#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 1.90 -0.16 0.00 2.01 -1.26 -5.01 115.64 113.12 1rk7 s THR 2 Ca 0.00 -1.87 -0.04 0.00 0.31 0.00 0.00 61.69 60.09 1rk7 s THR 2 Cb 0.00 -1.85 0.06 0.00 0.01 0.00 0.00 72.50 70.72 1rk7 s THR 2 CO 0.00 -0.23 0.08 -0.75 -0.69 0.00 0.00 174.62 173.03 1rk7 s LYS 3 N -2.61 0.16 0.53 4.92 2.36 -1.26 -2.66 119.74 121.19 1rk7 s LYS 3 Ca 0.15 -0.11 -0.07 0.00 -2.55 0.00 0.00 55.97 53.39 1rk7 s LYS 3 Cb -0.07 -1.78 -0.04 0.00 -1.05 0.00 0.00 37.83 34.89 1rk7 s LYS 3 CO 0.07 -0.64 0.88 0.00 1.55 0.00 0.00 175.35 177.21 1rk7 s ALA 4 N 2.09 3.29 0.04 3.13 0.00 0.46 -1.21 121.76 129.55 1rk7 s ALA 4 Ca 0.02 -0.34 -0.05 0.00 0.00 0.00 0.00 51.96 51.58 1rk7 s ALA 4 Cb -0.16 -2.77 -0.01 0.00 0.00 0.00 0.00 23.12 20.17 1rk7 s ALA 4 CO -0.08 -0.47 0.09 0.08 0.00 0.00 0.00 175.76 175.37 1rk7 s VAL 5 N -2.90 0.14 -0.36 0.00 1.01 0.40 0.15 120.40 118.84 1rk7 s VAL 5 Ca 0.50 -1.15 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1rk7 s VAL 5 Cb -0.11 -0.95 0.15 0.00 0.00 0.00 0.00 36.38 35.48 1rk7 s VAL 5 CO 0.48 -0.64 0.34 0.00 0.00 0.00 0.00 175.10 175.29 1rk7 s ALA 6 N -2.74 -0.24 -0.90 5.51 0.00 0.31 -0.24 121.76 123.46 1rk7 s ALA 6 Ca -0.04 -1.01 -0.22 0.00 0.00 0.00 0.00 51.96 50.69 1rk7 s ALA 6 Cb -0.00 -1.95 0.07 0.00 0.00 0.00 0.00 23.12 21.24 1rk7 s ALA 6 CO -0.05 -2.07 1.27 0.54 0.00 0.00 0.00 175.76 175.45 1rk7 s VAL 7 N 1.52 4.17 0.08 0.00 0.11 -1.22 -1.89 120.40 123.17 1rk7 s VAL 7 Ca 0.16 -0.75 -0.36 0.00 -2.93 0.00 0.00 61.98 58.09 1rk7 s VAL 7 Cb -0.16 -4.91 -0.18 0.00 -1.53 0.00 0.00 36.38 29.60 1rk7 s VAL 7 CO -0.07 -1.74 1.11 0.18 -3.33 0.00 0.00 175.10 171.24 1rk7 n LEU 8 N 8.16 0.65 -3.15 2.54 7.99 -0.52 -4.38 117.00 128.29 1rk7 n LEU 8 Ca 0.21 1.14 0.05 0.00 -0.01 0.00 0.00 56.01 57.40 1rk7 n LEU 8 Cb 0.49 -1.06 -0.00 0.00 -0.11 0.00 0.00 43.42 42.74 1rk7 n LEU 8 CO 0.62 -1.65 0.35 -0.75 -1.51 0.00 0.00 177.39 174.45 1rk7 s LYS 9 N -0.04 0.34 0.00 3.23 2.20 -1.26 -4.40 119.74 119.81 1rk7 s LYS 9 Ca 0.83 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.84 1rk7 s LYS 9 Cb -1.06 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 35.46 1rk7 s LYS 9 CO 0.53 -0.56 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 1rk7 n GLY 10 N 5.31 -0.97 0.18 5.54 0.00 -1.26 -3.77 105.19 110.22 1rk7 n GLY 10 Ca 0.04 0.55 -0.05 0.00 0.00 0.00 0.00 46.02 46.57 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 -0.45 0.00 1.61 2.03 -0.41 -4.90 116.55 114.44 1rk7 n ASP 11 Ca 0.00 1.26 0.00 0.00 0.52 0.00 0.00 54.79 56.57 1rk7 n ASP 11 Cb 0.00 -0.35 0.00 0.00 -0.72 0.00 0.00 41.12 40.05 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 -1.11 0.95 0.15 0.27 0.00 -1.26 -4.94 105.19 99.26 1rk7 n GLY 12 Ca 0.01 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 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 0.34 -5.89 1.61 0.13 -1.90 -3.40 132.00 122.88 1rk7 h PRO 13 Ca 0.00 -0.33 -0.42 0.00 -0.87 0.00 0.00 66.00 64.39 1rk7 h PRO 13 Cb 0.00 0.09 -0.05 0.00 0.13 0.00 0.00 31.00 31.17 1rk7 h PRO 13 CO 0.00 1.00 1.07 0.08 -0.23 0.00 0.00 178.00 179.92 1rk7 s VAL 14 N -3.37 3.46 -0.39 1.56 1.01 -1.20 -3.88 120.40 117.58 1rk7 s VAL 14 Ca -0.05 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1rk7 s VAL 14 Cb 0.10 -4.12 0.43 0.00 0.00 0.00 0.00 36.38 32.79 1rk7 s VAL 14 CO 0.84 -1.07 1.13 1.67 0.00 0.00 0.00 175.10 177.68 1rk7 n GLN 15 N 9.03 3.39 -0.53 2.72 7.27 0.34 -4.09 117.38 135.51 1rk7 n GLN 15 Ca 0.29 -4.37 -0.29 0.00 0.07 0.00 0.00 57.00 52.70 1rk7 n GLN 15 Cb 0.49 -2.22 0.23 0.00 2.41 0.00 0.00 30.24 31.16 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 -0.53 -1.64 2.55 1.69 0.00 -1.26 -4.49 105.19 101.50 1rk7 n GLY 16 Ca 0.39 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.45 0.02 -0.12 -0.61 1.01 0.33 -1.44 121.20 117.94 1rk7 s ILE 17 Ca 0.68 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 60.43 1rk7 s ILE 17 Cb -0.24 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 1rk7 s ILE 17 CO 0.64 -0.74 -0.03 -0.51 0.00 0.00 0.00 174.94 174.30 1rk7 s ILE 18 N 2.00 4.04 0.03 2.92 1.10 -0.79 -0.95 121.20 129.55 1rk7 s ILE 18 Ca 0.10 -0.33 0.04 0.00 -0.51 0.00 0.00 60.65 59.95 1rk7 s ILE 18 Cb -0.17 -2.73 -0.02 0.00 0.15 0.00 0.00 42.46 39.70 1rk7 s ILE 18 CO -0.34 0.55 -0.13 0.54 -2.11 0.00 0.00 174.94 173.46 1rk7 s ASN 19 N -0.28 1.47 -0.08 4.50 2.20 0.19 0.12 114.94 123.07 1rk7 s ASN 19 Ca 0.05 -0.42 0.03 0.00 -0.94 0.00 0.00 52.86 51.58 1rk7 s ASN 19 Cb -0.12 -0.09 -0.02 0.00 -2.00 0.00 0.00 41.25 39.02 1rk7 s ASN 19 CO 0.02 0.02 -0.17 -0.36 -2.94 0.00 0.00 177.10 173.67 1rk7 s PHE 20 N -0.81 2.67 -0.07 1.54 0.40 0.39 -2.06 117.98 120.04 1rk7 s PHE 20 Ca 0.01 -0.45 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1rk7 s PHE 20 Cb -0.07 -1.69 0.02 0.00 0.51 0.00 0.00 43.02 41.79 1rk7 s PHE 20 CO 0.01 -0.04 -0.09 -2.00 0.70 0.00 0.00 175.22 173.80 1rk7 s GLU 21 N -0.26 1.42 -0.40 0.44 2.56 -0.59 -0.41 118.70 121.46 1rk7 s GLU 21 Ca 0.01 -0.30 0.09 0.00 0.00 0.00 0.00 54.97 54.77 1rk7 s GLU 21 Cb -0.13 -1.27 0.30 0.00 2.00 0.00 0.00 34.13 35.02 1rk7 s GLU 21 CO 0.03 -0.05 0.73 0.94 -0.56 0.00 0.00 175.26 176.35 1rk7 n GLN 22 N 4.08 0.87 -1.01 4.30 7.27 -1.09 0.78 117.38 132.57 1rk7 n GLN 22 Ca -0.21 -2.92 -0.32 0.00 0.07 0.00 0.00 57.00 53.62 1rk7 n GLN 22 Cb 0.51 -1.41 -0.03 0.00 2.41 0.00 0.00 30.24 31.72 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 0.84 2.15 0.00 3.69 5.02 -1.26 -2.98 118.16 125.63 1rk7 n LYS 23 Ca 0.19 -1.76 0.00 0.00 -2.02 0.00 0.00 58.31 54.72 1rk7 n LYS 23 Cb 0.62 -2.71 0.00 0.00 -0.02 0.00 0.00 35.03 32.92 1rk7 n LYS 23 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1rk7 n GLU 24 N 5.16 0.00 0.00 1.97 -0.58 -1.26 -4.75 120.64 121.17 1rk7 n GLU 24 Ca 0.50 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.24 1rk7 n GLU 24 Cb 0.25 -0.01 0.00 0.00 -0.57 0.00 0.00 31.44 31.11 1rk7 n GLU 24 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1rk7 n SER 25 N -2.44 0.00 -0.78 1.62 2.88 -1.16 -4.55 113.62 109.19 1rk7 n SER 25 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1rk7 n SER 25 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 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 0.00 -0.29 0.00 -3.46 6.94 -1.26 -4.99 115.26 112.20 1rk7 n ASN 26 Ca 0.00 -1.57 0.00 0.00 -0.02 0.00 0.00 54.58 52.99 1rk7 n ASN 26 Cb 0.00 0.07 0.00 0.00 -2.36 0.00 0.00 39.78 37.49 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rk7 n GLY 27 N 0.04 7.20 3.77 4.83 0.00 -1.26 -5.09 105.19 114.68 1rk7 n GLY 27 Ca -0.10 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 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 1.05 4.45 -0.49 1.61 0.04 -1.26 -4.48 135.00 135.93 1rk7 s PRO 28 Ca 0.00 1.66 -0.14 0.00 0.04 0.00 0.00 61.00 62.56 1rk7 s PRO 28 Cb 0.00 -2.92 0.10 0.00 0.04 0.00 0.00 34.50 31.71 1rk7 s PRO 28 CO 0.00 0.08 0.41 0.08 0.04 0.00 0.00 177.00 177.61 1rk7 s VAL 29 N -1.37 5.00 -0.65 -0.36 1.01 0.27 -4.68 120.40 119.63 1rk7 s VAL 29 Ca 0.50 -1.31 -0.27 0.00 0.00 0.00 0.00 61.98 60.90 1rk7 s VAL 29 Cb -0.27 -4.10 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1rk7 s VAL 29 CO 0.35 -0.68 1.66 -0.54 0.00 0.00 0.00 175.10 175.89 1rk7 s LYS 30 N 1.57 2.82 -0.05 2.72 1.02 0.23 -3.92 119.74 124.14 1rk7 s LYS 30 Ca 0.04 0.33 -0.04 0.00 0.02 0.00 0.00 55.97 56.32 1rk7 s LYS 30 Cb -0.26 -4.32 -0.04 0.00 -0.52 0.00 0.00 37.83 32.69 1rk7 s LYS 30 CO 0.04 -2.53 0.14 0.08 -0.92 0.00 0.00 175.35 172.16 1rk7 s VAL 31 N 7.94 5.26 -0.19 3.17 1.01 0.17 -1.55 120.40 136.21 1rk7 s VAL 31 Ca 0.56 -0.08 -0.28 0.00 0.00 0.00 0.00 61.98 62.19 1rk7 s VAL 31 Cb -0.11 -3.37 0.10 0.00 0.00 0.00 0.00 36.38 32.99 1rk7 s VAL 31 CO 0.19 0.45 0.85 -1.66 0.00 0.00 0.00 175.10 174.94 1rk7 s TRP 32 N -1.17 -0.57 0.17 5.22 -2.14 -0.87 -0.94 118.94 118.64 1rk7 s TRP 32 Ca 0.21 1.20 -0.06 0.00 2.66 0.00 0.00 56.10 60.12 1rk7 s TRP 32 Cb -0.12 0.38 0.02 0.00 -3.10 0.00 0.00 33.47 30.65 1rk7 s TRP 32 CO 0.12 -0.40 0.32 0.41 -2.66 0.00 0.00 176.95 174.74 1rk7 n GLY 33 N 1.60 1.70 3.51 3.67 0.00 -1.11 -0.64 105.19 113.93 1rk7 n GLY 33 Ca -0.14 -1.16 -0.04 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.89 -0.82 0.65 1.61 1.04 -0.13 -1.65 113.70 112.52 1rk7 s SER 34 Ca 0.07 1.36 -0.08 0.00 0.48 0.00 0.00 55.95 57.79 1rk7 s SER 34 Cb -0.02 1.93 0.02 0.00 0.10 0.00 0.00 66.02 68.05 1rk7 s SER 34 CO 0.06 -0.22 0.99 -0.63 0.98 0.00 0.00 173.24 174.41 1rk7 s ILE 35 N 2.74 3.29 -0.28 -1.02 1.01 0.30 0.12 121.20 127.37 1rk7 s ILE 35 Ca -0.05 0.10 -0.03 0.00 0.00 0.00 0.00 60.65 60.68 1rk7 s ILE 35 Cb -0.12 -3.36 0.16 0.00 0.01 0.00 0.00 42.46 39.15 1rk7 s ILE 35 CO -0.17 -0.41 0.53 -0.54 0.00 0.00 0.00 174.94 174.35 1rk7 s LYS 36 N -5.17 0.49 0.00 2.79 1.02 -1.26 -3.39 119.74 114.21 1rk7 s LYS 36 Ca 0.57 0.92 0.00 0.00 0.02 0.00 0.00 55.97 57.48 1rk7 s LYS 36 Cb -0.11 0.29 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 1rk7 s LYS 36 CO 0.47 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.75 1rk7 n GLY 37 N 5.41 3.77 0.61 -3.33 0.00 -1.25 -0.51 105.19 109.89 1rk7 n GLY 37 Ca -0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 46.02 45.36 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 -4.09 0.99 4.32 -1.26 -4.87 117.00 112.08 1rk7 n LEU 38 Ca 0.00 -0.12 -0.22 0.00 -0.02 0.00 0.00 56.01 55.66 1rk7 n LEU 38 Cb 0.00 -0.17 -0.15 0.00 -1.62 0.00 0.00 43.42 41.48 1rk7 n LEU 38 CO 0.00 -1.57 -0.47 0.42 -1.22 0.00 0.00 177.39 174.55 1rk7 s THR 39 N -0.93 1.06 0.01 -5.08 -4.23 -1.26 -3.43 115.64 101.79 1rk7 s THR 39 Ca 0.09 -0.57 -0.32 0.00 -1.18 0.00 0.00 61.69 59.71 1rk7 s THR 39 Cb -0.02 -0.89 -0.16 0.00 1.34 0.00 0.00 72.50 72.77 1rk7 s THR 39 CO 0.07 0.30 0.84 -1.84 -0.54 0.00 0.00 174.62 173.46 1rk7 n GLU 40 N 2.81 0.00 0.00 3.99 0.28 -1.26 -4.35 120.64 122.10 1rk7 n GLU 40 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.85 1rk7 n GLU 40 Cb 0.55 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.22 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 1.26 0.97 3.77 -1.84 0.00 -1.26 -4.88 105.19 103.21 1rk7 n GLY 41 Ca 0.16 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 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 4.39 -0.06 0.99 2.01 -1.26 -0.11 118.68 124.64 1rk7 s LEU 42 Ca 0.00 2.02 -0.02 0.00 0.01 0.00 0.00 54.13 56.13 1rk7 s LEU 42 Cb 0.00 -3.90 0.04 0.00 0.01 0.00 0.00 46.19 42.34 1rk7 s LEU 42 CO 0.00 -0.16 0.10 -1.00 1.01 0.00 0.00 176.35 176.30 1rk7 s HIS 43 N -1.44 -0.06 1.25 0.29 3.76 -1.15 -4.47 115.29 113.47 1rk7 s HIS 43 Ca 0.49 0.40 -0.16 0.00 -0.15 0.00 0.00 55.06 55.64 1rk7 s HIS 43 Cb -0.24 -0.30 0.31 0.00 1.11 0.00 0.00 32.58 33.45 1rk7 s HIS 43 CO 0.30 -0.20 0.89 0.41 -0.85 0.00 0.00 174.74 175.29 1rk7 n GLY 44 N 4.96 -2.56 2.22 -2.22 0.00 -1.26 0.17 105.19 106.49 1rk7 n GLY 44 Ca -0.11 -1.28 -0.24 0.00 0.00 0.00 0.00 46.02 44.39 1rk7 n GLY 44 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1rk7 n PHE 45 N -5.17 0.07 -0.55 1.61 7.35 -0.45 -4.58 117.46 115.73 1rk7 n PHE 45 Ca 0.04 -3.64 -0.27 0.00 -0.76 0.00 0.00 57.45 52.82 1rk7 n PHE 45 Cb 0.56 -0.38 0.19 0.00 0.35 0.00 0.00 39.48 40.20 1rk7 n PHE 45 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 1rk7 n HIS 46 N 1.24 -2.06 -2.75 -5.13 8.25 -1.26 -2.05 115.22 111.46 1rk7 n HIS 46 Ca 0.22 -0.06 -0.06 0.00 -0.26 0.00 0.00 57.72 57.56 1rk7 n HIS 46 Cb 0.53 -1.47 0.04 0.00 1.12 0.00 0.00 29.99 30.20 1rk7 n HIS 46 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1rk7 n VAL 47 N -4.66 0.00 -0.89 1.59 0.31 0.55 -4.35 118.33 110.87 1rk7 n VAL 47 Ca 0.04 -1.21 -0.35 0.00 -0.01 0.00 0.00 64.34 62.81 1rk7 n VAL 47 Cb 0.52 1.25 0.08 0.00 -0.91 0.00 0.00 33.84 34.78 1rk7 n VAL 47 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rk7 n HIS 48 N 2.15 -2.78 -1.68 3.52 1.44 -1.03 -4.34 115.22 112.50 1rk7 n HIS 48 Ca 0.12 0.22 0.00 0.00 -2.01 0.00 0.00 57.72 56.05 1rk7 n HIS 48 Cb 0.61 -1.53 0.00 0.00 0.12 0.00 0.00 29.99 29.19 1rk7 n HIS 48 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1rk7 n GLU 49 N 0.69 1.76 -3.30 -1.40 1.02 -1.26 -4.33 120.64 113.82 1rk7 n GLU 49 Ca 0.01 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.96 1rk7 n GLU 49 Cb 0.61 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 32.02 1rk7 n GLU 49 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1rk7 s GLU 50 N 0.52 2.68 0.03 3.49 8.01 -1.26 -4.74 118.70 127.42 1rk7 s GLU 50 Ca 0.00 -1.39 0.00 0.00 0.01 0.00 0.00 54.97 53.59 1rk7 s GLU 50 Cb 0.00 -2.56 0.00 0.00 -4.31 0.00 0.00 34.13 27.26 1rk7 s GLU 50 CO 0.00 -0.23 0.00 -1.91 0.01 0.00 0.00 175.26 173.13 1rk7 n GLU 51 N -1.69 0.00 -3.26 1.61 0.00 -1.26 -4.99 120.64 111.04 1rk7 n GLU 51 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.11 1rk7 n GLU 51 Cb 0.60 0.00 0.01 0.00 0.00 0.00 0.00 31.44 32.05 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1rk7 n ASP 52 N -2.46 -6.25 0.00 4.31 8.00 -1.26 -4.92 116.55 113.97 1rk7 n ASP 52 Ca 0.00 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.75 1rk7 n ASP 52 Cb 0.00 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 39.53 1rk7 n ASP 52 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1rk7 n ASN 53 N 0.92 0.00 0.00 -2.24 4.13 -1.26 -5.04 115.26 111.77 1rk7 n ASN 53 Ca -0.02 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.24 1rk7 n ASN 53 Cb 0.55 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.79 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 1rk7 n THR 54 N 0.00 0.00 0.00 3.41 5.66 -1.26 -5.10 114.28 116.99 1rk7 n THR 54 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1rk7 n THR 54 Cb 0.00 -0.11 0.00 0.00 -1.55 0.00 0.00 70.33 68.67 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 -2.35 0.00 0.09 1.79 0.00 -1.26 -5.04 120.51 113.74 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 -1.83 3.06 0.00 0.00 -1.26 -5.08 105.19 100.09 1rk7 n GLY 56 Ca 0.00 0.46 -0.05 0.00 0.00 0.00 0.00 46.02 46.43 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 4.35 0.00 -3.54 0.00 -2.24 -1.26 -4.98 114.28 106.60 1rk7 n THR 58 Ca 0.11 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.53 1rk7 n THR 58 Cb 0.53 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.70 1rk7 n THR 58 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1rk7 n SER 59 N 0.00 4.43 -0.14 3.42 7.64 -1.26 -4.78 113.62 122.93 1rk7 n SER 59 Ca 0.00 -3.20 -0.29 0.00 1.01 0.00 0.00 58.87 56.39 1rk7 n SER 59 Cb 0.00 -1.04 -0.10 0.00 -1.01 0.00 0.00 64.21 62.06 1rk7 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rk7 n ALA 60 N 2.03 1.18 0.00 -0.43 0.00 -1.26 -5.03 120.51 117.00 1rk7 n ALA 60 Ca 0.23 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.58 1rk7 n ALA 60 Cb 0.37 0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 1.26 -1.35 3.55 0.00 0.00 -1.26 -5.10 105.19 102.29 1rk7 n GLY 61 Ca -0.53 0.73 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1rk7 n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rk7 s PRO 62 N 0.00 2.92 0.00 1.61 0.04 -1.26 -4.85 135.00 133.46 1rk7 s PRO 62 Ca 0.00 0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.15 1rk7 s PRO 62 Cb 0.00 -4.36 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1rk7 s PRO 62 CO 0.00 -2.47 0.00 0.72 0.04 0.00 0.00 177.00 175.29 1rk7 n HIS 63 N 11.08 0.00 0.00 0.56 8.25 -1.26 -4.98 115.22 128.87 1rk7 n HIS 63 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1rk7 n HIS 63 Cb 0.50 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.47 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 -1.25 0.00 -2.84 4.41 3.72 -1.26 -4.55 117.46 115.69 1rk7 n PHE 64 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 1rk7 n PHE 64 Cb 0.00 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.58 1rk7 n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1rk7 n ASN 65 N -3.36 -2.00 -2.00 4.37 2.85 -1.26 -5.00 115.26 108.85 1rk7 n ASN 65 Ca 0.00 -3.34 -0.07 0.00 -0.11 0.00 0.00 54.58 51.06 1rk7 n ASN 65 Cb 0.00 1.34 -0.10 0.00 1.24 0.00 0.00 39.78 42.27 1rk7 n ASN 65 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1rk7 n PRO 66 N 1.07 1.31 -0.22 1.20 -0.04 -1.26 -2.62 135.00 134.45 1rk7 n PRO 66 Ca 0.11 -0.56 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 1rk7 n PRO 66 Cb 0.64 -1.69 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1rk7 n PRO 66 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1rk7 n LEU 67 N 2.38 0.00 -2.39 1.53 -0.00 -1.26 -4.78 117.00 112.47 1rk7 n LEU 67 Ca 0.24 -0.50 -0.03 0.00 -0.00 0.00 0.00 56.01 55.72 1rk7 n LEU 67 Cb 0.61 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 44.03 1rk7 n LEU 67 CO 0.11 0.24 -0.01 -1.54 -0.00 0.00 0.00 177.39 176.20 1rk7 n SER 68 N 0.00 -0.93 0.00 1.45 3.41 -1.08 -1.35 113.62 115.12 1rk7 n SER 68 Ca 0.00 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1rk7 n SER 68 Cb 0.57 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 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 -2.28 0.00 -3.57 4.33 1.74 -1.26 -2.58 116.66 113.04 1rk7 n ARG 69 Ca 0.01 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.03 1rk7 n ARG 69 Cb 0.43 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.85 1rk7 n ARG 69 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1rk7 s LYS 70 N 0.00 0.63 -0.31 5.56 2.20 -0.46 -4.91 119.74 122.46 1rk7 s LYS 70 Ca 0.00 -0.26 -0.21 0.00 -0.36 0.00 0.00 55.97 55.14 1rk7 s LYS 70 Cb 0.00 0.28 -0.01 0.00 -1.51 0.00 0.00 37.83 36.59 1rk7 s LYS 70 CO 0.00 -0.28 0.66 -1.58 -0.36 0.00 0.00 175.35 173.79 1rk7 s HIS 71 N -2.83 3.21 0.00 4.03 5.65 -1.02 -4.43 115.29 119.90 1rk7 s HIS 71 Ca 0.08 0.61 0.00 0.00 0.25 0.00 0.00 55.06 56.00 1rk7 s HIS 71 Cb -0.01 -3.05 0.00 0.00 -1.18 0.00 0.00 32.58 28.34 1rk7 s HIS 71 CO -0.06 -0.51 0.00 0.41 -0.65 0.00 0.00 174.74 173.93 1rk7 n GLY 72 N 4.40 -0.30 3.81 1.59 0.00 -1.26 -4.95 105.19 108.48 1rk7 n GLY 72 Ca -0.00 0.48 -0.38 0.00 0.00 0.00 0.00 46.02 46.12 1rk7 n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk7 s GLY 73 N -0.00 2.39 -1.15 -0.02 0.00 -1.26 -4.95 107.32 102.33 1rk7 s GLY 73 Ca 0.00 -0.30 -0.19 0.00 0.00 0.00 0.00 44.72 44.23 1rk7 s GLY 73 CO 0.00 0.20 1.98 -1.55 0.00 0.00 0.00 173.10 173.74 1rk7 n PRO 74 N 2.32 2.24 -0.87 2.90 -0.04 -1.26 -3.18 135.00 137.11 1rk7 n PRO 74 Ca -0.14 -2.45 0.00 0.00 -0.04 0.00 0.00 63.50 60.87 1rk7 n PRO 74 Cb 0.52 -3.28 0.00 0.00 -0.04 0.00 0.00 33.50 30.70 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 7.22 0.00 0.01 0.54 2.85 -1.07 -4.97 118.16 122.74 1rk7 n LYS 75 Ca 0.49 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.85 1rk7 n LYS 75 Cb 0.42 -1.95 0.00 0.00 -0.65 0.00 0.00 35.03 32.85 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 1.06 0.15 -1.26 -5.58 2.03 -1.19 -4.83 116.55 106.93 1rk7 n ASP 76 Ca 0.00 0.03 0.10 0.00 0.52 0.00 0.00 54.79 55.44 1rk7 n ASP 76 Cb 0.17 -0.04 0.30 0.00 -0.72 0.00 0.00 41.12 40.83 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1rk7 n GLU 77 N -2.66 3.07 -1.20 -0.67 2.13 -1.25 -4.96 120.64 115.09 1rk7 n GLU 77 Ca 0.00 -2.62 0.00 0.00 0.66 0.00 0.00 57.16 55.20 1rk7 n GLU 77 Cb 0.00 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 30.09 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 1.19 0.00 -1.09 5.31 1.02 -1.20 -4.57 120.64 121.29 1rk7 n GLU 78 Ca 0.22 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.50 1rk7 n GLU 78 Cb 0.67 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 32.04 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rk7 n ARG 79 N 0.00 -2.37 -0.63 3.49 3.00 -1.06 -2.61 116.66 116.48 1rk7 n ARG 79 Ca 0.00 1.78 0.00 0.00 -0.01 0.00 0.00 57.85 59.62 1rk7 n ARG 79 Cb 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 32.46 29.64 1rk7 n ARG 79 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 1rk7 n HIS 80 N -3.87 0.00 -3.15 -1.55 -0.00 -1.21 -4.75 115.22 100.69 1rk7 n HIS 80 Ca -0.03 0.00 -0.21 0.00 0.46 0.00 0.00 57.72 57.93 1rk7 n HIS 80 Cb 0.51 -0.07 -0.05 0.00 -0.12 0.00 0.00 29.99 30.26 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 -2.63 -0.53 0.00 3.57 0.31 -1.26 -4.92 118.33 112.86 1rk7 n VAL 81 Ca 0.00 -3.91 0.00 0.00 -0.01 0.00 0.00 64.34 60.42 1rk7 n VAL 81 Cb 0.00 -1.32 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 1rk7 n VAL 81 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1rk7 n GLY 82 N 1.18 3.22 3.92 2.92 0.00 -1.25 -3.83 105.19 111.35 1rk7 n GLY 82 Ca 0.21 -0.91 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 1rk7 n GLY 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rk7 s ASP 83 N 0.00 6.33 -0.35 1.61 2.15 -1.26 0.20 116.67 125.35 1rk7 s ASP 83 Ca 0.00 0.71 0.14 0.00 0.43 0.00 0.00 52.55 53.83 1rk7 s ASP 83 Cb 0.00 -2.15 0.43 0.00 -0.30 0.00 0.00 42.92 40.90 1rk7 s ASP 83 CO 0.00 -0.38 1.09 -0.11 -0.17 0.00 0.00 175.17 175.59 1rk7 n LEU 84 N -1.77 0.12 0.00 -1.34 0.00 -0.87 -3.30 117.00 109.84 1rk7 n LEU 84 Ca -0.02 -3.68 0.00 0.00 0.00 0.00 0.00 56.01 52.31 1rk7 n LEU 84 Cb 0.55 0.31 0.00 0.00 0.00 0.00 0.00 43.42 44.29 1rk7 n LEU 84 CO 0.50 1.73 0.00 0.61 0.00 0.00 0.00 177.39 180.23 1rk7 n GLY 85 N -0.22 0.11 3.56 -3.96 0.00 -1.26 -4.50 105.19 98.92 1rk7 n GLY 85 Ca 0.05 -0.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.83 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 3.08 0.00 1.61 -0.87 -1.26 -1.34 114.94 112.15 1rk7 s ASN 86 Ca 0.00 -1.57 0.00 0.00 -1.57 0.00 0.00 52.86 49.72 1rk7 s ASN 86 Cb 0.00 0.28 0.00 0.00 -0.02 0.00 0.00 41.25 41.51 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 -0.94 0.00 -3.68 1.60 0.24 0.45 -4.88 118.33 111.11 1rk7 n VAL 87 Ca -0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.10 1rk7 n VAL 87 Cb 0.66 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.94 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 1.73 -0.01 0.81 3.34 2.01 -1.26 -2.91 115.64 119.36 1rk7 s THR 88 Ca 0.00 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.94 1rk7 s THR 88 Cb 0.00 -0.76 0.14 0.00 0.01 0.00 0.00 72.50 71.89 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 0.77 2.95 0.00 7.40 0.00 0.84 -4.48 121.76 129.25 1rk7 s ALA 89 Ca -0.04 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.64 1rk7 s ALA 89 Cb -0.05 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.58 1rk7 s ALA 89 CO -0.06 -1.81 0.00 -3.47 0.00 0.00 0.00 175.76 170.42 1rk7 n ASP 90 N -3.24 0.00 -0.10 0.00 2.03 0.48 -4.46 116.55 111.27 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 0.20 -0.84 -0.67 2.85 -1.26 -4.75 118.16 113.69 1rk7 n LYS 91 Ca 0.00 -0.69 -0.04 0.00 -1.05 0.00 0.00 58.31 56.54 1rk7 n LYS 91 Cb 0.00 -0.55 -0.04 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 -0.05 -0.47 0.00 -5.58 9.92 -1.26 -4.71 116.55 114.39 1rk7 n ASP 92 Ca 0.00 -1.65 0.00 0.00 -0.53 0.00 0.00 54.79 52.61 1rk7 n ASP 92 Cb 0.52 0.13 0.00 0.00 -0.64 0.00 0.00 41.12 41.14 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 0.03 2.55 3.30 0.44 0.00 -1.22 -4.39 105.19 105.91 1rk7 n GLY 93 Ca -0.15 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 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 -3.72 1.61 0.31 -1.26 -4.17 118.33 111.11 1rk7 n VAL 94 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.96 1rk7 n VAL 94 Cb 0.00 -0.47 -0.12 0.00 -0.91 0.00 0.00 33.84 32.33 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 8.32 3.20 0.13 3.52 0.00 -1.22 -0.39 121.76 135.33 1rk7 s ALA 95 Ca 1.28 -1.25 0.05 0.00 0.00 0.00 0.00 51.96 52.04 1rk7 s ALA 95 Cb -1.21 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1rk7 s ALA 95 CO 0.48 -0.67 0.08 0.16 0.00 0.00 0.00 175.76 175.80 1rk7 s ASP 96 N 1.60 5.34 0.18 0.00 -4.77 -1.26 0.11 116.67 117.88 1rk7 s ASP 96 Ca 0.05 -0.15 0.07 0.00 -3.30 0.00 0.00 52.55 49.23 1rk7 s ASP 96 Cb -0.16 -1.35 -0.05 0.00 -1.09 0.00 0.00 42.92 40.27 1rk7 s ASP 96 CO 0.05 0.11 -0.14 -0.69 0.70 0.00 0.00 175.17 175.20 1rk7 s VAL 97 N -1.59 1.60 -0.37 2.11 1.01 -0.66 -4.91 120.40 117.59 1rk7 s VAL 97 Ca 0.29 -2.13 0.02 0.00 0.00 0.00 0.00 61.98 60.16 1rk7 s VAL 97 Cb -0.11 -1.95 0.18 0.00 0.00 0.00 0.00 36.38 34.50 1rk7 s VAL 97 CO 0.22 -0.59 0.77 -0.94 0.00 0.00 0.00 175.10 174.55 1rk7 s SER 98 N -3.18 -1.13 0.13 3.32 1.04 -1.24 -2.76 113.70 109.88 1rk7 s SER 98 Ca 0.20 -0.52 0.11 0.00 0.48 0.00 0.00 55.95 56.22 1rk7 s SER 98 Cb -0.01 1.46 -0.04 0.00 0.10 0.00 0.00 66.02 67.53 1rk7 s SER 98 CO 0.05 -0.13 -0.27 -0.63 0.98 0.00 0.00 173.24 173.25 1rk7 s ILE 99 N 1.96 2.22 -0.36 -1.02 1.01 -0.11 -4.98 121.20 119.91 1rk7 s ILE 99 Ca 0.16 -1.74 0.01 0.00 0.00 0.00 0.00 60.65 59.08 1rk7 s ILE 99 Cb -0.02 -1.97 0.15 0.00 0.01 0.00 0.00 42.46 40.63 1rk7 s ILE 99 CO -0.11 0.09 0.26 -1.83 0.00 0.00 0.00 174.94 173.35 1rk7 s GLU 100 N -2.03 0.61 0.16 2.79 -1.05 -1.26 -0.65 118.70 117.27 1rk7 s GLU 100 Ca 0.13 -1.34 0.07 0.00 -0.15 0.00 0.00 54.97 53.69 1rk7 s GLU 100 Cb -0.10 -1.18 -0.04 0.00 -0.44 0.00 0.00 34.13 32.36 1rk7 s GLU 100 CO 0.06 -1.23 -0.14 -0.51 0.95 0.00 0.00 175.26 174.38 1rk7 s ASP 101 N 1.01 2.26 -0.20 0.83 1.01 -1.25 -4.87 116.67 115.46 1rk7 s ASP 101 Ca 0.20 -0.90 0.12 0.00 0.71 0.00 0.00 52.55 52.68 1rk7 s ASP 101 Cb -0.18 -0.10 0.40 0.00 1.01 0.00 0.00 42.92 44.06 1rk7 s ASP 101 CO -0.02 -0.15 1.21 -1.54 0.21 0.00 0.00 175.17 174.88 1rk7 n SER 102 N 0.15 1.78 -0.01 0.27 3.41 -1.26 0.97 113.62 118.93 1rk7 n SER 102 Ca -0.12 -3.80 -0.17 0.00 -0.26 0.00 0.00 58.87 54.51 1rk7 n SER 102 Cb 0.58 -0.52 -0.14 0.00 -0.26 0.00 0.00 64.21 63.88 1rk7 n SER 102 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1rk7 n VAL 103 N -1.15 1.72 -1.42 -3.33 0.31 -1.26 -4.80 118.33 108.40 1rk7 n VAL 103 Ca 0.19 -0.70 -0.03 0.00 -0.01 0.00 0.00 64.34 63.78 1rk7 n VAL 103 Cb 0.69 -1.50 0.02 0.00 -0.91 0.00 0.00 33.84 32.13 1rk7 n VAL 103 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1rk7 n ILE 104 N -3.34 0.00 -3.85 2.52 -0.00 -1.26 -4.82 119.36 108.61 1rk7 n ILE 104 Ca -0.28 -0.13 -0.07 0.00 -0.00 0.00 0.00 62.75 62.27 1rk7 n ILE 104 Cb 1.05 -1.78 -0.02 0.00 -0.00 0.00 0.00 39.64 38.89 1rk7 n ILE 104 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 1rk7 s SER 105 N -1.55 -0.23 -0.17 7.28 0.15 0.19 -4.88 113.70 114.48 1rk7 s SER 105 Ca 0.09 -0.62 -0.09 0.00 0.70 0.00 0.00 55.95 56.02 1rk7 s SER 105 Cb -0.00 0.71 -0.22 0.00 -1.71 0.00 0.00 66.02 64.79 1rk7 s SER 105 CO 0.06 -1.32 0.20 0.18 1.20 0.00 0.00 173.24 173.56 1rk7 n LEU 106 N -0.47 2.47 -3.03 3.45 4.32 -1.26 -0.27 117.00 122.20 1rk7 n LEU 106 Ca -0.04 0.22 -0.14 0.00 -0.02 0.00 0.00 56.01 56.03 1rk7 n LEU 106 Cb 0.59 -1.04 -0.04 0.00 -1.62 0.00 0.00 43.42 41.32 1rk7 n LEU 106 CO 0.16 0.72 -0.07 -0.55 -1.22 0.00 0.00 177.39 176.43 1rk7 s SER 107 N -6.96 -0.23 0.00 -1.43 0.15 -1.26 -4.24 113.70 99.73 1rk7 s SER 107 Ca -0.27 -2.30 0.00 0.00 0.70 0.00 0.00 55.95 54.08 1rk7 s SER 107 Cb 0.07 0.91 0.00 0.00 -1.71 0.00 0.00 66.02 65.29 1rk7 s SER 107 CO 0.69 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.64 1rk7 n GLY 108 N 2.91 0.77 0.03 9.45 0.00 -1.26 -5.02 105.19 112.07 1rk7 n GLY 108 Ca 0.23 0.12 -0.04 0.00 0.00 0.00 0.00 46.02 46.33 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 3.44 -3.20 1.61 9.92 -1.26 -4.76 116.55 122.31 1rk7 n ASP 109 Ca 0.00 -0.02 -0.27 0.00 -0.53 0.00 0.00 54.79 53.97 1rk7 n ASP 109 Cb 0.00 0.34 -0.06 0.00 -0.64 0.00 0.00 41.12 40.76 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 -2.43 3.84 -2.13 1.24 8.25 -1.26 -5.03 115.22 117.70 1rk7 n HIS 110 Ca -0.12 -4.06 -0.42 0.00 -0.26 0.00 0.00 57.72 52.86 1rk7 n HIS 110 Cb 0.68 -0.54 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 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 -2.95 6.77 0.00 0.41 1.04 -1.23 0.55 113.70 118.29 1rk7 s SER 111 Ca 0.44 2.23 0.29 0.00 0.48 0.00 0.00 55.95 59.40 1rk7 s SER 111 Cb 0.21 -2.56 1.37 0.00 0.10 0.00 0.00 66.02 65.14 1rk7 s SER 111 CO -0.07 -0.77 1.94 2.30 0.98 0.00 0.00 173.24 177.61 1rk7 n ILE 112 N 4.67 0.00 -2.37 -1.02 -0.00 0.63 -4.85 119.36 116.42 1rk7 n ILE 112 Ca 0.14 -0.07 -0.34 0.00 -0.00 0.00 0.00 62.75 62.48 1rk7 n ILE 112 Cb 0.43 -0.13 -0.01 0.00 -0.00 0.00 0.00 39.64 39.92 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 1rk7 s ILE 113 N -2.33 3.56 -1.51 7.28 1.01 -1.26 -3.10 121.20 124.85 1rk7 s ILE 113 Ca 0.34 0.94 0.00 0.00 0.00 0.00 0.00 60.65 61.92 1rk7 s ILE 113 Cb 0.21 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1rk7 s ILE 113 CO 0.43 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.74 1rk7 n GLY 114 N -0.19 0.69 2.87 6.18 0.00 -1.21 -4.91 105.19 108.61 1rk7 n GLY 114 Ca 0.10 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.53 3.68 -0.61 1.61 1.74 -1.18 -4.14 116.66 115.24 1rk7 n ARG 115 Ca -0.17 -4.81 -0.31 0.00 -0.77 0.00 0.00 57.85 51.79 1rk7 n ARG 115 Cb 0.58 -2.28 0.20 0.00 -1.02 0.00 0.00 32.46 29.93 1rk7 n ARG 115 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1rk7 n THR 116 N -0.22 0.00 -3.86 0.55 5.66 -1.26 -4.46 114.28 110.68 1rk7 n THR 116 Ca 0.34 -0.30 -0.28 0.00 -3.05 0.00 0.00 64.05 60.77 1rk7 n THR 116 Cb 0.37 -0.83 -0.17 0.00 -1.55 0.00 0.00 70.33 68.15 1rk7 n THR 116 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1rk7 s LEU 117 N -4.60 1.47 -0.84 1.09 -0.00 -1.26 -2.46 118.68 112.07 1rk7 s LEU 117 Ca 0.63 -0.63 0.00 0.00 -0.00 0.00 0.00 54.13 54.14 1rk7 s LEU 117 Cb -0.21 -0.83 0.22 0.00 -0.00 0.00 0.00 46.19 45.37 1rk7 s LEU 117 CO 0.65 -0.20 0.76 1.33 -0.00 0.00 0.00 176.35 178.88 1rk7 n VAL 118 N 4.92 2.77 -1.52 1.48 0.24 -1.21 -4.27 118.33 120.75 1rk7 n VAL 118 Ca -0.11 -5.12 -0.41 0.00 -2.04 0.00 0.00 64.34 56.67 1rk7 n VAL 118 Cb 0.48 -2.30 0.02 0.00 -1.47 0.00 0.00 33.84 30.57 1rk7 n VAL 118 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1rk7 n VAL 119 N 2.03 2.21 -2.24 3.34 0.24 -1.26 -3.90 118.33 118.75 1rk7 n VAL 119 Ca 0.22 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.74 1rk7 n VAL 119 Cb 0.37 -0.80 0.02 0.00 -1.47 0.00 0.00 33.84 31.95 1rk7 n VAL 119 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 1rk7 s HIS 120 N -1.44 3.47 -0.88 6.34 -3.43 -1.26 -2.01 115.29 116.07 1rk7 s HIS 120 Ca 0.65 0.94 -0.03 0.00 -0.80 0.00 0.00 55.06 55.83 1rk7 s HIS 120 Cb -0.55 -2.64 0.24 0.00 -1.43 0.00 0.00 32.58 28.20 1rk7 s HIS 120 CO 0.56 -0.67 2.20 -1.91 -2.00 0.00 0.00 174.74 172.92 1rk7 n GLU 121 N -2.59 3.67 0.00 -0.38 2.13 -1.26 -4.71 120.64 117.50 1rk7 n GLU 121 Ca 0.04 -3.55 0.00 0.00 0.66 0.00 0.00 57.16 54.31 1rk7 n GLU 121 Cb 0.56 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 29.92 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 0.24 0.00 -3.32 5.31 4.76 -1.26 -4.97 118.16 118.92 1rk7 n LYS 122 Ca 0.52 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.58 1rk7 n LYS 122 Cb 0.31 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.44 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 3.49 -0.41 7.82 0.00 -1.26 -4.56 121.76 124.83 1rk7 s ALA 123 Ca 0.00 -0.24 0.18 0.00 0.00 0.00 0.00 51.96 51.90 1rk7 s ALA 123 Cb 0.00 -2.65 0.93 0.00 0.00 0.00 0.00 23.12 21.40 1rk7 s ALA 123 CO 0.00 -0.05 1.56 -0.25 0.00 0.00 0.00 175.76 177.02 1rk7 n ASP 124 N 3.82 0.47 -2.07 0.00 8.00 -1.26 -4.73 116.55 120.78 1rk7 n ASP 124 Ca -0.07 0.69 -0.20 0.00 0.71 0.00 0.00 54.79 55.92 1rk7 n ASP 124 Cb 0.51 -0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 1rk7 n ASP 124 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1rk7 n ASP 125 N -2.10 -5.65 -1.45 -2.24 2.03 -1.26 -0.81 116.55 105.07 1rk7 n ASP 125 Ca -0.00 0.14 -0.14 0.00 0.52 0.00 0.00 54.79 55.31 1rk7 n ASP 125 Cb 0.07 -4.75 -0.06 0.00 -0.72 0.00 0.00 41.12 35.67 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 -2.71 -1.05 0.00 -2.67 4.77 -1.26 -4.17 117.00 109.92 1rk7 n LEU 126 Ca -0.23 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1rk7 n LEU 126 Cb 0.68 -2.12 0.00 0.00 -2.33 0.00 0.00 43.42 39.64 1rk7 n LEU 126 CO 0.29 -0.73 0.00 0.61 -1.33 0.00 0.00 177.39 176.23 1rk7 n GLY 127 N -0.28 1.33 0.49 -0.72 0.00 0.01 -4.97 105.19 101.05 1rk7 n GLY 127 Ca -0.14 -0.51 0.32 0.00 0.00 0.00 0.00 46.02 45.69 1rk7 n GLY 127 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1rk7 h LYS 128 N 0.00 0.16 0.00 1.61 3.64 -1.50 -3.44 116.57 117.04 1rk7 h LYS 128 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1rk7 h LYS 128 Cb 0.00 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1rk7 h LYS 128 CO 0.00 0.10 0.00 0.41 -2.27 0.00 0.00 179.45 177.69 1rk7 n GLY 129 N -1.62 0.38 0.00 5.01 0.00 -1.26 -5.08 105.19 102.62 1rk7 n GLY 129 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.70 -2.28 3.12 -0.02 0.00 -1.26 -5.02 105.19 98.03 1rk7 n GLY 130 Ca 0.00 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.51 -0.23 0.00 1.61 -0.87 -1.26 -4.36 114.94 108.31 1rk7 s ASN 131 Ca 0.00 0.67 0.00 0.00 -1.57 0.00 0.00 52.86 51.96 1rk7 s ASN 131 Cb 0.00 0.63 0.00 0.00 -0.02 0.00 0.00 41.25 41.86 1rk7 s ASN 131 CO 0.00 -0.19 0.00 1.21 -2.57 0.00 0.00 177.10 175.55 1rk7 n GLU 132 N 4.51 0.00 0.03 -0.60 2.13 -1.26 -4.71 120.64 120.73 1rk7 n GLU 132 Ca -0.20 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.60 1rk7 n GLU 132 Cb 0.53 -1.16 -0.00 0.00 0.27 0.00 0.00 31.44 31.08 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 -2.00 0.05 0.03 5.31 -0.06 -1.26 -4.65 117.38 114.81 1rk7 n GLN 133 Ca 0.00 0.02 -0.07 0.00 -2.00 0.00 0.00 57.00 54.95 1rk7 n GLN 133 Cb 0.00 -0.59 -0.12 0.00 -4.06 0.00 0.00 30.24 25.47 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1rk7 h SER 134 N -0.10 0.00 0.23 1.69 4.64 -1.82 -2.88 113.55 115.31 1rk7 h SER 134 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1rk7 h SER 134 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rk7 h SER 134 CO -0.01 0.96 0.00 1.07 -0.87 0.00 0.00 176.83 177.98 1rk7 n THR 135 N -3.21 0.39 -0.05 2.95 5.66 -1.26 -0.60 114.28 118.17 1rk7 n THR 135 Ca -0.07 0.10 -0.07 0.00 -3.05 0.00 0.00 64.05 60.96 1rk7 n THR 135 Cb 0.97 -0.83 -0.02 0.00 -1.55 0.00 0.00 70.33 68.90 1rk7 n THR 135 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1rk7 n LYS 136 N -1.21 0.38 -0.01 1.09 4.81 -1.21 -2.43 118.16 119.57 1rk7 n LYS 136 Ca 0.09 0.15 -0.01 0.00 -0.87 0.00 0.00 58.31 57.67 1rk7 n LYS 136 Cb 0.11 -1.17 -0.02 0.00 0.02 0.00 0.00 35.03 33.97 1rk7 n LYS 136 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1rk7 n THR 137 N -4.18 0.16 0.00 3.15 -2.24 -1.11 -4.35 114.28 105.71 1rk7 n THR 137 Ca -0.11 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1rk7 n THR 137 Cb 0.38 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 3.01 1.33 1.62 3.38 0.00 0.24 -4.59 105.19 110.18 1rk7 n GLY 138 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.59 -2.75 1.61 2.85 -1.11 -3.99 115.26 110.28 1rk7 n ASN 139 Ca 0.00 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.43 1rk7 n ASN 139 Cb 0.00 -0.41 0.02 0.00 1.24 0.00 0.00 39.78 40.63 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rk7 n ALA 140 N -0.31 -2.03 -3.19 5.20 0.00 -1.26 -4.84 120.51 114.09 1rk7 n ALA 140 Ca 0.00 -0.96 -0.18 0.00 0.00 0.00 0.00 53.44 52.30 1rk7 n ALA 140 Cb 0.21 -1.64 -0.06 0.00 0.00 0.00 0.00 19.45 17.95 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 141 N 0.66 0.25 0.00 0.00 0.00 -1.26 -4.71 107.32 102.26 1rk7 s GLY 141 Ca 0.30 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1rk7 s GLY 141 CO -0.07 2.70 0.55 1.44 0.00 0.00 0.00 173.10 177.71 1rk7 n SER 142 N 3.08 0.81 -1.23 1.64 7.64 -1.26 -5.02 113.62 119.27 1rk7 n SER 142 Ca 0.23 -1.30 0.12 0.00 1.01 0.00 0.00 58.87 58.93 1rk7 n SER 142 Cb 0.50 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 1rk7 n SER 142 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rk7 n ARG 143 N -0.15 -1.71 0.00 1.43 3.00 -1.26 -4.87 116.66 113.10 1rk7 n ARG 143 Ca 0.00 1.12 0.00 0.00 -0.01 0.00 0.00 57.85 58.96 1rk7 n ARG 143 Cb 0.27 -2.08 0.00 0.00 0.00 0.00 0.00 32.46 30.65 1rk7 n ARG 143 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1rk7 n LEU 144 N 0.00 0.00 -4.73 0.55 4.77 -0.85 -4.18 117.00 112.56 1rk7 n LEU 144 Ca 0.01 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.74 1rk7 n LEU 144 Cb 0.39 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1rk7 n LEU 144 CO 0.01 0.00 -0.27 0.00 -1.33 0.00 0.00 177.39 175.80 1rk7 s ALA 145 N -1.23 3.37 -0.64 -1.18 0.00 -1.26 -1.28 121.76 119.53 1rk7 s ALA 145 Ca 0.00 -1.39 0.06 0.00 0.00 0.00 0.00 51.96 50.63 1rk7 s ALA 145 Cb 0.00 -1.12 0.23 0.00 0.00 0.00 0.00 23.12 22.23 1rk7 s ALA 145 CO 0.00 0.40 0.67 0.00 0.00 0.00 0.00 175.76 176.83 1rk7 h GLY 147 N 4.48 1.01 -3.55 0.00 0.00 -1.76 -3.41 103.07 99.85 1rk7 h GLY 147 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1rk7 h GLY 147 CO 0.79 -0.10 -0.66 -0.62 0.00 0.00 0.00 176.54 175.95 1rk7 n VAL 148 N -5.04 -9.83 -2.71 4.60 0.31 -1.26 -3.42 118.33 100.97 1rk7 n VAL 148 Ca 0.12 2.24 -0.42 0.00 -0.01 0.00 0.00 64.34 66.28 1rk7 n VAL 148 Cb 0.38 -4.77 -0.03 0.00 -0.91 0.00 0.00 33.84 28.51 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 -0.38 4.18 0.24 2.52 1.09 -1.25 -3.68 121.20 123.92 1rk7 s ILE 149 Ca 0.00 -0.70 0.10 0.00 -1.10 0.00 0.00 60.65 58.94 1rk7 s ILE 149 Cb 0.00 -4.89 -0.04 0.00 -1.06 0.00 0.00 42.46 36.46 1rk7 s ILE 149 CO 0.00 -1.72 -0.05 -0.83 -0.10 0.00 0.00 174.94 172.24 1rk7 s GLY 150 N 4.17 1.70 0.52 6.18 0.00 0.67 -3.31 107.32 117.24 1rk7 s GLY 150 Ca 0.36 -1.62 -0.21 0.00 0.00 0.00 0.00 44.72 43.25 1rk7 s GLY 150 CO -0.02 -1.67 1.22 -0.42 0.00 0.00 0.00 173.10 172.21 1rk7 s ILE 151 N -2.17 2.73 0.18 0.90 -1.09 -1.26 0.15 121.20 120.63 1rk7 s ILE 151 Ca 0.29 0.52 -0.04 0.00 -2.23 0.00 0.00 60.65 59.19 1rk7 s ILE 151 Cb -0.07 -3.25 -0.03 0.00 -1.58 0.00 0.00 42.46 37.54 1rk7 s ILE 151 CO 0.18 -0.04 0.18 0.00 -1.23 0.00 0.00 174.94 174.04 1rk7 s ALA 152 N -1.51 0.65 -2.14 9.38 0.00 -0.35 -4.74 121.76 123.05 1rk7 s ALA 152 Ca 0.70 -1.35 0.17 0.00 0.00 0.00 0.00 51.96 51.48 1rk7 s ALA 152 Cb -0.32 1.07 0.14 0.00 0.00 0.00 0.00 23.12 24.01 1rk7 s ALA 152 CO 0.37 -0.60 1.04 0.00 0.00 0.00 0.00 175.76 176.57