLU 49 Ca -0.01 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.38 1rk7 n GLU 49 Cb 0.62 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 31.40 1rk7 n GLU 49 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1rk7 s GLU 50 N 0.00 3.16 0.66 3.49 -6.30 -1.26 -3.03 118.70 115.42 1rk7 s GLU 50 Ca 0.00 -0.37 0.00 0.00 -2.50 0.00 0.00 54.97 52.10 1rk7 s GLU 50 Cb 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 34.13 31.24 1rk7 s GLU 50 CO 0.00 0.66 0.00 -0.85 0.02 0.00 0.00 175.26 175.09 1rk7 n GLU 51 N 2.29 0.00 -3.36 4.30 0.28 -1.26 -4.76 120.64 118.13 1rk7 n GLU 51 Ca -0.19 0.00 0.02 0.00 -0.16 0.00 0.00 57.16 56.83 1rk7 n GLU 51 Cb 0.54 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.38 1rk7 n GLU 51 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1rk7 s ASP 52 N -4.00 -1.27 -0.31 -1.84 -4.77 -1.26 -4.85 116.67 98.37 1rk7 s ASP 52 Ca 0.00 1.16 0.04 0.00 -3.30 0.00 0.00 52.55 50.44 1rk7 s ASP 52 Cb 0.00 2.21 0.33 0.00 -1.09 0.00 0.00 42.92 44.37 1rk7 s ASP 52 CO 0.00 -0.24 1.44 0.59 0.70 0.00 0.00 175.17 177.66 1rk7 n ASN 53 N 5.43 -1.04 0.03 2.11 3.02 -1.26 -5.03 115.26 118.52 1rk7 n ASN 53 Ca -0.06 -1.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.93 1rk7 n ASN 53 Cb 0.50 1.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.67 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1rk7 n THR 54 N 0.56 0.00 0.00 3.41 5.66 -1.26 -5.12 114.28 117.53 1rk7 n THR 54 Ca -0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1rk7 n THR 54 Cb 0.76 -0.20 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 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 -2.66 0.00 0.00 1.79 0.00 -1.26 -5.08 120.51 113.30 1rk7 n ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rk7 n ALA 55 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.39 1.45 0.00 0.00 -1.26 -5.03 105.19 100.73 1rk7 n GLY 56 Ca 0.00 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 0.01 0.00 0.00 0.00 -2.24 -1.26 -4.93 114.28 105.85 1rk7 n THR 58 Ca 0.26 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 1rk7 n THR 58 Cb 1.08 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 1rk7 n THR 58 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1rk7 n SER 59 N 0.00 0.00 0.04 3.42 3.41 -1.26 -5.09 113.62 114.15 1rk7 n SER 59 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1rk7 n SER 59 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1rk7 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rk7 n ALA 60 N 0.00 0.00 0.00 7.33 0.00 -1.26 -5.14 120.51 121.44 1rk7 n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rk7 n ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1rk7 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk7 n GLY 61 N -1.40 3.15 2.36 0.00 0.00 -1.26 -5.01 105.19 103.04 1rk7 n GLY 61 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 1rk7 n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 62 N -0.78 2.35 -2.71 1.61 -0.04 -1.26 -3.65 135.00 130.53 1rk7 n PRO 62 Ca 0.00 -1.43 -0.02 0.00 -0.04 0.00 0.00 63.50 62.01 1rk7 n PRO 62 Cb 0.00 -2.36 0.11 0.00 -0.04 0.00 0.00 33.50 31.21 1rk7 n PRO 62 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1rk7 n HIS 63 N 3.50 -1.18 -1.43 0.54 -0.00 -1.17 -4.59 115.22 110.89 1rk7 n HIS 63 Ca 0.50 -1.87 0.00 0.00 0.46 0.00 0.00 57.72 56.81 1rk7 n HIS 63 Cb 0.34 1.06 0.00 0.00 -0.12 0.00 0.00 29.99 31.28 1rk7 n HIS 63 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1rk7 n PHE 64 N -1.20 -0.23 -2.90 1.57 3.72 -1.24 -4.66 117.46 112.52 1rk7 n PHE 64 Ca -0.10 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.02 1rk7 n PHE 64 Cb 0.86 0.05 -0.02 0.00 -0.94 0.00 0.00 39.48 39.43 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 6.39 -1.14 4.37 0.01 -1.26 -4.80 114.94 114.51 1rk7 s ASN 65 Ca 0.00 0.92 -0.15 0.00 -0.71 0.00 0.00 52.86 52.92 1rk7 s ASN 65 Cb 0.00 -2.24 -0.07 0.00 0.41 0.00 0.00 41.25 39.36 1rk7 s ASN 65 CO 0.00 -0.42 2.21 -0.81 -1.51 0.00 0.00 177.10 176.56 1rk7 n PRO 66 N -1.65 2.35 0.00 -0.60 -0.04 -1.26 -2.60 135.00 131.20 1rk7 n PRO 66 Ca 0.00 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.41 1rk7 n PRO 66 Cb 0.55 -2.93 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 1rk7 n PRO 66 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1rk7 n LEU 67 N 5.85 0.00 -4.52 1.53 4.77 -1.26 -5.08 117.00 118.29 1rk7 n LEU 67 Ca 0.54 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 56.18 1rk7 n LEU 67 Cb 0.32 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.30 1rk7 n LEU 67 CO 0.91 -0.00 2.04 -1.54 -1.33 0.00 0.00 177.39 177.46 1rk7 n SER 68 N -0.90 0.81 -0.73 -1.43 3.41 -1.07 -4.65 113.62 109.07 1rk7 n SER 68 Ca 0.00 -0.33 0.02 0.00 -0.26 0.00 0.00 58.87 58.30 1rk7 n SER 68 Cb 0.00 -1.15 0.08 0.00 -0.26 0.00 0.00 64.21 62.88 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 8.24 1.75 -1.33 4.33 1.74 -1.26 -4.84 116.66 125.29 1rk7 n ARG 69 Ca 0.55 -0.63 0.15 0.00 -0.77 0.00 0.00 57.85 57.16 1rk7 n ARG 69 Cb 0.25 -1.60 -0.07 0.00 -1.02 0.00 0.00 32.46 30.01 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 0.11 -2.83 -1.29 5.56 5.02 -1.26 -4.47 118.16 118.99 1rk7 n LYS 70 Ca 0.06 2.25 0.00 0.00 -2.02 0.00 0.00 58.31 58.60 1rk7 n LYS 70 Cb 0.41 -3.41 0.00 0.00 -0.02 0.00 0.00 35.03 32.01 1rk7 n LYS 70 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1rk7 n HIS 71 N -4.12 -3.41 0.00 2.13 8.25 -0.90 -3.36 115.22 113.81 1rk7 n HIS 71 Ca -0.07 1.79 0.00 0.00 -0.26 0.00 0.00 57.72 59.18 1rk7 n HIS 71 Cb 0.62 -3.02 0.00 0.00 1.12 0.00 0.00 29.99 28.71 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rk7 n GLY 72 N -0.14 4.17 0.00 -1.41 0.00 0.11 -2.81 105.19 105.12 1rk7 n GLY 72 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.74 -0.89 0.10 -0.02 0.00 -1.26 -4.63 105.19 96.76 1rk7 n GLY 73 Ca 0.00 0.65 -0.03 0.00 0.00 0.00 0.00 46.02 46.64 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 -0.19 -0.10 1.61 0.13 -1.87 -3.31 132.00 128.26 1rk7 h PRO 74 Ca 0.00 0.01 0.03 0.00 -0.87 0.00 0.00 66.00 65.17 1rk7 h PRO 74 Cb 0.00 0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.17 1rk7 h PRO 74 CO 0.00 -0.13 0.08 -0.22 -0.23 0.00 0.00 178.00 177.50 1rk7 h LYS 75 N -0.65 0.00 -5.45 0.86 1.63 -1.96 -3.47 116.57 107.52 1rk7 h LYS 75 Ca -0.02 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1rk7 h LYS 75 Cb 0.16 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 1rk7 h LYS 75 CO 0.03 0.00 -1.05 -0.25 -3.45 0.00 0.00 179.45 174.74 1rk7 n ASP 76 N -4.46 -6.11 -0.00 4.20 8.00 -1.24 -4.96 116.55 111.97 1rk7 n ASP 76 Ca -0.00 1.17 0.03 0.00 0.71 0.00 0.00 54.79 56.70 1rk7 n ASP 76 Cb 0.19 -4.24 -0.05 0.00 -0.02 0.00 0.00 41.12 37.00 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1rk7 n GLU 77 N 1.19 1.36 -2.48 -1.24 2.13 -1.26 -4.95 120.64 115.40 1rk7 n GLU 77 Ca -0.09 -0.04 -0.06 0.00 0.66 0.00 0.00 57.16 57.63 1rk7 n GLU 77 Cb 0.24 -1.06 -0.01 0.00 0.27 0.00 0.00 31.44 30.88 1rk7 n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1rk7 n GLU 78 N -1.58 0.30 0.00 5.31 1.02 -1.21 -4.99 120.64 119.49 1rk7 n GLU 78 Ca -0.01 -1.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.05 1rk7 n GLU 78 Cb 0.15 1.07 0.00 0.00 -0.02 0.00 0.00 31.44 32.64 1rk7 n GLU 78 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1rk7 n ARG 79 N -0.23 0.00 0.00 3.49 0.63 -1.12 -4.47 116.66 114.96 1rk7 n ARG 79 Ca -0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1rk7 n ARG 79 Cb 0.23 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.14 1rk7 n ARG 79 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1rk7 n HIS 80 N 0.00 0.00 0.00 -0.14 -0.00 -1.26 -3.93 115.22 109.88 1rk7 n HIS 80 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1rk7 n HIS 80 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1rk7 n HIS 80 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 1rk7 n VAL 81 N 0.00 0.00 0.24 3.57 0.31 -1.26 -3.68 118.33 117.51 1rk7 n VAL 81 Ca 0.00 1.39 -0.16 0.00 -0.01 0.00 0.00 64.34 65.57 1rk7 n VAL 81 Cb 0.00 -2.33 -0.08 0.00 -0.91 0.00 0.00 33.84 30.52 1rk7 n VAL 81 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1rk7 h GLY 82 N 0.00 -0.76 -4.68 2.92 0.00 -1.92 -3.43 103.07 95.20 1rk7 h GLY 82 Ca 0.00 0.35 -0.61 0.00 0.00 0.00 0.00 47.33 47.07 1rk7 h GLY 82 CO 0.00 -0.28 0.40 1.34 0.00 0.00 0.00 176.54 178.00 1rk7 n ASP 83 N -5.43 2.04 -2.62 0.19 2.03 -1.24 -4.28 116.55 107.24 1rk7 n ASP 83 Ca -0.10 1.16 -0.05 0.00 0.52 0.00 0.00 54.79 56.31 1rk7 n ASP 83 Cb 0.33 -1.34 0.09 0.00 -0.72 0.00 0.00 41.12 39.48 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 1.79 -1.57 0.00 -2.67 7.94 -1.26 -4.50 117.00 116.73 1rk7 n LEU 84 Ca 0.11 -2.97 0.00 0.00 -1.11 0.00 0.00 56.01 52.05 1rk7 n LEU 84 Cb 0.30 0.24 0.00 0.00 0.53 0.00 0.00 43.42 44.49 1rk7 n LEU 84 CO 0.62 1.67 0.00 0.61 -1.11 0.00 0.00 177.39 179.18 1rk7 n GLY 85 N -0.76 0.55 3.54 -3.96 0.00 -1.26 -4.75 105.19 98.55 1rk7 n GLY 85 Ca -0.10 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.72 2.92 0.00 1.61 -0.87 -1.26 -4.30 114.94 109.32 1rk7 s ASN 86 Ca 0.00 -1.58 0.00 0.00 -1.57 0.00 0.00 52.86 49.71 1rk7 s ASN 86 Cb 0.00 0.33 0.00 0.00 -0.02 0.00 0.00 41.25 41.56 1rk7 s ASN 86 CO 0.00 -0.82 0.00 1.33 -2.57 0.00 0.00 177.10 175.04 1rk7 n VAL 87 N -0.91 0.00 -3.73 1.60 0.24 -1.07 -4.94 118.33 109.52 1rk7 n VAL 87 Ca -0.07 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.10 1rk7 n VAL 87 Cb 0.66 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 1rk7 n VAL 87 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1rk7 s THR 88 N -0.71 -0.00 0.81 3.34 2.01 -1.26 -3.52 115.64 116.31 1rk7 s THR 88 Ca 0.00 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.93 1rk7 s THR 88 Cb 0.00 -0.56 0.13 0.00 0.01 0.00 0.00 72.50 72.08 1rk7 s THR 88 CO 0.00 0.01 1.13 0.00 -0.69 0.00 0.00 174.62 175.07 1rk7 s ALA 89 N 0.41 2.95 0.00 7.40 0.00 -0.70 -4.54 121.76 127.28 1rk7 s ALA 89 Ca -0.02 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.71 1rk7 s ALA 89 Cb -0.04 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.57 1rk7 s ALA 89 CO -0.02 -1.78 0.00 -3.47 0.00 0.00 0.00 175.76 170.49 1rk7 n ASP 90 N -3.23 0.00 0.00 0.00 2.03 0.12 -4.54 116.55 110.93 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 2.29 -1.92 0.00 0.00 177.20 177.57 1rk7 n LYS 91 N 0.00 0.45 -0.43 -0.67 2.85 -1.26 -4.76 118.16 114.34 1rk7 n LYS 91 Ca 0.00 -0.64 0.00 0.00 -1.05 0.00 0.00 58.31 56.62 1rk7 n LYS 91 Cb 0.00 -0.58 0.00 0.00 -0.65 0.00 0.00 35.03 33.80 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 0.00 0.00 -5.58 8.00 -1.26 -4.77 116.55 112.86 1rk7 n ASP 92 Ca 0.00 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 53.92 1rk7 n ASP 92 Cb 0.45 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rk7 n GLY 93 N 0.00 3.02 3.40 0.44 0.00 -1.23 -4.22 105.19 106.61 1rk7 n GLY 93 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.08 0.14 -4.21 1.61 0.31 -1.26 -4.41 118.33 109.44 1rk7 n VAL 94 Ca 0.00 -0.18 -0.33 0.00 -0.01 0.00 0.00 64.34 63.81 1rk7 n VAL 94 Cb 0.00 -1.33 -0.16 0.00 -0.91 0.00 0.00 33.84 31.44 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 6.83 2.42 0.15 3.52 0.00 -1.21 -0.70 121.76 132.77 1rk7 s ALA 95 Ca 1.12 -1.17 0.07 0.00 0.00 0.00 0.00 51.96 51.98 1rk7 s ALA 95 Cb -1.03 -1.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 1rk7 s ALA 95 CO 0.54 -0.28 -0.06 0.16 0.00 0.00 0.00 175.76 176.12 1rk7 s ASP 96 N 1.20 4.53 0.11 0.00 -4.77 -1.26 0.12 116.67 116.60 1rk7 s ASP 96 Ca 0.02 -0.42 0.03 0.00 -3.30 0.00 0.00 52.55 48.88 1rk7 s ASP 96 Cb -0.14 -0.89 -0.04 0.00 -1.09 0.00 0.00 42.92 40.75 1rk7 s ASP 96 CO -0.08 0.13 -0.08 -0.69 0.70 0.00 0.00 175.17 175.15 1rk7 s VAL 97 N -1.52 0.85 -0.30 2.11 1.01 -0.84 -4.93 120.40 116.79 1rk7 s VAL 97 Ca 0.25 -1.96 0.01 0.00 0.00 0.00 0.00 61.98 60.28 1rk7 s VAL 97 Cb -0.10 -1.72 0.19 0.00 0.00 0.00 0.00 36.38 34.76 1rk7 s VAL 97 CO 0.16 -0.82 0.73 -0.94 0.00 0.00 0.00 175.10 174.23 1rk7 s SER 98 N -3.05 -1.27 0.06 3.32 1.04 -1.25 -2.50 113.70 110.04 1rk7 s SER 98 Ca 0.13 0.10 0.07 0.00 0.48 0.00 0.00 55.95 56.73 1rk7 s SER 98 Cb 0.04 1.79 -0.03 0.00 0.10 0.00 0.00 66.02 67.92 1rk7 s SER 98 CO -0.03 -0.23 -0.20 -0.63 0.98 0.00 0.00 173.24 173.14 1rk7 s ILE 99 N 2.81 1.58 -0.42 -1.02 1.01 -0.49 -5.01 121.20 119.66 1rk7 s ILE 99 Ca 0.15 -1.25 0.02 0.00 0.00 0.00 0.00 60.65 59.57 1rk7 s ILE 99 Cb -0.07 -1.40 0.13 0.00 0.01 0.00 0.00 42.46 41.14 1rk7 s ILE 99 CO -0.24 0.10 0.23 -1.83 0.00 0.00 0.00 174.94 173.20 1rk7 s GLU 100 N -1.36 1.16 0.30 2.79 -1.05 -1.26 -1.67 118.70 117.61 1rk7 s GLU 100 Ca 0.06 -1.87 0.09 0.00 -0.15 0.00 0.00 54.97 53.10 1rk7 s GLU 100 Cb -0.09 -2.18 -0.04 0.00 -0.44 0.00 0.00 34.13 31.38 1rk7 s GLU 100 CO 0.02 -1.16 0.05 0.34 0.95 0.00 0.00 175.26 175.46 1rk7 s ASP 101 N 0.51 4.53 -0.09 0.83 -1.08 -1.26 -4.94 116.67 115.17 1rk7 s ASP 101 Ca 0.17 -0.74 0.21 0.00 -0.52 0.00 0.00 52.55 51.68 1rk7 s ASP 101 Cb -0.24 -0.76 0.44 0.00 -1.46 0.00 0.00 42.92 40.89 1rk7 s ASP 101 CO -0.00 -0.13 1.18 -1.54 0.52 0.00 0.00 175.17 175.19 1rk7 n SER 102 N -0.99 1.37 -0.09 -0.34 3.41 -1.26 -1.21 113.62 114.51 1rk7 n SER 102 Ca -0.05 -2.56 -0.15 0.00 -0.26 0.00 0.00 58.87 55.85 1rk7 n SER 102 Cb 0.60 -0.38 -0.08 0.00 -0.26 0.00 0.00 64.21 64.09 1rk7 n SER 102 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1rk7 n VAL 103 N -0.06 1.06 -1.13 -3.33 0.24 -1.26 -4.83 118.33 109.02 1rk7 n VAL 103 Ca 0.11 -0.38 -0.30 0.00 -2.04 0.00 0.00 64.34 61.73 1rk7 n VAL 103 Cb 0.99 -1.28 0.23 0.00 -1.47 0.00 0.00 33.84 32.31 1rk7 n VAL 103 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1rk7 s ILE 104 N -2.37 1.65 -0.06 1.34 -0.00 -1.26 -4.85 121.20 115.65 1rk7 s ILE 104 Ca -0.25 0.00 -0.16 0.00 -0.00 0.00 0.00 60.65 60.24 1rk7 s ILE 104 Cb 0.07 -2.52 0.03 0.00 -0.00 0.00 0.00 42.46 40.05 1rk7 s ILE 104 CO 0.41 0.00 0.37 -0.44 -0.00 0.00 0.00 174.94 175.28 1rk7 s SER 105 N -3.92 -0.30 0.05 4.36 0.01 -1.26 -4.93 113.70 107.70 1rk7 s SER 105 Ca 0.71 0.36 -0.27 0.00 1.31 0.00 0.00 55.95 58.05 1rk7 s SER 105 Cb -0.10 0.48 -0.17 0.00 0.21 0.00 0.00 66.02 66.44 1rk7 s SER 105 CO 0.56 -0.37 1.51 -0.07 0.41 0.00 0.00 173.24 175.28 1rk7 h LEU 106 N 4.28 -0.38 -5.75 2.44 3.38 -1.95 1.37 115.31 118.70 1rk7 h LEU 106 Ca -0.29 -0.07 -0.47 0.00 0.09 0.00 0.00 57.88 57.15 1rk7 h LEU 106 Cb 1.17 0.10 -0.33 0.00 0.09 0.00 0.00 40.66 41.69 1rk7 h LEU 106 CO 0.36 -0.16 -0.96 -0.24 0.09 0.00 0.00 178.44 177.52 1rk7 n SER 107 N -5.23 -0.51 0.00 -0.43 2.88 -1.26 -1.67 113.62 107.40 1rk7 n SER 107 Ca -0.10 -2.89 0.00 0.00 -1.33 0.00 0.00 58.87 54.55 1rk7 n SER 107 Cb 0.23 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1rk7 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rk7 n GLY 108 N 1.31 5.44 0.36 0.46 0.00 -1.26 -4.85 105.19 106.65 1rk7 n GLY 108 Ca 0.18 -0.94 0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 0.21 0.00 1.61 5.19 -1.96 -3.02 116.42 118.45 1rk7 h ASP 109 Ca 0.00 0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.27 1rk7 h ASP 109 Cb 0.00 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1rk7 h ASP 109 CO 0.00 0.12 -1.19 1.41 -3.12 0.00 0.00 179.24 176.46 1rk7 n HIS 110 N -4.44 0.55 -2.76 4.55 8.25 -1.26 -5.04 115.22 115.06 1rk7 n HIS 110 Ca 0.09 0.24 -0.04 0.00 -0.26 0.00 0.00 57.72 57.75 1rk7 n HIS 110 Cb 0.45 -0.83 -0.03 0.00 1.12 0.00 0.00 29.99 30.70 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 -4.47 -2.80 0.03 0.41 2.88 -0.05 -4.82 113.62 104.80 1rk7 n SER 111 Ca -0.24 1.22 -0.01 0.00 -1.33 0.00 0.00 58.87 58.52 1rk7 n SER 111 Cb 0.54 -4.07 -0.09 0.00 -0.75 0.00 0.00 64.21 59.84 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 4.41 0.53 -1.74 2.46 -0.00 0.27 -3.47 117.51 119.98 1rk7 h ILE 112 Ca -0.38 -2.06 -0.69 0.00 -0.00 0.00 0.00 64.86 61.73 1rk7 h ILE 112 Cb 0.87 2.07 0.03 0.00 -0.00 0.00 0.00 36.82 39.79 1rk7 h ILE 112 CO 0.01 0.30 0.86 -0.38 -0.00 0.00 0.00 178.15 178.95 1rk7 n ILE 113 N -2.91 0.30 0.00 0.16 2.08 -0.70 -1.07 119.36 117.22 1rk7 n ILE 113 Ca -0.10 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.16 1rk7 n ILE 113 Cb 0.86 -1.33 0.00 0.00 -0.75 0.00 0.00 39.64 38.42 1rk7 n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1rk7 n GLY 114 N 3.90 1.08 3.91 7.39 0.00 -1.20 -5.04 105.19 115.23 1rk7 n GLY 114 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.64 3.52 -0.04 1.61 0.52 -0.23 -4.88 118.95 118.81 1rk7 s ARG 115 Ca 0.00 -0.26 -0.02 0.00 -0.52 0.00 0.00 55.73 54.93 1rk7 s ARG 115 Cb 0.00 -2.99 0.02 0.00 0.52 0.00 0.00 34.95 32.50 1rk7 s ARG 115 CO 0.00 0.57 0.09 -0.08 0.02 0.00 0.00 175.30 175.91 1rk7 s THR 116 N -1.51 -0.03 -1.22 0.02 -1.32 -1.26 0.15 115.64 110.47 1rk7 s THR 116 Ca 0.35 0.10 -0.12 0.00 -1.21 0.00 0.00 61.69 60.82 1rk7 s THR 116 Cb -0.13 -0.15 0.18 0.00 -1.51 0.00 0.00 72.50 70.89 1rk7 s THR 116 CO 0.24 0.04 1.55 0.18 -2.21 0.00 0.00 174.62 174.43 1rk7 n LEU 117 N 3.65 5.74 -4.55 9.08 7.99 -1.26 -2.35 117.00 135.30 1rk7 n LEU 117 Ca -0.20 -4.59 -0.39 0.00 -0.01 0.00 0.00 56.01 50.82 1rk7 n LEU 117 Cb 0.55 -1.55 -0.03 0.00 -0.11 0.00 0.00 43.42 42.28 1rk7 n LEU 117 CO 0.21 1.01 1.50 -0.69 -1.51 0.00 0.00 177.39 177.91 1rk7 s VAL 118 N 0.82 3.45 0.41 4.08 1.01 0.22 -4.52 120.40 125.87 1rk7 s VAL 118 Ca 0.41 0.22 -0.21 0.00 0.00 0.00 0.00 61.98 62.40 1rk7 s VAL 118 Cb 0.01 -4.18 -0.15 0.00 0.00 0.00 0.00 36.38 32.06 1rk7 s VAL 118 CO 0.00 -1.15 0.20 1.33 0.00 0.00 0.00 175.10 175.48 1rk7 n VAL 119 N 7.03 0.94 -2.84 2.92 0.24 -1.26 -3.78 118.33 121.57 1rk7 n VAL 119 Ca 0.17 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.55 1rk7 n VAL 119 Cb 0.51 -0.13 -0.04 0.00 -1.47 0.00 0.00 33.84 32.71 1rk7 n VAL 119 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1rk7 s HIS 120 N -1.64 3.14 0.53 6.34 2.46 -1.05 -3.37 115.29 121.71 1rk7 s HIS 120 Ca 0.60 0.84 0.40 0.00 0.47 0.00 0.00 55.06 57.37 1rk7 s HIS 120 Cb -0.62 -3.48 1.36 0.00 -0.13 0.00 0.00 32.58 29.71 1rk7 s HIS 120 CO 0.61 -0.72 1.37 -1.91 -2.47 0.00 0.00 174.74 171.63 1rk7 n GLU 121 N 6.56 0.00 -3.70 2.88 0.00 -1.19 -4.33 120.64 120.86 1rk7 n GLU 121 Ca 0.06 0.99 -0.12 0.00 0.00 0.00 0.00 57.16 58.10 1rk7 n GLU 121 Cb 0.48 -2.35 -0.07 0.00 0.00 0.00 0.00 31.44 29.51 1rk7 n GLU 121 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 1rk7 s LYS 122 N -4.57 0.89 1.04 5.31 2.20 -1.26 -4.97 119.74 118.38 1rk7 s LYS 122 Ca -0.04 -0.47 -0.15 0.00 -0.36 0.00 0.00 55.97 54.95 1rk7 s LYS 122 Cb 0.21 0.39 0.16 0.00 -1.51 0.00 0.00 37.83 37.08 1rk7 s LYS 122 CO 0.70 -0.30 0.23 0.00 -0.36 0.00 0.00 175.35 175.61 1rk7 n ALA 123 N 0.44 -1.66 -2.72 3.13 0.00 -1.26 -4.36 120.51 114.08 1rk7 n ALA 123 Ca -0.18 -1.12 -0.06 0.00 0.00 0.00 0.00 53.44 52.08 1rk7 n ALA 123 Cb 0.60 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 19.08 1rk7 n ALA 123 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rk7 n ASP 124 N -1.35 1.74 -2.19 0.00 2.03 -1.26 -4.42 116.55 111.09 1rk7 n ASP 124 Ca 0.05 -2.45 -0.07 0.00 0.52 0.00 0.00 54.79 52.83 1rk7 n ASP 124 Cb 0.42 -0.50 -0.01 0.00 -0.72 0.00 0.00 41.12 40.31 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1rk7 n ASP 125 N -0.35 -2.59 -1.40 1.67 9.92 -1.26 0.20 116.55 122.74 1rk7 n ASP 125 Ca 0.10 0.29 -0.15 0.00 -0.53 0.00 0.00 54.79 54.50 1rk7 n ASP 125 Cb 0.81 -2.33 -0.06 0.00 -0.64 0.00 0.00 41.12 38.90 1rk7 n ASP 125 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1rk7 n LEU 126 N -2.42 -1.06 0.00 0.64 4.77 -1.26 -4.40 117.00 113.26 1rk7 n LEU 126 Ca -0.09 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1rk7 n LEU 126 Cb 0.50 -2.26 0.00 0.00 -2.33 0.00 0.00 43.42 39.33 1rk7 n LEU 126 CO 0.11 -0.81 0.00 0.61 -1.33 0.00 0.00 177.39 175.96 1rk7 n GLY 127 N -0.25 -0.75 0.32 -0.72 0.00 0.54 -4.49 105.19 99.84 1rk7 n GLY 127 Ca -0.15 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 0.00 0.00 1.61 5.02 -1.22 -4.76 118.16 118.81 1rk7 n LYS 128 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1rk7 n LYS 128 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 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 3.44 1.81 0.00 0.72 0.00 -1.26 -4.59 105.19 105.30 1rk7 n GLY 129 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 3.37 3.23 -0.02 0.00 -1.26 -5.08 105.19 105.42 1rk7 n GLY 130 Ca 0.00 -1.96 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.37 -0.28 -1.13 1.61 2.20 -1.26 -4.66 114.94 111.06 1rk7 s ASN 131 Ca 0.00 0.43 0.00 0.00 -0.94 0.00 0.00 52.86 52.35 1rk7 s ASN 131 Cb 0.00 0.53 0.00 0.00 -2.00 0.00 0.00 41.25 39.78 1rk7 s ASN 131 CO 0.00 -0.25 0.00 1.21 -2.94 0.00 0.00 177.10 175.12 1rk7 n GLU 132 N 2.26 -2.04 0.00 3.55 2.13 -1.26 -4.54 120.64 120.74 1rk7 n GLU 132 Ca -0.16 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.29 1rk7 n GLU 132 Cb 0.57 -5.17 0.00 0.00 0.27 0.00 0.00 31.44 27.11 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 -2.63 0.00 0.30 5.31 -0.06 -1.26 -4.90 117.38 114.15 1rk7 n GLN 133 Ca -0.15 0.00 0.17 0.00 -2.00 0.00 0.00 57.00 55.03 1rk7 n GLN 133 Cb 0.58 0.00 0.95 0.00 -4.06 0.00 0.00 30.24 27.70 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 1rk7 h SER 134 N 0.00 0.00 -0.02 1.69 0.02 -1.83 0.68 113.55 114.09 1rk7 h SER 134 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1rk7 h SER 134 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1rk7 h SER 134 CO 0.00 0.03 -0.32 0.71 -1.14 0.00 0.00 176.83 176.12 1rk7 h THR 135 N 0.00 1.28 0.00 -2.27 1.35 -1.82 -3.05 112.91 108.40 1rk7 h THR 135 Ca -0.00 -1.40 -0.15 0.00 -0.55 0.00 0.00 66.41 64.31 1rk7 h THR 135 Cb 0.16 1.45 -0.03 0.00 -1.73 0.00 0.00 68.15 68.01 1rk7 h THR 135 CO 0.00 0.44 -1.88 2.29 -0.25 0.00 0.00 175.52 176.13 1rk7 n LYS 136 N -4.08 0.65 0.00 4.72 2.85 -0.40 0.10 118.16 122.01 1rk7 n LYS 136 Ca -0.01 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1rk7 n LYS 136 Cb 0.45 -1.62 0.00 0.00 -0.65 0.00 0.00 35.03 33.21 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 -2.60 0.00 0.00 0.58 -2.24 0.23 -4.76 114.28 105.48 1rk7 n THR 137 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1rk7 n THR 137 Cb 0.81 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 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 0.91 0.00 2.79 3.38 0.00 -1.21 -4.72 105.19 106.34 1rk7 n GLY 138 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.08 0.01 1.61 5.15 -1.26 -4.41 115.26 115.28 1rk7 n ASN 139 Ca 0.00 -0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.96 1rk7 n ASN 139 Cb 0.00 -1.02 -0.00 0.00 -0.53 0.00 0.00 39.78 38.22 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 -2.59 2.43 0.00 5.20 0.00 -1.26 -5.00 120.51 119.29 1rk7 n ALA 140 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1rk7 n ALA 140 Cb 0.42 0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 3.02 0.63 3.55 0.00 0.00 -1.26 -4.56 105.19 106.57 1rk7 n GLY 141 Ca -0.02 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 1rk7 n GLY 141 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rk7 n SER 142 N 0.00 2.25 -3.10 1.61 3.41 -1.26 -3.19 113.62 113.34 1rk7 n SER 142 Ca 0.00 -0.36 0.02 0.00 -0.26 0.00 0.00 58.87 58.28 1rk7 n SER 142 Cb 0.00 -1.52 -0.00 0.00 -0.26 0.00 0.00 64.21 62.43 1rk7 n SER 142 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1rk7 s ARG 143 N 8.09 0.54 0.00 4.33 0.52 -1.22 -4.78 118.95 126.43 1rk7 s ARG 143 Ca 1.02 0.03 0.00 0.00 -0.52 0.00 0.00 55.73 56.26 1rk7 s ARG 143 Cb -0.30 0.12 0.00 0.00 0.52 0.00 0.00 34.95 35.29 1rk7 s ARG 143 CO 0.30 -0.84 0.00 1.28 0.02 0.00 0.00 175.30 176.05 1rk7 n LEU 144 N 4.60 0.00 -4.84 2.53 4.32 -1.26 -4.75 117.00 117.60 1rk7 n LEU 144 Ca 0.08 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.78 1rk7 n LEU 144 Cb 0.58 0.00 0.18 0.00 -1.62 0.00 0.00 43.42 42.55 1rk7 n LEU 144 CO -0.06 0.00 0.79 0.00 -1.22 0.00 0.00 177.39 176.90 1rk7 s ALA 145 N -1.35 1.89 -0.45 -1.18 0.00 -1.26 -3.37 121.76 116.03 1rk7 s ALA 145 Ca 0.00 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.06 1rk7 s ALA 145 Cb 0.00 -2.86 0.26 0.00 0.00 0.00 0.00 23.12 20.51 1rk7 s ALA 145 CO 0.00 -2.54 0.80 0.00 0.00 0.00 0.00 175.76 174.02 1rk7 n GLY 147 N 1.38 2.68 3.55 0.00 0.00 -1.26 -4.75 105.19 106.79 1rk7 n GLY 147 Ca 0.13 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 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 4.56 0.09 -1.68 1.61 0.31 -1.25 -4.20 118.33 117.77 1rk7 n VAL 148 Ca 0.34 -0.57 -0.46 0.00 -0.01 0.00 0.00 64.34 63.64 1rk7 n VAL 148 Cb 0.12 -2.42 -0.04 0.00 -0.91 0.00 0.00 33.84 30.59 1rk7 n VAL 148 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1rk7 n ILE 149 N 7.79 0.48 -3.82 2.52 -0.00 0.12 -4.54 119.36 121.92 1rk7 n ILE 149 Ca 0.37 -0.09 -0.13 0.00 -0.00 0.00 0.00 62.75 62.91 1rk7 n ILE 149 Cb 0.44 -1.90 -0.13 0.00 -0.00 0.00 0.00 39.64 38.04 1rk7 n ILE 149 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1rk7 s GLY 150 N 3.41 -0.06 0.51 7.39 0.00 -0.17 -3.23 107.32 115.16 1rk7 s GLY 150 Ca 0.88 0.36 -0.21 0.00 0.00 0.00 0.00 44.72 45.75 1rk7 s GLY 150 CO 0.46 0.41 0.89 1.39 0.00 0.00 0.00 173.10 176.25 1rk7 n ILE 151 N 3.32 2.79 -4.03 0.90 2.08 -1.26 0.00 119.36 123.16 1rk7 n ILE 151 Ca -0.16 -0.50 -0.12 0.00 0.56 0.00 0.00 62.75 62.53 1rk7 n ILE 151 Cb 0.57 -1.04 -0.04 0.00 -0.75 0.00 0.00 39.64 38.38 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 -1.44 0.26 -2.00 -1.39 0.00 -0.23 -4.73 121.76 112.23 1rk7 s ALA 152 Ca 0.68 -1.21 0.09 0.00 0.00 0.00 0.00 51.96 51.52 1rk7 s ALA 152 Cb -0.49 1.09 0.53 0.00 0.00 0.00 0.00 23.12 24.24 1rk7 s ALA 152 CO 0.53 -0.82 0.98 0.94 0.00 0.00 0.00 175.76 177.39