#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 4.90 -0.37 0.00 2.01 -1.26 -4.43 115.64 116.49 1rk7 s THR 2 Ca 0.00 0.36 -0.09 0.00 0.31 0.00 0.00 61.69 62.27 1rk7 s THR 2 Cb 0.00 -3.73 0.04 0.00 0.01 0.00 0.00 72.50 68.82 1rk7 s THR 2 CO 0.00 -0.41 0.18 -0.75 -0.69 0.00 0.00 174.62 172.94 1rk7 s LYS 3 N -3.67 2.70 0.67 4.92 2.20 -1.26 -2.43 119.74 122.88 1rk7 s LYS 3 Ca 0.48 -1.19 -0.08 0.00 -0.36 0.00 0.00 55.97 54.82 1rk7 s LYS 3 Cb -0.10 -3.63 0.04 0.00 -1.51 0.00 0.00 37.83 32.62 1rk7 s LYS 3 CO 0.30 -0.73 1.00 0.00 -0.36 0.00 0.00 175.35 175.56 1rk7 s ALA 4 N 1.47 3.12 -0.08 3.13 0.00 0.33 -1.38 121.76 128.35 1rk7 s ALA 4 Ca 0.01 -0.72 -0.12 0.00 0.00 0.00 0.00 51.96 51.12 1rk7 s ALA 4 Cb -0.20 -2.71 0.03 0.00 0.00 0.00 0.00 23.12 20.24 1rk7 s ALA 4 CO 0.04 -1.14 0.32 0.14 0.00 0.00 0.00 175.76 175.12 1rk7 s VAL 5 N -3.21 0.02 -0.21 0.00 -7.23 -0.97 -1.07 120.40 107.73 1rk7 s VAL 5 Ca 0.58 -0.19 -0.03 0.00 -1.81 0.00 0.00 61.98 60.52 1rk7 s VAL 5 Cb -0.11 -0.51 0.07 0.00 0.56 0.00 0.00 36.38 36.39 1rk7 s VAL 5 CO 0.46 -0.10 0.07 0.00 -0.31 0.00 0.00 175.10 175.22 1rk7 s ALA 6 N -0.41 0.82 -1.04 1.32 0.00 -0.15 -1.47 121.76 120.84 1rk7 s ALA 6 Ca -0.05 -0.74 -0.21 0.00 0.00 0.00 0.00 51.96 50.95 1rk7 s ALA 6 Cb -0.03 -1.22 0.07 0.00 0.00 0.00 0.00 23.12 21.94 1rk7 s ALA 6 CO 0.02 -1.30 1.42 0.54 0.00 0.00 0.00 175.76 176.44 1rk7 s VAL 7 N 1.96 4.13 0.38 0.00 0.11 -1.25 -0.53 120.40 125.20 1rk7 s VAL 7 Ca 0.03 -1.10 -0.23 0.00 -2.93 0.00 0.00 61.98 57.74 1rk7 s VAL 7 Cb -0.17 -5.02 -0.14 0.00 -1.53 0.00 0.00 36.38 29.52 1rk7 s VAL 7 CO -0.15 -1.86 0.47 0.18 -3.33 0.00 0.00 175.10 170.41 1rk7 n LEU 8 N 8.30 -0.73 0.00 2.54 7.99 0.10 -4.31 117.00 130.90 1rk7 n LEU 8 Ca 0.33 0.93 0.00 0.00 -0.01 0.00 0.00 56.01 57.26 1rk7 n LEU 8 Cb 0.50 -1.05 0.00 0.00 -0.11 0.00 0.00 43.42 42.76 1rk7 n LEU 8 CO 0.64 -3.11 0.00 1.17 -1.51 0.00 0.00 177.39 174.58 1rk7 n LYS 9 N 0.82 0.00 0.00 3.23 4.81 -1.20 -4.15 118.16 121.67 1rk7 n LYS 9 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1rk7 n LYS 9 Cb 0.37 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.42 1rk7 n LYS 9 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1rk7 n GLY 10 N 0.00 -0.70 0.34 3.14 0.00 -1.21 -2.63 105.19 104.13 1rk7 n GLY 10 Ca 0.00 0.57 -0.10 0.00 0.00 0.00 0.00 46.02 46.49 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 -1.61 0.00 1.61 1.82 -1.23 -3.47 116.42 113.54 1rk7 h ASP 11 Ca 0.00 0.23 0.00 0.00 -0.39 0.00 0.00 57.03 56.87 1rk7 h ASP 11 Cb 0.00 0.69 0.00 0.00 0.68 0.00 0.00 39.33 40.70 1rk7 h ASP 11 CO 0.00 -0.24 0.00 0.61 -1.61 0.00 0.00 179.24 178.00 1rk7 n GLY 12 N -1.24 0.74 0.19 -0.78 0.00 -1.26 -4.97 105.19 97.88 1rk7 n GLY 12 Ca -0.00 0.06 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 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 0.68 -5.19 1.61 0.13 -1.88 -3.40 132.00 123.95 1rk7 h PRO 13 Ca 0.00 -0.66 -0.04 0.00 -0.87 0.00 0.00 66.00 64.43 1rk7 h PRO 13 Cb 0.00 0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.30 1rk7 h PRO 13 CO 0.00 1.26 0.12 0.08 -0.23 0.00 0.00 178.00 179.23 1rk7 s VAL 14 N -3.45 3.06 -0.57 1.56 1.01 -1.22 -3.85 120.40 116.95 1rk7 s VAL 14 Ca -0.11 -0.10 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1rk7 s VAL 14 Cb 0.07 -3.84 0.33 0.00 0.00 0.00 0.00 36.38 32.94 1rk7 s VAL 14 CO 0.90 -0.12 0.91 1.67 0.00 0.00 0.00 175.10 178.46 1rk7 n GLN 15 N 8.32 2.98 -2.40 2.72 7.27 -0.12 -3.26 117.38 132.89 1rk7 n GLN 15 Ca 0.43 -4.72 -0.19 0.00 0.07 0.00 0.00 57.00 52.59 1rk7 n GLN 15 Cb 0.46 -2.19 0.09 0.00 2.41 0.00 0.00 30.24 31.02 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 -0.11 0.93 2.80 1.69 0.00 -1.26 -4.60 105.19 104.65 1rk7 n GLY 16 Ca 0.30 -2.06 -0.18 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.55 -0.26 0.31 -0.61 1.01 -0.22 0.01 121.20 118.89 1rk7 s ILE 17 Ca 0.57 0.22 0.03 0.00 0.00 0.00 0.00 60.65 61.47 1rk7 s ILE 17 Cb -0.03 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 42.02 1rk7 s ILE 17 CO 0.37 0.05 0.48 0.27 0.00 0.00 0.00 174.94 176.11 1rk7 s ILE 18 N 2.29 4.96 -0.15 2.92 -5.25 0.31 -2.31 121.20 123.97 1rk7 s ILE 18 Ca 0.04 -0.72 -0.04 0.00 -0.99 0.00 0.00 60.65 58.94 1rk7 s ILE 18 Cb -0.13 -3.78 0.07 0.00 2.95 0.00 0.00 42.46 41.57 1rk7 s ILE 18 CO -0.07 -0.41 0.25 0.54 -1.79 0.00 0.00 174.94 173.45 1rk7 s ASN 19 N -4.05 0.68 -0.56 4.36 2.20 0.21 -0.97 114.94 116.81 1rk7 s ASN 19 Ca 0.39 0.31 -0.10 0.00 -0.94 0.00 0.00 52.86 52.53 1rk7 s ASN 19 Cb -0.09 0.59 0.14 0.00 -2.00 0.00 0.00 41.25 39.89 1rk7 s ASN 19 CO 0.33 -0.27 0.44 -0.36 -2.94 0.00 0.00 177.10 174.30 1rk7 s PHE 20 N 2.39 3.46 -0.16 1.54 0.40 -0.23 -1.99 117.98 123.39 1rk7 s PHE 20 Ca 0.04 -1.97 -0.04 0.00 -0.60 0.00 0.00 56.93 54.36 1rk7 s PHE 20 Cb -0.13 -3.53 -0.03 0.00 0.51 0.00 0.00 43.02 39.84 1rk7 s PHE 20 CO -0.10 -0.97 -0.03 -1.83 0.70 0.00 0.00 175.22 172.98 1rk7 s GLU 21 N 0.98 3.68 -0.55 0.44 4.04 -0.82 0.12 118.70 126.59 1rk7 s GLU 21 Ca 0.09 -0.51 0.06 0.00 0.04 0.00 0.00 54.97 54.64 1rk7 s GLU 21 Cb -0.23 -2.92 0.35 0.00 0.02 0.00 0.00 34.13 31.35 1rk7 s GLU 21 CO -0.02 0.25 0.94 0.94 -1.84 0.00 0.00 175.26 175.53 1rk7 n GLN 22 N 3.52 3.02 -0.98 -4.83 7.27 -1.02 0.18 117.38 124.55 1rk7 n GLN 22 Ca -0.17 -4.69 -0.34 0.00 0.07 0.00 0.00 57.00 51.87 1rk7 n GLN 22 Cb 0.52 -2.18 -0.04 0.00 2.41 0.00 0.00 30.24 30.95 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 -0.21 1.74 -3.73 3.69 5.02 -1.26 0.22 118.16 123.63 1rk7 n LYS 23 Ca 0.31 -1.68 -0.11 0.00 -2.02 0.00 0.00 58.31 54.80 1rk7 n LYS 23 Cb 0.44 -2.72 -0.07 0.00 -0.02 0.00 0.00 35.03 32.66 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 4.33 0.87 -0.61 1.97 0.41 -1.26 -4.96 118.70 119.44 1rk7 s GLU 24 Ca 0.49 -0.54 -0.04 0.00 -0.41 0.00 0.00 54.97 54.47 1rk7 s GLU 24 Cb 0.13 0.38 -0.06 0.00 -1.78 0.00 0.00 34.13 32.79 1rk7 s GLU 24 CO 0.05 -0.29 1.95 0.43 -0.49 0.00 0.00 175.26 176.92 1rk7 n SER 25 N 0.41 3.84 -0.28 -0.19 7.64 -1.26 -3.79 113.62 119.99 1rk7 n SER 25 Ca -0.18 -2.21 -0.03 0.00 1.01 0.00 0.00 58.87 57.47 1rk7 n SER 25 Cb 0.60 -0.94 -0.00 0.00 -1.01 0.00 0.00 64.21 62.86 1rk7 n SER 25 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1rk7 n ASN 26 N 3.99 -1.68 -1.09 6.43 3.02 -1.26 -5.05 115.26 119.62 1rk7 n ASN 26 Ca 0.34 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.89 1rk7 n ASN 26 Cb 0.18 -1.03 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rk7 n GLY 27 N -1.09 1.25 3.81 7.41 0.00 -1.25 -5.00 105.19 110.32 1rk7 n GLY 27 Ca -0.03 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 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 1.53 2.14 -0.24 1.61 0.04 -1.26 -4.65 135.00 134.19 1rk7 s PRO 28 Ca 0.00 0.66 -0.08 0.00 0.04 0.00 0.00 61.00 61.62 1rk7 s PRO 28 Cb 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1rk7 s PRO 28 CO 0.00 -1.58 0.10 0.08 0.04 0.00 0.00 177.00 175.64 1rk7 s VAL 29 N -3.15 4.77 -1.04 -0.36 1.01 -0.01 -4.67 120.40 116.95 1rk7 s VAL 29 Ca 0.61 -0.02 -0.23 0.00 0.00 0.00 0.00 61.98 62.34 1rk7 s VAL 29 Cb -0.14 -3.22 0.04 0.00 0.00 0.00 0.00 36.38 33.06 1rk7 s VAL 29 CO 0.54 0.35 1.53 -0.54 0.00 0.00 0.00 175.10 176.99 1rk7 s LYS 30 N 1.24 3.53 -0.10 2.72 1.02 0.48 -1.99 119.74 126.65 1rk7 s LYS 30 Ca 0.06 -1.15 -0.24 0.00 0.02 0.00 0.00 55.97 54.66 1rk7 s LYS 30 Cb -0.14 -5.35 -0.03 0.00 -0.52 0.00 0.00 37.83 31.78 1rk7 s LYS 30 CO 0.05 -2.34 0.72 0.08 -0.92 0.00 0.00 175.35 172.93 1rk7 s VAL 31 N 5.42 5.01 0.22 3.17 1.01 -0.08 -1.95 120.40 133.21 1rk7 s VAL 31 Ca 0.49 1.46 -0.20 0.00 0.00 0.00 0.00 61.98 63.73 1rk7 s VAL 31 Cb -0.00 -4.05 0.04 0.00 0.00 0.00 0.00 36.38 32.37 1rk7 s VAL 31 CO -0.07 0.20 0.62 -1.66 0.00 0.00 0.00 175.10 174.19 1rk7 s TRP 32 N 1.15 -0.26 -4.39 5.22 -2.14 -0.84 -0.22 118.94 117.45 1rk7 s TRP 32 Ca 0.37 -0.08 0.00 0.00 2.66 0.00 0.00 56.10 59.05 1rk7 s TRP 32 Cb -0.17 0.56 0.00 0.00 -3.10 0.00 0.00 33.47 30.75 1rk7 s TRP 32 CO 0.16 -1.02 0.00 0.41 -2.66 0.00 0.00 176.95 173.85 1rk7 n GLY 33 N -0.40 -0.61 3.44 3.67 0.00 -1.09 0.64 105.19 110.85 1rk7 n GLY 33 Ca -0.10 -1.07 -0.07 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 -4.00 -0.68 -0.33 1.61 1.04 -0.98 -1.01 113.70 109.35 1rk7 s SER 34 Ca 0.00 1.22 -0.05 0.00 0.48 0.00 0.00 55.95 57.60 1rk7 s SER 34 Cb 0.00 1.39 0.04 0.00 0.10 0.00 0.00 66.02 67.55 1rk7 s SER 34 CO 0.00 -0.22 0.07 -0.63 0.98 0.00 0.00 173.24 173.44 1rk7 s ILE 35 N 2.08 3.50 -0.27 -1.02 1.01 0.31 -1.05 121.20 125.76 1rk7 s ILE 35 Ca -0.07 -1.23 -0.04 0.00 0.00 0.00 0.00 60.65 59.31 1rk7 s ILE 35 Cb -0.09 -2.99 0.02 0.00 0.01 0.00 0.00 42.46 39.40 1rk7 s ILE 35 CO -0.16 -0.16 -0.00 -1.59 0.00 0.00 0.00 174.94 173.03 1rk7 s LYS 36 N 1.35 2.92 0.00 2.79 -2.85 -1.26 0.15 119.74 122.83 1rk7 s LYS 36 Ca -0.03 -0.94 0.00 0.00 -1.00 0.00 0.00 55.97 54.00 1rk7 s LYS 36 Cb -0.20 -3.14 0.00 0.00 -2.06 0.00 0.00 37.83 32.43 1rk7 s LYS 36 CO 0.01 -0.43 0.00 0.41 0.10 0.00 0.00 175.35 175.45 1rk7 n GLY 37 N 4.74 0.30 0.00 0.59 0.00 -1.25 -0.94 105.19 108.63 1rk7 n GLY 37 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1rk7 n GLY 37 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1rk7 n LEU 38 N 0.00 0.00 -4.34 0.99 -0.00 -1.26 -4.50 117.00 107.89 1rk7 n LEU 38 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 55.80 1rk7 n LEU 38 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.31 1rk7 n LEU 38 CO 0.00 -0.08 -0.47 0.42 -0.00 0.00 0.00 177.39 177.26 1rk7 s THR 39 N 0.33 1.80 0.47 1.47 -4.23 -1.26 -3.29 115.64 110.93 1rk7 s THR 39 Ca 0.00 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.27 1rk7 s THR 39 Cb 0.00 -1.90 -0.08 0.00 1.34 0.00 0.00 72.50 71.86 1rk7 s THR 39 CO 0.00 -0.39 1.32 1.21 -0.54 0.00 0.00 174.62 176.21 1rk7 n GLU 40 N 0.10 1.91 0.00 3.99 0.00 -1.26 -4.44 120.64 120.93 1rk7 n GLU 40 Ca -0.12 0.69 0.00 0.00 0.00 0.00 0.00 57.16 57.73 1rk7 n GLU 40 Cb 0.58 -2.48 0.00 0.00 0.00 0.00 0.00 31.44 29.54 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 0.76 1.65 3.50 8.31 0.00 -1.26 -4.88 105.19 113.28 1rk7 n GLY 41 Ca 0.07 -2.09 -0.32 0.00 0.00 0.00 0.00 46.02 43.68 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rk7 n LEU 42 N 0.00 1.03 -3.75 0.99 4.32 -1.26 -2.60 117.00 115.72 1rk7 n LEU 42 Ca 0.00 0.36 -0.10 0.00 -0.02 0.00 0.00 56.01 56.26 1rk7 n LEU 42 Cb 0.00 -1.30 -0.04 0.00 -1.62 0.00 0.00 43.42 40.46 1rk7 n LEU 42 CO 0.00 -3.12 0.26 -1.00 -1.22 0.00 0.00 177.39 172.32 1rk7 s HIS 43 N -2.48 -0.09 0.00 -1.77 3.76 0.36 -4.35 115.29 110.73 1rk7 s HIS 43 Ca 0.60 -0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.26 1rk7 s HIS 43 Cb -0.22 0.38 0.00 0.00 1.11 0.00 0.00 32.58 33.85 1rk7 s HIS 43 CO 0.64 -0.92 0.00 0.41 -0.85 0.00 0.00 174.74 174.02 1rk7 n GLY 44 N -0.34 0.89 3.53 -2.22 0.00 -1.25 0.43 105.19 106.24 1rk7 n GLY 44 Ca -0.10 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 1rk7 n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rk7 s PHE 45 N 0.57 -0.42 1.09 1.61 0.08 -1.25 -2.48 117.98 117.18 1rk7 s PHE 45 Ca 0.00 0.55 -0.17 0.00 0.12 0.00 0.00 56.93 57.43 1rk7 s PHE 45 Cb 0.00 0.48 0.14 0.00 -0.57 0.00 0.00 43.02 43.07 1rk7 s PHE 45 CO 0.00 -0.49 0.13 -2.39 -0.10 0.00 0.00 175.22 172.38 1rk7 n HIS 46 N 0.35 -1.98 -2.67 0.36 1.44 -1.04 -4.53 115.22 107.15 1rk7 n HIS 46 Ca -0.12 0.03 -0.01 0.00 -2.01 0.00 0.00 57.72 55.62 1rk7 n HIS 46 Cb 0.59 -1.46 0.00 0.00 0.12 0.00 0.00 29.99 29.25 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 -4.47-11.51 -2.66 0.61 0.31 -1.26 -4.74 118.33 94.60 1rk7 n VAL 47 Ca 0.04 1.67 -0.04 0.00 -0.01 0.00 0.00 64.34 66.00 1rk7 n VAL 47 Cb 0.50 -6.85 0.06 0.00 -0.91 0.00 0.00 33.84 26.64 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 0.56 -0.47 -3.07 3.52 1.44 -1.26 -4.48 115.22 111.46 1rk7 n HIS 48 Ca 0.01 -0.64 -0.45 0.00 -2.01 0.00 0.00 57.72 54.64 1rk7 n HIS 48 Cb 0.05 1.07 -0.04 0.00 0.12 0.00 0.00 29.99 31.19 1rk7 n HIS 48 CO 0.00 0.00 0.00 -1.83 -2.81 0.00 0.00 176.34 171.70 1rk7 s GLU 49 N 0.54 3.28 0.00 -1.40 1.03 -1.26 -4.48 118.70 116.41 1rk7 s GLU 49 Ca 0.24 -1.57 0.00 0.00 0.03 0.00 0.00 54.97 53.67 1rk7 s GLU 49 Cb 0.17 -4.46 0.00 0.00 -0.80 0.00 0.00 34.13 29.05 1rk7 s GLU 49 CO -0.09 -1.59 0.12 -1.91 -1.33 0.00 0.00 175.26 170.46 1rk7 n GLU 50 N 6.14 0.00 -1.87 -4.83 0.00 -1.26 -4.45 120.64 114.37 1rk7 n GLU 50 Ca 0.03 0.39 -0.01 0.00 0.00 0.00 0.00 57.16 57.57 1rk7 n GLU 50 Cb 0.45 -0.96 -0.00 0.00 0.00 0.00 0.00 31.44 30.93 1rk7 n GLU 50 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1rk7 n GLU 51 N -1.67 0.04 -1.45 5.31 1.02 -1.26 -5.03 120.64 117.60 1rk7 n GLU 51 Ca 0.00 -0.21 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 1rk7 n GLU 51 Cb 0.00 0.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.61 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1rk7 n ASP 52 N -2.34 -5.50 -2.77 1.62 8.00 -1.26 -4.85 116.55 109.45 1rk7 n ASP 52 Ca 0.00 0.78 -0.38 0.00 0.71 0.00 0.00 54.79 55.90 1rk7 n ASP 52 Cb 0.04 -2.99 0.05 0.00 -0.02 0.00 0.00 41.12 38.20 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 0.90 7.56 -4.30 -2.24 4.13 -1.26 -4.92 115.26 115.13 1rk7 n ASN 53 Ca 0.00 -3.81 -0.35 0.00 1.68 0.00 0.00 54.58 52.10 1rk7 n ASN 53 Cb 0.00 -1.05 -0.14 0.00 -1.54 0.00 0.00 39.78 37.05 1rk7 n ASN 53 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1rk7 s THR 54 N -4.95 3.34 0.00 3.41 -1.32 -1.26 -5.03 115.64 109.83 1rk7 s THR 54 Ca 0.55 -0.58 0.00 0.00 -1.21 0.00 0.00 61.69 60.46 1rk7 s THR 54 Cb 0.45 -2.55 0.00 0.00 -1.51 0.00 0.00 72.50 68.89 1rk7 s THR 54 CO -0.32 0.37 0.00 0.00 -2.21 0.00 0.00 174.62 172.46 1rk7 n ALA 55 N 4.79 0.00 -2.87 11.08 0.00 -1.26 -5.07 120.51 127.18 1rk7 n ALA 55 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 1rk7 n ALA 55 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.97 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 5.55 1.35 0.00 0.00 -1.26 -4.46 105.19 106.37 1rk7 n GLY 56 Ca 0.00 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.38 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 -3.29 0.00 -2.49 0.00 -2.24 -1.26 -5.14 114.28 99.86 1rk7 n THR 58 Ca 0.00 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1rk7 n THR 58 Cb 0.10 -0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 68.00 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 -3.21 -4.90 0.04 3.42 7.64 -1.26 -5.05 113.62 110.30 1rk7 n SER 59 Ca 0.00 1.62 0.00 0.00 1.01 0.00 0.00 58.87 61.50 1rk7 n SER 59 Cb 0.00 -5.27 0.00 0.00 -1.01 0.00 0.00 64.21 57.93 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 1.80 3.00 -2.85 -0.43 0.00 -1.26 -5.07 120.51 115.70 1rk7 n ALA 60 Ca -0.22 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 1rk7 n ALA 60 Cb 0.34 0.05 0.01 0.00 0.00 0.00 0.00 19.45 19.85 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 -3.92 -1.51 -0.60 0.00 0.00 -1.26 -5.11 107.32 94.93 1rk7 s GLY 61 Ca 0.00 0.44 -0.27 0.00 0.00 0.00 0.00 44.72 44.88 1rk7 s GLY 61 CO 0.00 4.00 1.52 2.56 0.00 0.00 0.00 173.10 181.18 1rk7 s PRO 62 N 1.42 3.12 -0.21 2.90 0.04 -1.26 -4.69 135.00 136.31 1rk7 s PRO 62 Ca 0.21 0.41 0.13 0.00 0.04 0.00 0.00 61.00 61.79 1rk7 s PRO 62 Cb 0.03 -4.20 0.33 0.00 0.04 0.00 0.00 34.50 30.70 1rk7 s PRO 62 CO -0.10 -2.17 1.30 1.58 0.04 0.00 0.00 177.00 177.65 1rk7 n HIS 63 N 10.36 -0.75 -2.04 0.56 -0.00 -1.26 -4.97 115.22 117.11 1rk7 n HIS 63 Ca 0.13 -1.40 0.09 0.00 0.46 0.00 0.00 57.72 57.00 1rk7 n HIS 63 Cb 0.50 0.81 -0.02 0.00 -0.12 0.00 0.00 29.99 31.15 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 -0.81 -2.63 -4.79 1.57 3.72 -1.26 -4.76 117.46 108.50 1rk7 n PHE 64 Ca -0.13 0.80 -0.33 0.00 -0.05 0.00 0.00 57.45 57.74 1rk7 n PHE 64 Cb 0.85 -1.40 -0.15 0.00 -0.94 0.00 0.00 39.48 37.84 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 -4.91 3.88 -1.21 4.37 0.01 -1.26 -5.04 114.94 110.78 1rk7 s ASN 65 Ca 0.00 -0.37 -0.21 0.00 -0.71 0.00 0.00 52.86 51.57 1rk7 s ASN 65 Cb 0.00 -1.59 -0.01 0.00 0.41 0.00 0.00 41.25 40.07 1rk7 s ASN 65 CO 0.00 0.15 1.82 -2.16 -1.51 0.00 0.00 177.10 175.40 1rk7 s PRO 66 N 0.41 3.24 0.00 -0.60 0.04 -1.26 -3.01 135.00 133.82 1rk7 s PRO 66 Ca -0.11 -1.49 0.00 0.00 0.04 0.00 0.00 61.00 59.43 1rk7 s PRO 66 Cb -0.16 -5.37 0.00 0.00 0.04 0.00 0.00 34.50 29.00 1rk7 s PRO 66 CO 0.05 -3.07 0.00 -0.11 0.04 0.00 0.00 177.00 173.91 1rk7 n LEU 67 N 11.34 0.00 0.11 -3.56 -0.00 -1.26 -4.93 117.00 118.69 1rk7 n LEU 67 Ca 0.46 0.00 0.20 0.00 -0.00 0.00 0.00 56.01 56.67 1rk7 n LEU 67 Cb 0.47 0.00 0.73 0.00 -0.00 0.00 0.00 43.42 44.62 1rk7 n LEU 67 CO 0.71 -0.00 1.18 0.77 -0.00 0.00 0.00 177.39 180.04 1rk7 h SER 68 N 0.00 0.00 0.00 1.96 4.64 -1.83 -3.37 113.55 114.95 1rk7 h SER 68 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rk7 h SER 68 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1rk7 h SER 68 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1rk7 n ARG 69 N -3.56 0.00 -0.02 4.77 1.74 -1.26 -3.02 116.66 115.31 1rk7 n ARG 69 Ca 0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1rk7 n ARG 69 Cb 0.64 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.08 1rk7 n ARG 69 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1rk7 n LYS 70 N 0.00 0.00 -1.52 5.56 2.85 -1.26 -5.06 118.16 118.73 1rk7 n LYS 70 Ca 0.00 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.88 1rk7 n LYS 70 Cb 0.00 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.28 1rk7 n LYS 70 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 1rk7 n HIS 71 N 0.00 0.93 -2.10 5.58 -0.00 -0.98 -4.77 115.22 113.88 1rk7 n HIS 71 Ca 0.00 0.25 -0.39 0.00 -0.00 0.00 0.00 57.72 57.57 1rk7 n HIS 71 Cb 0.00 -2.44 -0.01 0.00 -0.00 0.00 0.00 29.99 27.54 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 1rk7 s GLY 72 N 10.17 2.92 0.00 1.57 0.00 -1.26 -4.02 107.32 116.71 1rk7 s GLY 72 Ca 1.19 1.18 0.00 0.00 0.00 0.00 0.00 44.72 47.09 1rk7 s GLY 72 CO 0.38 1.76 0.00 0.61 0.00 0.00 0.00 173.10 175.86 1rk7 n GLY 73 N 0.68 0.16 2.18 0.20 0.00 -0.55 -4.53 105.19 103.33 1rk7 n GLY 73 Ca 0.03 -1.28 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1rk7 n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 74 N 0.00 1.70 0.00 1.61 -0.04 -1.26 -2.62 135.00 134.39 1rk7 n PRO 74 Ca 0.00 -0.91 0.00 0.00 -0.04 0.00 0.00 63.50 62.55 1rk7 n PRO 74 Cb 0.00 -1.99 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1rk7 n PRO 74 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1rk7 n LYS 75 N 2.83 0.00 0.00 0.54 5.02 -1.26 -5.14 118.16 120.15 1rk7 n LYS 75 Ca 0.36 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1rk7 n LYS 75 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.62 1rk7 n LYS 75 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1rk7 n ASP 76 N 0.00 0.00 -0.86 4.39 -0.08 -1.08 -4.54 116.55 114.39 1rk7 n ASP 76 Ca 0.00 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.38 1rk7 n ASP 76 Cb 0.00 0.00 0.12 0.00 2.34 0.00 0.00 41.12 43.58 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1rk7 n GLU 77 N 0.00 1.95 0.00 -0.67 0.00 -1.26 -1.49 120.64 119.17 1rk7 n GLU 77 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 57.16 55.33 1rk7 n GLU 77 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 31.44 30.04 1rk7 n GLU 77 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1rk7 n GLU 78 N 1.16 0.00 0.00 5.31 4.71 -1.26 -5.02 120.64 125.54 1rk7 n GLU 78 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.28 1rk7 n GLU 78 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.94 1rk7 n GLU 78 CO 0.00 0.00 0.00 2.89 0.09 0.00 0.00 177.13 180.11 1rk7 n ARG 79 N 0.00 0.00 -0.95 3.49 1.85 -1.17 -4.81 116.66 115.08 1rk7 n ARG 79 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1rk7 n ARG 79 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1rk7 n ARG 79 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 1rk7 n HIS 80 N -0.37 0.00 0.24 2.89 -0.00 -1.04 -4.75 115.22 112.19 1rk7 n HIS 80 Ca 0.00 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.20 1rk7 n HIS 80 Cb 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 29.85 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 -2.23 0.00 0.02 3.57 0.31 -1.26 -4.89 118.33 113.84 1rk7 n VAL 81 Ca 0.00 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1rk7 n VAL 81 Cb 0.00 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.94 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 1.06 -1.94 3.86 2.92 0.00 -1.26 -4.75 105.19 105.07 1rk7 n GLY 82 Ca 0.01 0.57 -0.31 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.12 6.48 0.00 1.61 2.15 -1.26 -4.65 116.67 119.87 1rk7 s ASP 83 Ca 0.00 1.34 0.00 0.00 0.43 0.00 0.00 52.55 54.32 1rk7 s ASP 83 Cb 0.00 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1rk7 s ASP 83 CO 0.00 -0.58 0.00 0.18 -0.17 0.00 0.00 175.17 174.60 1rk7 n LEU 84 N -1.77 0.00 0.00 -1.34 7.99 -1.26 -2.51 117.00 118.11 1rk7 n LEU 84 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.04 1rk7 n LEU 84 Cb 0.54 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.85 1rk7 n LEU 84 CO 0.50 -0.32 0.00 0.61 -1.51 0.00 0.00 177.39 176.66 1rk7 n GLY 85 N 1.63 1.41 3.28 -0.72 0.00 -1.26 -4.33 105.19 105.20 1rk7 n GLY 85 Ca 0.00 0.35 -0.14 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.28 0.03 1.61 -0.87 -1.26 -4.48 114.94 111.69 1rk7 s ASN 86 Ca 0.00 0.28 0.00 0.00 -1.57 0.00 0.00 52.86 51.57 1rk7 s ASN 86 Cb 0.00 0.42 0.00 0.00 -0.02 0.00 0.00 41.25 41.65 1rk7 s ASN 86 CO 0.00 -0.42 0.02 1.33 -2.57 0.00 0.00 177.10 175.46 1rk7 n VAL 87 N 1.48 0.00 -3.65 1.60 0.24 0.17 -4.82 118.33 113.35 1rk7 n VAL 87 Ca -0.20 -0.13 -0.15 0.00 -2.04 0.00 0.00 64.34 61.82 1rk7 n VAL 87 Cb 0.56 -0.41 -0.08 0.00 -1.47 0.00 0.00 33.84 32.44 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 -0.27 0.01 0.76 3.34 2.01 -1.26 0.14 115.64 120.38 1rk7 s THR 88 Ca 0.02 -0.11 -0.07 0.00 0.31 0.00 0.00 61.69 61.83 1rk7 s THR 88 Cb -0.00 -0.81 0.11 0.00 0.01 0.00 0.00 72.50 71.81 1rk7 s THR 88 CO 0.01 -0.06 1.08 0.00 -0.69 0.00 0.00 174.62 174.96 1rk7 s ALA 89 N -0.51 3.07 0.00 7.40 0.00 -1.07 -4.53 121.76 126.11 1rk7 s ALA 89 Ca -0.06 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1rk7 s ALA 89 Cb -0.03 -2.51 0.00 0.00 0.00 0.00 0.00 23.12 20.58 1rk7 s ALA 89 CO 0.04 -1.59 0.00 -3.47 0.00 0.00 0.00 175.76 170.75 1rk7 n ASP 90 N -3.09 0.00 -0.08 0.00 2.03 -0.83 -4.39 116.55 110.19 1rk7 n ASP 90 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 1rk7 n ASP 90 Cb 0.60 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.00 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 0.29 -0.75 -0.67 2.85 -1.26 -4.75 118.16 113.88 1rk7 n LYS 91 Ca 0.00 -0.70 -0.02 0.00 -1.05 0.00 0.00 58.31 56.54 1rk7 n LYS 91 Cb 0.00 -0.56 -0.02 0.00 -0.65 0.00 0.00 35.03 33.79 1rk7 n LYS 91 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1rk7 n ASP 92 N -0.07 -0.25 0.00 -5.58 2.03 -1.26 -4.87 116.55 106.54 1rk7 n ASP 92 Ca 0.00 -1.53 0.00 0.00 0.52 0.00 0.00 54.79 53.78 1rk7 n ASP 92 Cb 0.51 0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rk7 n GLY 93 N 0.04 2.71 3.51 0.27 0.00 -1.21 -4.17 105.19 106.35 1rk7 n GLY 93 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.02 -0.01 -3.51 1.61 0.31 -1.11 -4.30 118.33 111.31 1rk7 n VAL 94 Ca 0.00 -0.35 -0.41 0.00 -0.01 0.00 0.00 64.34 63.57 1rk7 n VAL 94 Cb 0.00 -0.69 -0.10 0.00 -0.91 0.00 0.00 33.84 32.14 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 6.16 3.50 0.19 3.52 0.00 0.39 -1.97 121.76 133.55 1rk7 s ALA 95 Ca 1.26 -1.42 -0.11 0.00 0.00 0.00 0.00 51.96 51.69 1rk7 s ALA 95 Cb -0.85 -2.71 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 1rk7 s ALA 95 CO 0.45 -1.05 0.53 0.16 0.00 0.00 0.00 175.76 175.85 1rk7 s ASP 96 N 1.72 6.67 0.19 0.00 -4.77 -1.26 0.11 116.67 119.33 1rk7 s ASP 96 Ca 0.06 0.94 0.11 0.00 -3.30 0.00 0.00 52.55 50.35 1rk7 s ASP 96 Cb -0.18 -2.23 -0.04 0.00 -1.09 0.00 0.00 42.92 39.38 1rk7 s ASP 96 CO 0.11 -0.00 -0.20 -0.69 0.70 0.00 0.00 175.17 175.08 1rk7 s VAL 97 N -1.69 2.58 -0.32 2.11 1.01 -0.18 -4.90 120.40 119.01 1rk7 s VAL 97 Ca 0.44 -1.91 -0.10 0.00 0.00 0.00 0.00 61.98 60.41 1rk7 s VAL 97 Cb -0.12 -2.24 0.19 0.00 0.00 0.00 0.00 36.38 34.20 1rk7 s VAL 97 CO 0.21 -0.10 1.06 -0.94 0.00 0.00 0.00 175.10 175.33 1rk7 s SER 98 N -2.67 -0.29 0.25 3.32 1.04 -1.07 -2.66 113.70 111.62 1rk7 s SER 98 Ca 0.21 -0.15 -0.01 0.00 0.48 0.00 0.00 55.95 56.48 1rk7 s SER 98 Cb -0.08 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 1rk7 s SER 98 CO 0.11 -0.03 0.25 -0.63 0.98 0.00 0.00 173.24 173.92 1rk7 s ILE 99 N 1.94 0.00 -0.28 -1.02 1.01 0.69 -4.99 121.20 118.55 1rk7 s ILE 99 Ca 0.15 -1.87 -0.02 0.00 0.00 0.00 0.00 60.65 58.91 1rk7 s ILE 99 Cb 0.04 -2.47 0.09 0.00 0.01 0.00 0.00 42.46 40.12 1rk7 s ILE 99 CO -0.15 0.00 0.08 -1.61 0.00 0.00 0.00 174.94 173.26 1rk7 s GLU 100 N -3.87 0.67 -0.63 2.79 8.01 -1.25 -0.90 118.70 123.52 1rk7 s GLU 100 Ca 0.36 -0.84 -0.25 0.00 0.01 0.00 0.00 54.97 54.25 1rk7 s GLU 100 Cb 0.04 -1.94 0.05 0.00 -4.31 0.00 0.00 34.13 27.97 1rk7 s GLU 100 CO 0.16 -0.89 1.04 -0.51 0.01 0.00 0.00 175.26 175.07 1rk7 s ASP 101 N 1.73 6.26 -1.34 -0.19 1.01 -0.84 -4.74 116.67 118.55 1rk7 s ASP 101 Ca 0.06 -0.54 -0.07 0.00 0.71 0.00 0.00 52.55 52.72 1rk7 s ASP 101 Cb -0.17 -2.47 0.11 0.00 1.01 0.00 0.00 42.92 41.40 1rk7 s ASP 101 CO -0.22 -1.45 2.29 -1.54 0.21 0.00 0.00 175.17 174.47 1rk7 n SER 102 N 8.04 7.21 0.12 0.27 3.41 -1.26 -0.83 113.62 130.58 1rk7 n SER 102 Ca 0.01 -3.08 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 1rk7 n SER 102 Cb 0.47 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 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 2.40 0.00 -1.76 -3.33 0.31 -1.26 -4.90 118.33 109.78 1rk7 n VAL 103 Ca 0.57 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.61 1rk7 n VAL 103 Cb 0.28 -0.01 0.09 0.00 -0.91 0.00 0.00 33.84 33.29 1rk7 n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1rk7 s ILE 104 N -1.50 2.45 0.15 2.52 -5.25 -1.26 -4.94 121.20 113.37 1rk7 s ILE 104 Ca 0.00 0.15 -0.24 0.00 -0.99 0.00 0.00 60.65 59.57 1rk7 s ILE 104 Cb 0.00 -3.05 0.07 0.00 2.95 0.00 0.00 42.46 42.43 1rk7 s ILE 104 CO 0.00 -0.19 0.68 -0.44 -1.79 0.00 0.00 174.94 173.20 1rk7 s SER 105 N -4.31 -0.48 0.25 4.36 0.01 -1.26 -4.40 113.70 107.88 1rk7 s SER 105 Ca 0.61 -0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.73 1rk7 s SER 105 Cb -0.12 0.57 0.29 0.00 0.21 0.00 0.00 66.02 66.97 1rk7 s SER 105 CO 0.51 -0.96 1.88 -0.07 0.41 0.00 0.00 173.24 175.02 1rk7 h LEU 106 N 2.00 1.05 0.00 2.44 3.38 -1.95 -0.18 115.31 122.05 1rk7 h LEU 106 Ca -0.30 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 1rk7 h LEU 106 Cb 1.29 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1rk7 h LEU 106 CO 0.34 0.84 -0.07 -1.54 0.09 0.00 0.00 178.44 178.10 1rk7 n SER 107 N -4.34 1.08 0.00 -0.43 3.41 -1.26 -3.67 113.62 108.41 1rk7 n SER 107 Ca 0.09 -1.31 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 1rk7 n SER 107 Cb 0.09 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1rk7 n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rk7 n GLY 108 N 2.08 0.80 2.08 5.00 0.00 -1.26 -3.78 105.19 110.10 1rk7 n GLY 108 Ca -0.01 -1.41 -0.17 0.00 0.00 0.00 0.00 46.02 44.43 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 1.26 4.05 0.00 1.61 9.92 -1.26 -4.47 116.55 127.67 1rk7 n ASP 109 Ca 0.00 -3.38 0.00 0.00 -0.53 0.00 0.00 54.79 50.88 1rk7 n ASP 109 Cb 0.00 -0.79 0.00 0.00 -0.64 0.00 0.00 41.12 39.69 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 -0.72 0.00 -2.61 1.24 8.25 -1.26 -5.05 115.22 115.07 1rk7 n HIS 110 Ca 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.93 1rk7 n HIS 110 Cb 1.51 0.13 -0.02 0.00 1.12 0.00 0.00 29.99 32.72 1rk7 n HIS 110 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1rk7 n SER 111 N -2.48 -4.04 0.04 0.41 3.41 -0.59 -4.90 113.62 105.47 1rk7 n SER 111 Ca 0.00 1.35 0.12 0.00 -0.26 0.00 0.00 58.87 60.08 1rk7 n SER 111 Cb 0.00 -5.17 0.13 0.00 -0.26 0.00 0.00 64.21 58.91 1rk7 n SER 111 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1rk7 n ILE 112 N 1.17 0.25 -1.45 -1.33 -5.35 -0.18 -4.87 119.36 107.60 1rk7 n ILE 112 Ca -0.21 -0.23 -0.50 0.00 -0.27 0.00 0.00 62.75 61.54 1rk7 n ILE 112 Cb 0.33 0.03 -0.07 0.00 -1.74 0.00 0.00 39.64 38.18 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1rk7 n ILE 113 N -1.99 0.16 0.00 7.28 2.08 -1.26 -1.81 119.36 123.83 1rk7 n ILE 113 Ca 0.03 -0.27 0.00 0.00 0.56 0.00 0.00 62.75 63.07 1rk7 n ILE 113 Cb 0.43 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.68 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 6.54 1.56 3.09 7.39 0.00 -1.26 -5.02 105.19 117.49 1rk7 n GLY 114 Ca 0.42 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.21 3.08 -0.48 1.61 1.81 -0.75 -4.93 118.95 119.08 1rk7 s ARG 115 Ca 0.00 -3.15 -0.43 0.00 -1.72 0.00 0.00 55.73 50.42 1rk7 s ARG 115 Cb 0.00 -3.87 -0.18 0.00 -0.45 0.00 0.00 34.95 30.45 1rk7 s ARG 115 CO 0.00 -1.25 2.05 2.41 -0.68 0.00 0.00 175.30 177.83 1rk7 n THR 116 N 2.50 0.03 -2.42 0.02 -1.04 -1.26 -4.21 114.28 107.91 1rk7 n THR 116 Ca 0.19 -0.03 -0.38 0.00 -2.04 0.00 0.00 64.05 61.79 1rk7 n THR 116 Cb 0.37 -0.65 -0.03 0.00 -1.82 0.00 0.00 70.33 68.20 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1rk7 s LEU 117 N 5.61 3.49 0.56 -4.42 2.01 -1.26 -4.23 118.68 120.44 1rk7 s LEU 117 Ca 1.16 -1.63 -0.14 0.00 0.01 0.00 0.00 54.13 53.52 1rk7 s LEU 117 Cb -1.42 -2.57 -0.06 0.00 0.01 0.00 0.00 46.19 42.15 1rk7 s LEU 117 CO 0.67 -1.82 1.01 -0.69 1.01 0.00 0.00 176.35 176.52 1rk7 s VAL 118 N 6.39 4.56 0.00 -1.59 1.01 -1.26 -4.06 120.40 125.45 1rk7 s VAL 118 Ca 0.55 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1rk7 s VAL 118 Cb -0.00 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1rk7 s VAL 118 CO -0.00 -0.86 0.00 0.52 0.00 0.00 0.00 175.10 174.75 1rk7 n VAL 119 N -2.09 0.00 -3.66 2.92 0.31 -1.26 -2.48 118.33 112.07 1rk7 n VAL 119 Ca 0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.33 1rk7 n VAL 119 Cb 0.54 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.39 1rk7 n VAL 119 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1rk7 s HIS 120 N 2.77 -0.96 0.18 3.52 -3.43 -1.26 -3.84 115.29 112.27 1rk7 s HIS 120 Ca 0.00 1.83 0.35 0.00 -0.80 0.00 0.00 55.06 56.44 1rk7 s HIS 120 Cb 0.00 0.51 1.65 0.00 -1.43 0.00 0.00 32.58 33.31 1rk7 s HIS 120 CO 0.00 -0.51 2.05 1.49 -2.00 0.00 0.00 174.74 175.77 1rk7 h GLU 121 N 7.61 0.00 0.00 -0.38 4.81 -1.51 -3.47 114.58 121.65 1rk7 h GLU 121 Ca -0.24 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.06 1rk7 h GLU 121 Cb 1.15 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1rk7 h GLU 121 CO 0.16 0.00 0.19 1.17 -0.73 0.00 0.00 179.01 179.80 1rk7 n LYS 122 N -2.91 0.01 -3.20 1.92 4.81 -1.25 -5.01 118.16 112.53 1rk7 n LYS 122 Ca -0.01 -0.11 -0.40 0.00 -0.87 0.00 0.00 58.31 56.93 1rk7 n LYS 122 Cb 0.20 0.20 -0.07 0.00 0.02 0.00 0.00 35.03 35.38 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rk7 s ALA 123 N -1.19 3.57 -0.90 3.14 0.00 -1.26 -3.79 121.76 121.33 1rk7 s ALA 123 Ca 0.06 -0.45 0.13 0.00 0.00 0.00 0.00 51.96 51.70 1rk7 s ALA 123 Cb -0.00 -2.90 0.56 0.00 0.00 0.00 0.00 23.12 20.78 1rk7 s ALA 123 CO -0.00 -0.62 1.41 -0.25 0.00 0.00 0.00 175.76 176.30 1rk7 n ASP 124 N 5.22 0.11 -2.79 0.00 8.00 -1.26 -4.82 116.55 121.00 1rk7 n ASP 124 Ca -0.03 0.53 -0.18 0.00 0.71 0.00 0.00 54.79 55.82 1rk7 n ASP 124 Cb 0.50 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1rk7 n ASP 125 N -1.62 -4.40 -1.35 -2.24 8.00 -1.26 0.11 116.55 113.78 1rk7 n ASP 125 Ca 0.02 -0.07 -0.15 0.00 0.71 0.00 0.00 54.79 55.31 1rk7 n ASP 125 Cb 0.14 -3.67 -0.06 0.00 -0.02 0.00 0.00 41.12 37.51 1rk7 n ASP 125 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1rk7 n LEU 126 N -3.28 -1.02 -0.02 0.64 4.77 -1.26 -4.36 117.00 112.47 1rk7 n LEU 126 Ca -0.11 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1rk7 n LEU 126 Cb 0.60 -2.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.39 1rk7 n LEU 126 CO 0.33 -0.84 0.00 0.61 -1.33 0.00 0.00 177.39 176.16 1rk7 n GLY 127 N -0.21 0.95 0.00 -0.72 0.00 0.29 -5.02 105.19 100.48 1rk7 n GLY 127 Ca -0.15 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 2.55 0.00 -1.36 1.61 5.02 -1.25 -4.75 118.16 119.98 1rk7 n LYS 128 Ca 0.00 0.40 0.01 0.00 -2.02 0.00 0.00 58.31 56.70 1rk7 n LYS 128 Cb 0.00 -1.10 -0.00 0.00 -0.02 0.00 0.00 35.03 33.91 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 0.90 0.87 2.16 0.72 0.00 -1.26 -5.09 105.19 103.50 1rk7 n GLY 129 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 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 0.37 -5.15 3.12 -0.02 0.00 -1.26 -5.06 105.19 97.20 1rk7 n GLY 130 Ca -0.02 0.37 -0.10 0.00 0.00 0.00 0.00 46.02 46.26 1rk7 n GLY 130 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rk7 s ASN 131 N -0.50 0.11 0.52 1.61 3.84 -1.26 -4.81 114.94 114.45 1rk7 s ASN 131 Ca -0.07 -0.41 0.41 0.00 0.21 0.00 0.00 52.86 53.00 1rk7 s ASN 131 Cb 0.00 0.23 1.40 0.00 -0.55 0.00 0.00 41.25 42.33 1rk7 s ASN 131 CO 0.18 -0.48 1.36 -0.62 -2.79 0.00 0.00 177.10 174.76 1rk7 n GLU 132 N 0.95 0.00 -0.07 0.43 1.02 -1.26 0.32 120.64 122.04 1rk7 n GLU 132 Ca -0.20 0.97 -0.22 0.00 -0.02 0.00 0.00 57.16 57.69 1rk7 n GLU 132 Cb 0.58 -2.29 -0.12 0.00 -0.02 0.00 0.00 31.44 29.59 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1rk7 h GLN 133 N 0.00 0.09 -0.02 3.49 4.15 -1.96 -3.38 115.11 117.48 1rk7 h GLN 133 Ca 0.76 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 60.02 1rk7 h GLN 133 Cb 3.27 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 31.01 1rk7 h GLN 133 CO -0.01 1.07 -0.03 1.03 -1.93 0.00 0.00 178.83 178.97 1rk7 h SER 134 N -0.65 0.06 -1.57 -0.69 0.87 0.16 0.84 113.55 112.57 1rk7 h SER 134 Ca -0.37 -0.51 0.47 0.00 -1.23 0.00 0.00 61.79 60.14 1rk7 h SER 134 Cb 1.55 -0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 63.41 1rk7 h SER 134 CO -0.11 0.56 1.11 0.35 -0.53 0.00 0.00 176.83 178.20 1rk7 n THR 135 N -4.80 -0.06 -0.08 2.23 -2.24 0.97 0.68 114.28 110.98 1rk7 n THR 135 Ca -0.08 1.35 -0.11 0.00 -2.27 0.00 0.00 64.05 62.93 1rk7 n THR 135 Cb 0.28 -2.24 -0.08 0.00 -2.10 0.00 0.00 70.33 66.19 1rk7 n THR 135 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1rk7 n LYS 136 N -3.84 0.54 0.00 -0.78 2.85 -1.15 -2.31 118.16 113.47 1rk7 n LYS 136 Ca 0.37 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.72 1rk7 n LYS 136 Cb 1.64 -1.34 0.00 0.00 -0.65 0.00 0.00 35.03 34.67 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 -2.96 0.00 -2.66 0.58 -2.24 0.29 -3.83 114.28 103.46 1rk7 n THR 137 Ca -0.30 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.44 1rk7 n THR 137 Cb 0.83 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 69.15 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 2.63 0.90 2.95 3.38 0.00 -1.19 -4.35 105.19 109.52 1rk7 n GLY 138 Ca 0.00 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.80 -3.78 -0.94 1.61 5.15 -1.26 -4.53 115.26 110.72 1rk7 n ASN 139 Ca -0.12 -0.12 -0.02 0.00 -0.60 0.00 0.00 54.58 53.73 1rk7 n ASN 139 Cb 0.78 -3.16 -0.02 0.00 -0.53 0.00 0.00 39.78 36.85 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 -2.97 2.74 -2.57 5.20 0.00 -1.26 -5.03 120.51 116.62 1rk7 n ALA 140 Ca -0.07 -1.01 -0.41 0.00 0.00 0.00 0.00 53.44 51.95 1rk7 n ALA 140 Cb 0.57 -0.39 -0.03 0.00 0.00 0.00 0.00 19.45 19.60 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 -1.03 1.11 -0.06 0.00 0.00 -1.26 -3.24 107.32 102.84 1rk7 s GLY 141 Ca 0.09 -1.88 -0.15 0.00 0.00 0.00 0.00 44.72 42.78 1rk7 s GLY 141 CO -0.04 2.65 0.34 -0.45 0.00 0.00 0.00 173.10 175.60 1rk7 s SER 142 N 4.40 -0.28 -0.07 1.64 0.15 -1.26 -4.44 113.70 113.83 1rk7 s SER 142 Ca 0.41 0.36 -0.15 0.00 0.70 0.00 0.00 55.95 57.27 1rk7 s SER 142 Cb -0.04 0.49 -0.05 0.00 -1.71 0.00 0.00 66.02 64.71 1rk7 s SER 142 CO 0.01 -0.33 0.37 -0.13 1.20 0.00 0.00 173.24 174.37 1rk7 s ARG 143 N -0.73 4.05 -0.02 5.44 0.52 -1.26 -2.99 118.95 123.97 1rk7 s ARG 143 Ca -0.08 0.30 0.02 0.00 -0.52 0.00 0.00 55.73 55.45 1rk7 s ARG 143 Cb -0.04 -3.31 0.04 0.00 0.52 0.00 0.00 34.95 32.16 1rk7 s ARG 143 CO 0.03 0.48 0.85 1.28 0.02 0.00 0.00 175.30 177.96 1rk7 n LEU 144 N 2.63 1.14 -3.53 2.53 4.77 -1.26 -4.93 117.00 118.36 1rk7 n LEU 144 Ca -0.13 -1.35 -0.08 0.00 -0.03 0.00 0.00 56.01 54.43 1rk7 n LEU 144 Cb 0.52 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 1rk7 n LEU 144 CO 0.39 0.33 0.66 0.00 -1.33 0.00 0.00 177.39 177.44 1rk7 s ALA 145 N -0.79 -1.78 -0.45 -1.18 0.00 -1.26 -0.71 121.76 115.60 1rk7 s ALA 145 Ca 0.04 0.84 0.07 0.00 0.00 0.00 0.00 51.96 52.91 1rk7 s ALA 145 Cb 0.04 0.49 0.28 0.00 0.00 0.00 0.00 23.12 23.93 1rk7 s ALA 145 CO 0.00 -0.74 0.88 0.00 0.00 0.00 0.00 175.76 175.90 1rk7 h GLY 147 N 3.55 1.19 -3.25 0.00 0.00 -1.75 -3.44 103.07 99.37 1rk7 h GLY 147 Ca -0.06 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1rk7 h GLY 147 CO 0.31 0.44 -0.82 -0.62 0.00 0.00 0.00 176.54 175.85 1rk7 n VAL 148 N -4.49 -3.59 -2.92 4.60 0.31 -1.26 -3.81 118.33 107.16 1rk7 n VAL 148 Ca 0.09 1.67 -0.41 0.00 -0.01 0.00 0.00 64.34 65.68 1rk7 n VAL 148 Cb 0.01 -2.49 -0.04 0.00 -0.91 0.00 0.00 33.84 30.42 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 -4.33 4.95 -0.18 2.52 -1.09 -1.26 -3.83 121.20 117.98 1rk7 s ILE 149 Ca 0.00 1.63 -0.03 0.00 -2.23 0.00 0.00 60.65 60.02 1rk7 s ILE 149 Cb 0.00 -4.13 0.06 0.00 -1.58 0.00 0.00 42.46 36.81 1rk7 s ILE 149 CO 0.00 0.14 0.04 -0.83 -1.23 0.00 0.00 174.94 173.06 1rk7 s GLY 150 N 0.98 0.63 0.07 6.18 0.00 -0.54 -4.00 107.32 110.65 1rk7 s GLY 150 Ca 0.40 -0.58 -0.36 0.00 0.00 0.00 0.00 44.72 44.18 1rk7 s GLY 150 CO 0.18 1.43 0.96 1.39 0.00 0.00 0.00 173.10 177.06 1rk7 n ILE 151 N 5.09 0.55 -2.51 0.90 2.08 -1.26 -2.29 119.36 121.92 1rk7 n ILE 151 Ca -0.08 -0.14 -0.23 0.00 0.56 0.00 0.00 62.75 62.86 1rk7 n ILE 151 Cb 0.48 -0.12 0.05 0.00 -0.75 0.00 0.00 39.64 39.29 1rk7 n ILE 151 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rk7 s ALA 152 N -0.22 3.67 -0.44 -1.39 0.00 -0.48 -4.85 121.76 118.05 1rk7 s ALA 152 Ca 0.83 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1rk7 s ALA 152 Cb -1.13 -2.22 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1rk7 s ALA 152 CO 0.56 -0.95 0.11 0.94 0.00 0.00 0.00 175.76 176.42