#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 -0.61 -0.09 0.00 2.01 -1.25 -5.07 115.64 110.62 1rk7 s THR 2 Ca 0.00 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.51 1rk7 s THR 2 Cb 0.00 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.98 1rk7 s THR 2 CO 0.00 -0.33 -0.22 -0.75 -0.69 0.00 0.00 174.62 172.63 1rk7 s LYS 3 N 1.80 2.76 0.23 4.92 2.20 -1.26 -2.21 119.74 128.19 1rk7 s LYS 3 Ca 0.15 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 55.00 1rk7 s LYS 3 Cb -0.11 -2.13 -0.03 0.00 -1.51 0.00 0.00 37.83 34.04 1rk7 s LYS 3 CO -0.10 0.18 0.33 0.00 -0.36 0.00 0.00 175.35 175.40 1rk7 s ALA 4 N 0.33 3.90 0.03 3.13 0.00 0.11 0.64 121.76 129.91 1rk7 s ALA 4 Ca -0.16 -1.22 -0.01 0.00 0.00 0.00 0.00 51.96 50.57 1rk7 s ALA 4 Cb -0.17 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 1rk7 s ALA 4 CO 0.07 0.29 -0.00 0.08 0.00 0.00 0.00 175.76 176.20 1rk7 s VAL 5 N -1.96 0.15 -0.37 0.00 1.01 -0.22 0.12 120.40 119.14 1rk7 s VAL 5 Ca 0.34 -1.22 0.05 0.00 0.00 0.00 0.00 61.98 61.14 1rk7 s VAL 5 Cb -0.09 -0.78 0.17 0.00 0.00 0.00 0.00 36.38 35.68 1rk7 s VAL 5 CO 0.29 -0.67 0.47 0.00 0.00 0.00 0.00 175.10 175.18 1rk7 s ALA 6 N -2.44 -1.20 -0.97 5.51 0.00 0.25 -2.15 121.76 120.76 1rk7 s ALA 6 Ca -0.07 -0.41 -0.23 0.00 0.00 0.00 0.00 51.96 51.25 1rk7 s ALA 6 Cb -0.03 -2.29 0.06 0.00 0.00 0.00 0.00 23.12 20.86 1rk7 s ALA 6 CO -0.04 -2.12 1.37 0.54 0.00 0.00 0.00 175.76 175.51 1rk7 s VAL 7 N 1.72 4.03 -0.17 0.00 0.11 -1.26 -2.31 120.40 122.51 1rk7 s VAL 7 Ca 0.16 -0.76 -0.41 0.00 -2.93 0.00 0.00 61.98 58.04 1rk7 s VAL 7 Cb -0.11 -5.00 -0.19 0.00 -1.53 0.00 0.00 36.38 29.55 1rk7 s VAL 7 CO -0.08 -1.86 1.20 0.18 -3.33 0.00 0.00 175.10 171.22 1rk7 n LEU 8 N 8.56 0.41 0.11 2.54 7.99 -0.58 -4.71 117.00 131.32 1rk7 n LEU 8 Ca 0.28 1.12 -0.19 0.00 -0.01 0.00 0.00 56.01 57.20 1rk7 n LEU 8 Cb 0.50 -0.86 -0.13 0.00 -0.11 0.00 0.00 43.42 42.82 1rk7 n LEU 8 CO 0.64 -1.45 -0.07 0.50 -1.51 0.00 0.00 177.39 175.50 1rk7 h LYS 9 N 3.55 0.43 -4.40 3.23 1.63 -1.84 -3.38 116.57 115.79 1rk7 h LYS 9 Ca -0.46 -0.66 0.00 0.00 -0.85 0.00 0.00 60.65 58.68 1rk7 h LYS 9 Cb 1.34 0.23 0.00 0.00 -0.60 0.00 0.00 32.23 33.21 1rk7 h LYS 9 CO 0.73 1.30 -0.98 0.41 -3.45 0.00 0.00 179.45 177.46 1rk7 n GLY 10 N 1.47 -5.25 0.60 5.01 0.00 -1.23 -4.45 105.19 101.34 1rk7 n GLY 10 Ca -0.11 -0.25 0.46 0.00 0.00 0.00 0.00 46.02 46.11 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 1.54 0.04 0.08 1.61 -0.08 -1.26 -4.46 116.55 114.02 1rk7 n ASP 11 Ca 0.00 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.26 1rk7 n ASP 11 Cb 0.00 -0.49 0.00 0.00 2.34 0.00 0.00 41.12 42.97 1rk7 n ASP 11 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rk7 n GLY 12 N -1.75 -1.77 0.16 0.27 0.00 -1.26 -5.01 105.19 95.83 1rk7 n GLY 12 Ca 0.40 0.53 -0.06 0.00 0.00 0.00 0.00 46.02 46.88 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 -0.30 -5.14 1.61 0.13 -1.90 -3.46 132.00 122.94 1rk7 h PRO 13 Ca 0.00 0.02 -0.56 0.00 -0.87 0.00 0.00 66.00 64.59 1rk7 h PRO 13 Cb 0.00 0.07 0.11 0.00 0.13 0.00 0.00 31.00 31.31 1rk7 h PRO 13 CO 0.00 -0.12 -0.57 0.28 -0.23 0.00 0.00 178.00 177.35 1rk7 n VAL 14 N -4.98 1.33 -2.62 1.56 0.31 -1.24 -4.66 118.33 108.03 1rk7 n VAL 14 Ca -0.05 -0.43 -0.02 0.00 -0.01 0.00 0.00 64.34 63.83 1rk7 n VAL 14 Cb 0.16 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.15 1rk7 n VAL 14 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1rk7 n GLN 15 N 0.95 0.73 -0.47 5.55 0.00 0.94 -3.53 117.38 121.55 1rk7 n GLN 15 Ca 0.13 -0.82 -0.28 0.00 -0.00 0.00 0.00 57.00 56.03 1rk7 n GLN 15 Cb 0.26 0.16 0.26 0.00 0.00 0.00 0.00 30.24 30.92 1rk7 n GLN 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1rk7 n GLY 16 N -0.77 -2.12 2.58 1.69 0.00 -1.26 -4.47 105.19 100.84 1rk7 n GLY 16 Ca -0.12 -1.18 -0.26 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.38 -0.11 -0.06 -0.61 -1.09 0.34 -1.52 121.20 115.77 1rk7 s ILE 17 Ca 0.68 -0.85 0.03 0.00 -2.23 0.00 0.00 60.65 58.29 1rk7 s ILE 17 Cb -0.25 -0.99 -0.02 0.00 -1.58 0.00 0.00 42.46 39.62 1rk7 s ILE 17 CO 0.66 -0.71 -0.14 -0.51 -1.23 0.00 0.00 174.94 173.00 1rk7 s ILE 18 N 1.99 3.06 0.01 2.92 1.10 -0.98 -1.12 121.20 128.18 1rk7 s ILE 18 Ca 0.11 -0.72 -0.02 0.00 -0.51 0.00 0.00 60.65 59.51 1rk7 s ILE 18 Cb -0.17 -2.21 -0.01 0.00 0.15 0.00 0.00 42.46 40.23 1rk7 s ILE 18 CO -0.30 0.58 0.02 0.20 -2.11 0.00 0.00 174.94 173.33 1rk7 s ASN 19 N -0.61 0.17 -0.09 4.50 0.01 -0.68 0.86 114.94 119.11 1rk7 s ASN 19 Ca 0.09 -0.39 -0.01 0.00 -0.71 0.00 0.00 52.86 51.83 1rk7 s ASN 19 Cb -0.11 0.13 -0.03 0.00 0.41 0.00 0.00 41.25 41.65 1rk7 s ASN 19 CO 0.01 -0.31 -0.03 -0.36 -1.51 0.00 0.00 177.10 174.90 1rk7 s PHE 20 N -1.37 3.04 -0.10 2.20 0.40 0.33 -2.30 117.98 120.19 1rk7 s PHE 20 Ca -0.15 0.04 0.04 0.00 -0.60 0.00 0.00 56.93 56.26 1rk7 s PHE 20 Cb -0.09 -1.79 -0.00 0.00 0.51 0.00 0.00 43.02 41.65 1rk7 s PHE 20 CO -0.00 0.32 -0.24 -2.00 0.70 0.00 0.00 175.22 174.01 1rk7 s GLU 21 N -0.63 3.03 -0.42 0.44 2.56 -0.62 0.09 118.70 123.15 1rk7 s GLU 21 Ca 0.10 -0.87 0.08 0.00 0.00 0.00 0.00 54.97 54.28 1rk7 s GLU 21 Cb -0.12 -2.31 0.29 0.00 2.00 0.00 0.00 34.13 33.99 1rk7 s GLU 21 CO 0.02 0.20 0.76 0.94 -0.56 0.00 0.00 175.26 176.62 1rk7 n GLN 22 N 3.47 0.85 -0.98 4.30 7.27 -0.94 0.19 117.38 131.54 1rk7 n GLN 22 Ca -0.19 -2.71 -0.26 0.00 0.07 0.00 0.00 57.00 53.91 1rk7 n GLN 22 Cb 0.53 -1.37 -0.05 0.00 2.41 0.00 0.00 30.24 31.76 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 0.99 2.61 0.00 3.69 5.02 -1.26 -2.88 118.16 126.34 1rk7 n LYS 23 Ca 0.17 -1.59 0.00 0.00 -2.02 0.00 0.00 58.31 54.87 1rk7 n LYS 23 Cb 0.61 -2.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.17 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 3.55 0.00 0.00 1.97 -0.58 -1.26 -5.00 120.64 119.32 1rk7 n GLU 24 Ca 0.56 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 1rk7 n GLU 24 Cb 0.32 -0.06 0.00 0.00 -0.57 0.00 0.00 31.44 31.13 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 -1.99 0.00 -0.83 1.62 2.88 -1.14 -4.57 113.62 109.59 1rk7 n SER 25 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 1rk7 n SER 25 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 1rk7 n SER 25 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1rk7 n ASN 26 N 0.00 -0.46 0.00 -3.46 2.85 -1.26 -5.01 115.26 107.91 1rk7 n ASN 26 Ca 0.00 -1.64 0.00 0.00 -0.11 0.00 0.00 54.58 52.83 1rk7 n ASN 26 Cb 0.00 0.13 0.00 0.00 1.24 0.00 0.00 39.78 41.15 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rk7 n GLY 27 N 0.03 5.80 3.78 8.20 0.00 -1.26 -5.09 105.19 116.65 1rk7 n GLY 27 Ca -0.14 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.72 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 1.71 4.08 -0.78 1.61 0.04 -1.26 -4.64 135.00 135.76 1rk7 s PRO 28 Ca 0.00 1.49 -0.07 0.00 0.04 0.00 0.00 61.00 62.46 1rk7 s PRO 28 Cb 0.00 -2.44 0.20 0.00 0.04 0.00 0.00 34.50 32.30 1rk7 s PRO 28 CO 0.00 -0.21 0.66 0.08 0.04 0.00 0.00 177.00 177.56 1rk7 s VAL 29 N -1.72 4.65 -0.75 -0.36 1.01 0.12 -4.53 120.40 118.81 1rk7 s VAL 29 Ca 0.60 -2.98 -0.26 0.00 0.00 0.00 0.00 61.98 59.34 1rk7 s VAL 29 Cb -0.21 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 1rk7 s VAL 29 CO 0.26 -0.99 2.22 -0.54 0.00 0.00 0.00 175.10 176.05 1rk7 s LYS 30 N -0.29 2.07 -0.08 2.72 1.02 0.13 -4.22 119.74 121.09 1rk7 s LYS 30 Ca 0.20 0.45 -0.12 0.00 0.02 0.00 0.00 55.97 56.52 1rk7 s LYS 30 Cb -0.14 -4.78 -0.05 0.00 -0.52 0.00 0.00 37.83 32.34 1rk7 s LYS 30 CO -0.07 -3.75 0.29 0.08 -0.92 0.00 0.00 175.35 170.98 1rk7 s VAL 31 N 12.38 5.26 -0.15 3.17 1.01 -0.95 -1.59 120.40 139.52 1rk7 s VAL 31 Ca 0.84 0.56 -0.28 0.00 0.00 0.00 0.00 61.98 63.10 1rk7 s VAL 31 Cb -0.12 -3.59 0.07 0.00 0.00 0.00 0.00 36.38 32.74 1rk7 s VAL 31 CO 0.10 0.55 0.71 -1.66 0.00 0.00 0.00 175.10 174.79 1rk7 s TRP 32 N -0.68 -0.71 0.14 5.22 -2.14 -0.97 -1.88 118.94 117.91 1rk7 s TRP 32 Ca 0.19 1.48 -0.04 0.00 2.66 0.00 0.00 56.10 60.39 1rk7 s TRP 32 Cb -0.14 0.35 0.02 0.00 -3.10 0.00 0.00 33.47 30.59 1rk7 s TRP 32 CO 0.08 -0.50 0.26 0.41 -2.66 0.00 0.00 176.95 174.54 1rk7 n GLY 33 N 1.71 1.83 3.50 3.67 0.00 -1.11 -1.68 105.19 113.12 1rk7 n GLY 33 Ca -0.17 -1.16 -0.05 0.00 0.00 0.00 0.00 46.02 44.64 1rk7 n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rk7 s SER 34 N -1.74 -0.80 0.60 1.61 0.15 -0.27 -2.09 113.70 111.16 1rk7 s SER 34 Ca 0.06 1.33 -0.07 0.00 0.70 0.00 0.00 55.95 57.97 1rk7 s SER 34 Cb -0.01 1.67 -0.00 0.00 -1.71 0.00 0.00 66.02 65.96 1rk7 s SER 34 CO 0.05 -0.22 0.94 -0.63 1.20 0.00 0.00 173.24 174.57 1rk7 s ILE 35 N 2.36 3.90 -0.28 6.45 1.01 0.36 0.13 121.20 135.13 1rk7 s ILE 35 Ca -0.06 0.22 -0.00 0.00 0.00 0.00 0.00 60.65 60.80 1rk7 s ILE 35 Cb -0.10 -3.56 0.18 0.00 0.01 0.00 0.00 42.46 38.99 1rk7 s ILE 35 CO -0.17 -0.62 0.53 -0.54 0.00 0.00 0.00 174.94 174.14 1rk7 s LYS 36 N -5.05 0.51 0.00 2.79 1.02 -1.26 -3.43 119.74 114.31 1rk7 s LYS 36 Ca 0.54 0.79 0.00 0.00 0.02 0.00 0.00 55.97 57.32 1rk7 s LYS 36 Cb -0.11 0.22 0.00 0.00 -0.52 0.00 0.00 37.83 37.42 1rk7 s LYS 36 CO 0.47 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 1rk7 n GLY 37 N 5.41 3.21 0.01 -3.33 0.00 -1.26 -0.04 105.19 109.19 1rk7 n GLY 37 Ca -0.01 -0.47 -0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.01 0.99 4.32 -1.26 -4.83 117.00 112.21 1rk7 n LEU 38 Ca 0.00 -0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.85 1rk7 n LEU 38 Cb 0.00 -0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 41.67 1rk7 n LEU 38 CO 0.00 -1.34 -0.40 0.42 -1.22 0.00 0.00 177.39 174.85 1rk7 s THR 39 N -0.68 0.45 -0.09 -5.08 -4.23 -1.26 -3.38 115.64 101.37 1rk7 s THR 39 Ca 0.00 -0.69 -0.37 0.00 -1.18 0.00 0.00 61.69 59.46 1rk7 s THR 39 Cb -0.00 -0.47 -0.18 0.00 1.34 0.00 0.00 72.50 73.19 1rk7 s THR 39 CO 0.00 -0.17 1.04 -1.84 -0.54 0.00 0.00 174.62 173.11 1rk7 n GLU 40 N 2.13 0.00 0.00 3.99 0.28 -1.26 -4.36 120.64 121.42 1rk7 n GLU 40 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 1rk7 n GLU 40 Cb 0.56 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 32.10 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 1.77 -0.05 4.01 -1.84 0.00 -1.26 -4.91 105.19 102.92 1rk7 n GLY 41 Ca 0.20 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rk7 s LEU 42 N 0.00 3.10 -0.24 0.99 1.02 -1.26 -2.48 118.68 119.81 1rk7 s LEU 42 Ca 0.00 -0.59 -0.04 0.00 0.02 0.00 0.00 54.13 53.52 1rk7 s LEU 42 Cb 0.00 -1.89 0.13 0.00 0.02 0.00 0.00 46.19 44.44 1rk7 s LEU 42 CO 0.00 -1.51 0.44 -1.00 0.02 0.00 0.00 176.35 174.30 1rk7 s HIS 43 N -2.84 -0.96 -0.48 0.29 3.76 0.42 -4.59 115.29 110.89 1rk7 s HIS 43 Ca 0.63 1.28 -0.26 0.00 -0.15 0.00 0.00 55.06 56.56 1rk7 s HIS 43 Cb -0.06 0.24 -0.06 0.00 1.11 0.00 0.00 32.58 33.81 1rk7 s HIS 43 CO 0.41 -0.66 2.27 0.20 -0.85 0.00 0.00 174.74 176.11 1rk7 s GLY 44 N 2.63 -0.20 -1.55 -2.22 0.00 -1.26 0.11 107.32 104.83 1rk7 s GLY 44 Ca 0.08 -0.03 -0.10 0.00 0.00 0.00 0.00 44.72 44.67 1rk7 s GLY 44 CO -0.16 3.95 2.75 0.33 0.00 0.00 0.00 173.10 179.98 1rk7 n PHE 45 N 14.78 2.62 -0.38 1.90 7.35 -1.16 -3.80 117.46 138.76 1rk7 n PHE 45 Ca 0.33 -3.04 -0.29 0.00 -0.76 0.00 0.00 57.45 53.69 1rk7 n PHE 45 Cb 0.53 -2.40 0.28 0.00 0.35 0.00 0.00 39.48 38.24 1rk7 n PHE 45 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1rk7 s HIS 46 N 1.81 0.12 -0.43 -5.13 3.76 -1.26 -3.81 115.29 110.34 1rk7 s HIS 46 Ca 0.64 0.83 0.08 0.00 -0.15 0.00 0.00 55.06 56.46 1rk7 s HIS 46 Cb 0.17 -2.94 0.33 0.00 1.11 0.00 0.00 32.58 31.25 1rk7 s HIS 46 CO -0.07 -4.66 1.00 0.28 -0.85 0.00 0.00 174.74 170.44 1rk7 n VAL 47 N -5.44 -0.05 -0.43 -0.90 0.31 -1.26 -4.61 118.33 105.95 1rk7 n VAL 47 Ca 0.08 -2.38 0.05 0.00 -0.01 0.00 0.00 64.34 62.08 1rk7 n VAL 47 Cb 0.58 0.98 -0.02 0.00 -0.91 0.00 0.00 33.84 34.46 1rk7 n VAL 47 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1rk7 n HIS 48 N 0.37 -1.12 -3.83 3.52 8.25 -1.17 -3.08 115.22 118.17 1rk7 n HIS 48 Ca 0.11 0.59 -0.07 0.00 -0.26 0.00 0.00 57.72 58.09 1rk7 n HIS 48 Cb 0.69 -1.02 0.02 0.00 1.12 0.00 0.00 29.99 30.80 1rk7 n HIS 48 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 1rk7 s GLU 49 N -2.50 2.03 0.63 -0.41 -1.05 -1.26 -3.88 118.70 112.27 1rk7 s GLU 49 Ca 0.00 -1.32 -0.17 0.00 -0.15 0.00 0.00 54.97 53.33 1rk7 s GLU 49 Cb 0.00 0.56 -0.01 0.00 -0.44 0.00 0.00 34.13 34.24 1rk7 s GLU 49 CO 0.00 -0.95 1.19 -2.00 0.95 0.00 0.00 175.26 174.45 1rk7 s GLU 50 N -2.19 2.76 0.00 -4.83 2.12 -1.26 -4.78 118.70 110.52 1rk7 s GLU 50 Ca 0.17 1.75 0.00 0.00 0.36 0.00 0.00 54.97 57.26 1rk7 s GLU 50 Cb -0.04 -1.91 0.00 0.00 0.26 0.00 0.00 34.13 32.44 1rk7 s GLU 50 CO 0.10 -1.35 0.00 0.39 -0.54 0.00 0.00 175.26 173.86 1rk7 n GLU 51 N -1.96 0.00 -2.65 4.30 1.02 -1.26 -5.01 120.64 115.09 1rk7 n GLU 51 Ca 0.13 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.20 1rk7 n GLU 51 Cb 0.50 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.95 1rk7 n GLU 51 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1rk7 n ASP 52 N -2.20 -2.69 -0.56 1.62 -0.08 -1.26 -3.85 116.55 107.54 1rk7 n ASP 52 Ca 0.00 -0.19 0.00 0.00 -1.51 0.00 0.00 54.79 53.09 1rk7 n ASP 52 Cb 0.00 -2.01 0.00 0.00 2.34 0.00 0.00 41.12 41.45 1rk7 n ASP 52 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1rk7 n ASN 53 N -0.90 -1.79 -0.10 1.67 2.85 -1.26 -4.99 115.26 110.74 1rk7 n ASN 53 Ca -0.05 0.00 -0.18 0.00 -0.11 0.00 0.00 54.58 54.24 1rk7 n ASN 53 Cb 0.54 -0.45 -0.13 0.00 1.24 0.00 0.00 39.78 40.98 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1rk7 n THR 54 N -1.89 1.55 -1.94 -0.44 5.66 -1.25 -5.10 114.28 110.87 1rk7 n THR 54 Ca 0.00 -0.61 0.00 0.00 -3.05 0.00 0.00 64.05 60.39 1rk7 n THR 54 Cb 0.45 -1.42 0.00 0.00 -1.55 0.00 0.00 70.33 67.81 1rk7 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rk7 n ALA 55 N -3.16 -2.20 -0.03 1.79 0.00 -1.26 -5.02 120.51 110.62 1rk7 n ALA 55 Ca -0.42 0.40 -0.05 0.00 0.00 0.00 0.00 53.44 53.37 1rk7 n ALA 55 Cb 1.01 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 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 1.54 -0.09 2.08 0.00 0.00 -1.26 -5.01 105.19 102.45 1rk7 n GLY 56 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1rk7 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk7 n THR 58 N -2.96 0.00 -2.35 0.00 -2.24 -1.26 -5.12 114.28 100.35 1rk7 n THR 58 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1rk7 n THR 58 Cb 0.00 -0.77 -0.01 0.00 -2.10 0.00 0.00 70.33 67.45 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 -2.62 -4.57 0.04 3.42 7.64 -1.26 -5.03 113.62 111.25 1rk7 n SER 59 Ca 0.00 1.02 0.00 0.00 1.01 0.00 0.00 58.87 60.90 1rk7 n SER 59 Cb 0.14 -4.12 0.00 0.00 -1.01 0.00 0.00 64.21 59.22 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 0.74 3.00 -3.41 -0.43 0.00 -1.26 -5.03 120.51 114.12 1rk7 n ALA 60 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.10 1rk7 n ALA 60 Cb 0.15 0.11 -0.10 0.00 0.00 0.00 0.00 19.45 19.61 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 -3.85 0.55 0.21 0.00 0.00 -1.26 -5.13 107.32 97.84 1rk7 s GLY 61 Ca 0.00 -1.59 -0.30 0.00 0.00 0.00 0.00 44.72 42.84 1rk7 s GLY 61 CO 0.00 2.34 1.11 2.56 0.00 0.00 0.00 173.10 179.11 1rk7 s PRO 62 N 1.12 4.60 0.00 2.90 0.04 -1.26 -4.92 135.00 137.48 1rk7 s PRO 62 Ca 0.19 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1rk7 s PRO 62 Cb -0.18 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1rk7 s PRO 62 CO -0.02 0.11 0.00 1.58 0.04 0.00 0.00 177.00 178.71 1rk7 n HIS 63 N 2.00 0.00 -0.85 0.56 -0.00 -1.26 -4.97 115.22 110.71 1rk7 n HIS 63 Ca 0.02 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.30 1rk7 n HIS 63 Cb 0.46 -0.34 -0.03 0.00 -0.12 0.00 0.00 29.99 29.96 1rk7 n HIS 63 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1rk7 n PHE 64 N -2.04 -2.00 -3.78 1.57 7.35 -1.18 -4.62 117.46 112.76 1rk7 n PHE 64 Ca 0.00 1.01 -0.37 0.00 -0.76 0.00 0.00 57.45 57.33 1rk7 n PHE 64 Cb 0.00 -1.82 -0.12 0.00 0.35 0.00 0.00 39.48 37.89 1rk7 n PHE 64 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1rk7 s ASN 65 N -4.58 5.23 0.41 -2.13 4.22 -1.26 -4.56 114.94 112.27 1rk7 s ASN 65 Ca 0.00 -1.57 0.27 0.00 -2.14 0.00 0.00 52.86 49.42 1rk7 s ASN 65 Cb 0.00 -1.83 0.88 0.00 1.28 0.00 0.00 41.25 41.58 1rk7 s ASN 65 CO 0.00 -0.42 1.78 1.55 -2.04 0.00 0.00 177.10 177.97 1rk7 h PRO 66 N 8.13 0.00 0.00 3.55 0.13 -1.96 -3.02 132.00 138.82 1rk7 h PRO 66 Ca -0.19 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.62 1rk7 h PRO 66 Cb 1.06 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.14 1rk7 h PRO 66 CO 0.64 0.00 -1.99 1.47 -0.23 0.00 0.00 178.00 177.89 1rk7 n LEU 67 N -2.81 0.50 -3.46 1.56 -0.00 -1.26 -5.02 117.00 106.51 1rk7 n LEU 67 Ca 0.03 0.24 -0.19 0.00 -0.00 0.00 0.00 56.01 56.08 1rk7 n LEU 67 Cb 0.39 0.31 0.03 0.00 -0.00 0.00 0.00 43.42 44.14 1rk7 n LEU 67 CO 0.29 0.42 0.03 -1.54 -0.00 0.00 0.00 177.39 176.59 1rk7 n SER 68 N -2.91 -6.16 -0.24 1.45 3.41 -1.14 -4.74 113.62 103.29 1rk7 n SER 68 Ca -0.23 -0.71 0.31 0.00 -0.26 0.00 0.00 58.87 57.97 1rk7 n SER 68 Cb 1.09 -3.99 0.55 0.00 -0.26 0.00 0.00 64.21 61.60 1rk7 n SER 68 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1rk7 h ARG 69 N -0.92 0.00 0.00 4.33 3.08 -1.91 -3.46 114.38 115.50 1rk7 h ARG 69 Ca -0.48 0.00 0.13 0.00 0.07 0.00 0.00 59.98 59.70 1rk7 h ARG 69 Cb 1.27 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.28 1rk7 h ARG 69 CO 0.41 0.00 -0.17 1.63 -1.07 0.00 0.00 179.97 180.77 1rk7 n LYS 70 N -3.45 -0.97 -0.90 0.04 5.02 -1.26 -4.68 118.16 111.96 1rk7 n LYS 70 Ca 0.24 0.64 -0.31 0.00 -2.02 0.00 0.00 58.31 56.85 1rk7 n LYS 70 Cb 1.45 -1.19 -0.02 0.00 -0.02 0.00 0.00 35.03 35.25 1rk7 n LYS 70 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1rk7 n HIS 71 N -2.30 -0.20 0.03 2.13 1.44 -0.91 -3.49 115.22 111.92 1rk7 n HIS 71 Ca 0.00 0.62 0.00 0.00 -2.01 0.00 0.00 57.72 56.34 1rk7 n HIS 71 Cb 0.22 -1.25 0.00 0.00 0.12 0.00 0.00 29.99 29.08 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1rk7 n GLY 72 N 1.21 -0.78 0.00 -1.39 0.00 0.14 -4.74 105.19 99.64 1rk7 n GLY 72 Ca 0.12 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.41 -0.24 0.00 -0.02 0.00 -1.21 -4.81 105.19 97.50 1rk7 n GLY 73 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1rk7 n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 74 N 0.00 0.00 -0.44 1.61 -0.04 -1.26 -3.32 135.00 131.55 1rk7 n PRO 74 Ca 0.00 0.39 0.10 0.00 -0.04 0.00 0.00 63.50 63.96 1rk7 n PRO 74 Cb 0.00 -1.02 0.32 0.00 -0.04 0.00 0.00 33.50 32.76 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 -1.68 2.96 -0.07 0.54 2.85 -1.26 -3.80 118.16 117.69 1rk7 n LYS 75 Ca 0.00 -2.55 0.03 0.00 -1.05 0.00 0.00 58.31 54.74 1rk7 n LYS 75 Cb 0.00 -1.66 0.06 0.00 -0.65 0.00 0.00 35.03 32.79 1rk7 n LYS 75 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1rk7 n ASP 76 N 1.33 2.38 -0.50 -5.58 9.92 -1.26 -4.21 116.55 118.63 1rk7 n ASP 76 Ca 0.23 -2.09 0.09 0.00 -0.53 0.00 0.00 54.79 52.49 1rk7 n ASP 76 Cb 0.68 -0.12 0.33 0.00 -0.64 0.00 0.00 41.12 41.38 1rk7 n ASP 76 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1rk7 n GLU 77 N -0.23 1.65 0.00 -1.24 -0.58 -1.21 0.29 120.64 119.32 1rk7 n GLU 77 Ca 0.05 -0.98 0.00 0.00 -0.42 0.00 0.00 57.16 55.81 1rk7 n GLU 77 Cb 0.35 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 1rk7 n GLU 77 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1rk7 n GLU 78 N 0.23 0.00 -2.97 3.49 2.13 -1.23 -3.60 120.64 118.69 1rk7 n GLU 78 Ca 0.14 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.71 1rk7 n GLU 78 Cb 0.28 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.02 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1rk7 n ARG 79 N -1.02 -1.31 0.02 5.31 1.74 -1.26 -4.78 116.66 115.36 1rk7 n ARG 79 Ca 0.00 0.89 0.08 0.00 -0.77 0.00 0.00 57.85 58.04 1rk7 n ARG 79 Cb 0.00 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 29.87 1rk7 n ARG 79 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1rk7 n HIS 80 N -0.64 0.42 1.53 -1.55 -0.00 -1.26 -2.05 115.22 111.68 1rk7 n HIS 80 Ca -0.11 0.13 0.14 0.00 -0.00 0.00 0.00 57.72 57.87 1rk7 n HIS 80 Cb 0.50 -0.77 0.56 0.00 -0.00 0.00 0.00 29.99 30.28 1rk7 n HIS 80 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.34 177.89 1rk7 n VAL 81 N -2.52 0.03 0.00 3.57 3.14 -1.26 -4.72 118.33 116.57 1rk7 n VAL 81 Ca -0.06 -0.23 0.00 0.00 -2.96 0.00 0.00 64.34 61.09 1rk7 n VAL 81 Cb 0.66 0.33 0.00 0.00 -1.06 0.00 0.00 33.84 33.77 1rk7 n VAL 81 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1rk7 n GLY 82 N 1.14 -0.12 3.31 7.55 0.00 -1.25 -4.92 105.19 110.89 1rk7 n GLY 82 Ca 0.19 0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 1rk7 n GLY 82 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 83 N -0.63 -3.12 0.00 1.61 -0.08 -0.87 -4.92 116.55 108.55 1rk7 n ASP 83 Ca 0.00 0.31 0.00 0.00 -1.51 0.00 0.00 54.79 53.59 1rk7 n ASP 83 Cb 0.00 -1.08 0.00 0.00 2.34 0.00 0.00 41.12 42.38 1rk7 n ASP 83 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1rk7 n LEU 84 N 0.09 0.00 0.00 -2.67 7.94 -1.25 -4.39 117.00 116.72 1rk7 n LEU 84 Ca 0.05 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 1rk7 n LEU 84 Cb 0.54 -0.15 0.00 0.00 0.53 0.00 0.00 43.42 44.34 1rk7 n LEU 84 CO 0.51 -0.25 0.00 0.61 -1.11 0.00 0.00 177.39 177.15 1rk7 n GLY 85 N 2.69 2.15 3.18 -3.96 0.00 -1.26 -4.22 105.19 103.77 1rk7 n GLY 85 Ca 0.00 0.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1rk7 n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk7 s ASN 86 N 1.76 0.11 0.46 1.61 2.20 -1.26 -3.00 114.94 116.83 1rk7 s ASN 86 Ca 0.00 -0.56 0.06 0.00 -0.94 0.00 0.00 52.86 51.43 1rk7 s ASN 86 Cb 0.00 0.31 -0.01 0.00 -2.00 0.00 0.00 41.25 39.54 1rk7 s ASN 86 CO 0.00 -0.64 0.29 -0.69 -2.94 0.00 0.00 177.10 173.12 1rk7 s VAL 87 N -3.29 2.12 -0.04 3.54 1.01 0.31 -4.77 120.40 119.27 1rk7 s VAL 87 Ca 0.01 -1.56 0.07 0.00 0.00 0.00 0.00 61.98 60.49 1rk7 s VAL 87 Cb 0.02 -2.68 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 1rk7 s VAL 87 CO -0.08 0.00 -0.25 -0.89 0.00 0.00 0.00 175.10 173.88 1rk7 s THR 88 N -2.64 2.05 0.78 3.92 2.01 -1.26 0.16 115.64 120.66 1rk7 s THR 88 Ca 0.39 -1.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.24 1rk7 s THR 88 Cb 0.00 -1.72 0.13 0.00 0.01 0.00 0.00 72.50 70.92 1rk7 s THR 88 CO 0.22 0.57 1.09 0.00 -0.69 0.00 0.00 174.62 175.82 1rk7 s ALA 89 N -0.34 3.15 0.00 7.40 0.00 -1.04 -4.56 121.76 126.37 1rk7 s ALA 89 Ca 0.02 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.60 1rk7 s ALA 89 Cb -0.12 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1rk7 s ALA 89 CO 0.02 -1.69 0.00 -3.47 0.00 0.00 0.00 175.76 170.62 1rk7 n ASP 90 N -3.12 0.00 -0.02 0.00 2.03 0.36 -4.56 116.55 111.25 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 0.35 -0.71 -0.67 2.85 -1.26 -4.75 118.16 113.96 1rk7 n LYS 91 Ca 0.00 -0.64 -0.01 0.00 -1.05 0.00 0.00 58.31 56.61 1rk7 n LYS 91 Cb 0.00 -0.56 -0.01 0.00 -0.65 0.00 0.00 35.03 33.81 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 -0.06 -0.10 0.00 -5.58 9.92 -1.26 -4.67 116.55 114.80 1rk7 n ASP 92 Ca 0.00 -1.54 0.00 0.00 -0.53 0.00 0.00 54.79 52.72 1rk7 n ASP 92 Cb 0.48 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1rk7 n GLY 93 N 0.05 2.59 3.38 0.44 0.00 -1.22 -4.37 105.19 106.06 1rk7 n GLY 93 Ca -0.05 -0.32 -0.48 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.88 1.61 0.31 -1.26 -4.17 118.33 110.94 1rk7 n VAL 94 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 1rk7 n VAL 94 Cb 0.00 -0.50 -0.14 0.00 -0.91 0.00 0.00 33.84 32.30 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 7.75 2.87 0.10 3.52 0.00 -1.22 -0.48 121.76 134.28 1rk7 s ALA 95 Ca 1.29 -1.22 0.06 0.00 0.00 0.00 0.00 51.96 52.10 1rk7 s ALA 95 Cb -1.35 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1rk7 s ALA 95 CO 0.56 -0.52 -0.08 0.16 0.00 0.00 0.00 175.76 175.88 1rk7 s ASP 96 N 1.48 4.52 0.24 0.00 -4.77 -1.26 0.14 116.67 117.02 1rk7 s ASP 96 Ca 0.05 -0.34 0.08 0.00 -3.30 0.00 0.00 52.55 49.04 1rk7 s ASP 96 Cb -0.15 -0.91 -0.05 0.00 -1.09 0.00 0.00 42.92 40.72 1rk7 s ASP 96 CO -0.02 0.18 -0.12 -0.69 0.70 0.00 0.00 175.17 175.22 1rk7 s VAL 97 N -1.22 1.79 -0.33 2.11 1.01 -0.89 -4.92 120.40 117.95 1rk7 s VAL 97 Ca 0.22 -2.20 -0.04 0.00 0.00 0.00 0.00 61.98 59.96 1rk7 s VAL 97 Cb -0.11 -2.23 0.19 0.00 0.00 0.00 0.00 36.38 34.23 1rk7 s VAL 97 CO 0.14 -0.46 0.89 -0.94 0.00 0.00 0.00 175.10 174.72 1rk7 s SER 98 N -3.39 -0.81 0.11 3.32 1.04 -1.24 -2.75 113.70 109.97 1rk7 s SER 98 Ca 0.26 -0.21 0.08 0.00 0.48 0.00 0.00 55.95 56.56 1rk7 s SER 98 Cb 0.00 1.22 -0.04 0.00 0.10 0.00 0.00 66.02 67.31 1rk7 s SER 98 CO 0.10 -0.11 -0.20 -0.63 0.98 0.00 0.00 173.24 173.37 1rk7 s ILE 99 N 2.31 1.69 -0.53 -1.02 1.09 -0.79 -5.01 121.20 118.94 1rk7 s ILE 99 Ca 0.18 -1.56 0.04 0.00 -1.10 0.00 0.00 60.65 58.20 1rk7 s ILE 99 Cb -0.02 -1.56 0.15 0.00 -1.06 0.00 0.00 42.46 39.97 1rk7 s ILE 99 CO -0.17 -0.09 0.32 -1.61 -0.10 0.00 0.00 174.94 173.30 1rk7 s GLU 100 N -1.97 1.79 -0.01 2.79 2.02 -1.26 -2.24 118.70 119.81 1rk7 s GLU 100 Ca 0.07 -2.57 0.00 0.00 0.02 0.00 0.00 54.97 52.48 1rk7 s GLU 100 Cb -0.10 -2.86 -0.04 0.00 0.10 0.00 0.00 34.13 31.24 1rk7 s GLU 100 CO 0.04 -1.20 0.05 -0.51 0.02 0.00 0.00 175.26 173.66 1rk7 s ASP 101 N -0.37 5.46 -0.02 -0.19 1.01 -1.26 -4.90 116.67 116.41 1rk7 s ASP 101 Ca 0.21 0.10 -0.00 0.00 0.71 0.00 0.00 52.55 53.56 1rk7 s ASP 101 Cb -0.17 -1.52 -0.01 0.00 1.01 0.00 0.00 42.92 42.23 1rk7 s ASP 101 CO -0.06 0.28 -0.02 -1.54 0.21 0.00 0.00 175.17 174.05 1rk7 n SER 102 N 1.34 2.65 -0.29 0.27 3.41 -1.26 0.11 113.62 119.85 1rk7 n SER 102 Ca -0.14 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.53 1rk7 n SER 102 Cb 0.53 -0.03 0.16 0.00 -0.26 0.00 0.00 64.21 64.61 1rk7 n SER 102 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1rk7 h VAL 103 N -0.02 0.20 -3.19 -3.33 2.07 -1.95 -3.40 116.25 106.63 1rk7 h VAL 103 Ca -0.04 -0.01 -0.40 0.00 0.82 0.00 0.00 66.70 67.07 1rk7 h VAL 103 Cb 1.05 0.15 0.21 0.00 -1.52 0.00 0.00 31.29 31.18 1rk7 h VAL 103 CO -0.01 0.01 -0.04 0.27 0.02 0.00 0.00 177.57 177.82 1rk7 s ILE 104 N -6.15 1.41 0.20 4.57 -5.25 -1.26 -4.86 121.20 109.85 1rk7 s ILE 104 Ca -0.14 0.00 -0.23 0.00 -0.99 0.00 0.00 60.65 59.29 1rk7 s ILE 104 Cb 0.24 -2.18 0.05 0.00 2.95 0.00 0.00 42.46 43.52 1rk7 s ILE 104 CO 0.76 0.00 0.78 -0.55 -1.79 0.00 0.00 174.94 174.14 1rk7 s SER 105 N -3.25 -0.30 -0.15 4.36 0.15 -1.26 -4.94 113.70 108.30 1rk7 s SER 105 Ca 0.69 -0.39 0.08 0.00 0.70 0.00 0.00 55.95 57.03 1rk7 s SER 105 Cb -0.14 0.61 -0.23 0.00 -1.71 0.00 0.00 66.02 64.55 1rk7 s SER 105 CO 0.58 -1.09 0.25 0.18 1.20 0.00 0.00 173.24 174.35 1rk7 n LEU 106 N -0.43 1.43 -3.22 3.45 4.32 -1.26 -0.25 117.00 121.04 1rk7 n LEU 106 Ca -0.07 0.14 -0.22 0.00 -0.02 0.00 0.00 56.01 55.84 1rk7 n LEU 106 Cb 0.61 -0.23 -0.07 0.00 -1.62 0.00 0.00 43.42 42.11 1rk7 n LEU 106 CO 0.14 0.63 -0.21 -0.24 -1.22 0.00 0.00 177.39 176.49 1rk7 n SER 107 N -3.10 -1.09 0.00 -1.43 2.88 -1.26 -4.13 113.62 105.49 1rk7 n SER 107 Ca -0.31 -2.54 0.00 0.00 -1.33 0.00 0.00 58.87 54.69 1rk7 n SER 107 Cb 1.07 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.50 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 2.67 0.82 0.03 0.46 0.00 -1.26 -4.95 105.19 102.96 1rk7 n GLY 108 Ca 0.26 0.28 -0.00 0.00 0.00 0.00 0.00 46.02 46.55 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 2.29 -0.10 1.61 9.92 -1.26 -4.72 116.55 124.30 1rk7 n ASP 109 Ca 0.00 0.00 -0.14 0.00 -0.53 0.00 0.00 54.79 54.12 1rk7 n ASP 109 Cb 0.00 1.11 -0.06 0.00 -0.64 0.00 0.00 41.12 41.53 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 -2.19 0.56 -3.46 1.24 8.25 -1.26 -5.04 115.22 113.32 1rk7 n HIS 110 Ca -0.11 0.24 -0.33 0.00 -0.26 0.00 0.00 57.72 57.26 1rk7 n HIS 110 Cb 0.62 -0.82 0.03 0.00 1.12 0.00 0.00 29.99 30.94 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 -5.75 -0.33 0.41 2.88 0.66 -4.81 113.62 102.20 1rk7 n SER 111 Ca -0.23 -0.18 0.09 0.00 -1.33 0.00 0.00 58.87 57.22 1rk7 n SER 111 Cb 0.53 -2.17 0.38 0.00 -0.75 0.00 0.00 64.21 62.21 1rk7 n SER 111 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1rk7 n ILE 112 N -0.55 0.15 -1.68 2.46 -0.00 0.11 -4.88 119.36 114.98 1rk7 n ILE 112 Ca -0.09 -0.22 -0.45 0.00 -0.00 0.00 0.00 62.75 61.99 1rk7 n ILE 112 Cb 0.66 0.10 -0.04 0.00 -0.00 0.00 0.00 39.64 40.36 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1rk7 n ILE 113 N -0.10 0.55 0.00 7.28 2.08 -1.26 -2.30 119.36 125.62 1rk7 n ILE 113 Ca 0.14 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 63.35 1rk7 n ILE 113 Cb 0.21 -2.04 0.00 0.00 -0.75 0.00 0.00 39.64 37.06 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 4.33 1.84 2.43 7.39 0.00 -0.68 -4.95 105.19 115.55 1rk7 n GLY 114 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.96 4.17 -1.67 1.61 1.74 -0.97 -4.65 116.66 115.93 1rk7 n ARG 115 Ca 0.00 -2.93 -0.46 0.00 -0.77 0.00 0.00 57.85 53.70 1rk7 n ARG 115 Cb 0.00 -2.72 -0.04 0.00 -1.02 0.00 0.00 32.46 28.68 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 2.60 0.66 -2.87 0.55 5.66 -1.26 -4.42 114.28 115.20 1rk7 n THR 116 Ca 0.68 -0.12 -0.43 0.00 -3.05 0.00 0.00 64.05 61.13 1rk7 n THR 116 Cb 0.25 -2.07 -0.04 0.00 -1.55 0.00 0.00 70.33 66.91 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1rk7 s LEU 117 N 4.33 4.48 -1.01 1.09 2.96 -1.22 -3.06 118.68 126.24 1rk7 s LEU 117 Ca 0.91 -1.10 -0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1rk7 s LEU 117 Cb -0.58 -2.41 0.31 0.00 0.50 0.00 0.00 46.19 44.01 1rk7 s LEU 117 CO 0.48 -1.40 1.56 1.33 -1.32 0.00 0.00 176.35 176.99 1rk7 n VAL 118 N 5.88 5.38 -1.30 1.68 0.24 -1.26 -3.69 118.33 125.27 1rk7 n VAL 118 Ca -0.02 -5.91 -0.37 0.00 -2.04 0.00 0.00 64.34 56.01 1rk7 n VAL 118 Cb 0.46 -1.83 0.06 0.00 -1.47 0.00 0.00 33.84 31.05 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 0.65 1.69 -3.28 3.34 0.24 -1.20 -3.79 118.33 115.98 1rk7 n VAL 119 Ca 0.35 -0.43 -0.21 0.00 -2.04 0.00 0.00 64.34 62.01 1rk7 n VAL 119 Cb 0.31 -0.64 0.00 0.00 -1.47 0.00 0.00 33.84 32.04 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 -1.88 3.16 -0.37 6.34 -3.43 -1.26 -2.72 115.29 115.13 1rk7 s HIS 120 Ca 0.65 -0.04 -0.02 0.00 -0.80 0.00 0.00 55.06 54.85 1rk7 s HIS 120 Cb -0.38 -2.12 0.17 0.00 -1.43 0.00 0.00 32.58 28.83 1rk7 s HIS 120 CO 0.59 -0.15 2.28 -1.91 -2.00 0.00 0.00 174.74 173.55 1rk7 n GLU 121 N -1.81 2.04 -0.80 -0.38 2.13 -1.16 -4.66 120.64 115.99 1rk7 n GLU 121 Ca 0.00 -1.89 0.00 0.00 0.66 0.00 0.00 57.16 55.93 1rk7 n GLU 121 Cb 0.58 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.47 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 0.49 0.00 -3.94 5.31 5.02 -1.21 -4.83 118.16 119.00 1rk7 n LYS 122 Ca 0.38 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.40 1rk7 n LYS 122 Cb 0.58 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.57 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rk7 n ALA 123 N -3.00 0.74 -3.80 7.82 0.00 -1.15 -4.41 120.51 116.71 1rk7 n ALA 123 Ca 0.00 -2.16 -0.30 0.00 0.00 0.00 0.00 53.44 50.98 1rk7 n ALA 123 Cb 0.00 0.95 -0.14 0.00 0.00 0.00 0.00 19.45 20.26 1rk7 n ALA 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rk7 s ASP 124 N -4.05 4.09 0.00 0.00 1.01 -1.26 -1.92 116.67 114.54 1rk7 s ASP 124 Ca 0.24 -2.14 0.17 0.00 0.71 0.00 0.00 52.55 51.53 1rk7 s ASP 124 Cb -0.02 -1.13 0.72 0.00 1.01 0.00 0.00 42.92 43.50 1rk7 s ASP 124 CO 0.15 -0.35 1.53 0.47 0.21 0.00 0.00 175.17 177.19 1rk7 n ASP 125 N 4.21 0.00 -4.21 0.27 8.00 0.12 -4.86 116.55 120.08 1rk7 n ASP 125 Ca 0.03 0.48 -0.32 0.00 0.71 0.00 0.00 54.79 55.69 1rk7 n ASP 125 Cb 0.39 -0.49 -0.06 0.00 -0.02 0.00 0.00 41.12 40.94 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 -1.49 -1.49 0.00 0.64 4.77 -1.12 -4.85 117.00 113.46 1rk7 n LEU 126 Ca 0.04 -1.14 0.00 0.00 -0.03 0.00 0.00 56.01 54.88 1rk7 n LEU 126 Cb 0.19 -1.89 0.00 0.00 -2.33 0.00 0.00 43.42 39.40 1rk7 n LEU 126 CO 0.15 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1rk7 n GLY 127 N -1.99 4.59 0.00 -0.72 0.00 -1.26 -4.72 105.19 101.09 1rk7 n GLY 127 Ca -0.20 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.26 -4.34 118.16 119.19 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 2.55 0.57 0.00 0.72 0.00 -1.26 -4.39 105.19 103.38 1rk7 n GLY 129 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 3.11 3.46 -0.02 0.00 -1.26 -5.12 105.19 105.37 1rk7 n GLY 130 Ca 0.00 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.23 -0.70 -0.28 1.61 0.01 -1.26 -4.80 114.94 109.29 1rk7 s ASN 131 Ca 0.00 1.20 0.00 0.00 -0.71 0.00 0.00 52.86 53.35 1rk7 s ASN 131 Cb 0.00 1.11 0.00 0.00 0.41 0.00 0.00 41.25 42.77 1rk7 s ASN 131 CO 0.00 -0.21 0.00 1.21 -1.51 0.00 0.00 177.10 176.59 1rk7 n GLU 132 N 3.87 -0.24 0.03 -0.60 2.13 -1.26 -4.80 120.64 119.77 1rk7 n GLU 132 Ca -0.19 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.14 1rk7 n GLU 132 Cb 0.57 -4.07 0.00 0.00 0.27 0.00 0.00 31.44 28.21 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rk7 n GLN 133 N -2.80 0.00 0.11 5.31 10.64 -1.26 -4.83 117.38 124.54 1rk7 n GLN 133 Ca -0.03 0.00 0.13 0.00 -1.83 0.00 0.00 57.00 55.27 1rk7 n GLN 133 Cb 0.10 0.00 0.45 0.00 -0.86 0.00 0.00 30.24 29.93 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1rk7 n SER 134 N -2.67 0.70 0.21 2.61 7.64 -1.26 -0.02 113.62 120.83 1rk7 n SER 134 Ca 0.00 0.60 0.12 0.00 1.01 0.00 0.00 58.87 60.61 1rk7 n SER 134 Cb 0.00 -0.78 0.20 0.00 -1.01 0.00 0.00 64.21 62.62 1rk7 n SER 134 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1rk7 h THR 135 N 0.00 0.00 0.00 0.44 1.35 -1.83 -3.06 112.91 109.81 1rk7 h THR 135 Ca 0.00 -0.95 -0.06 0.00 -0.55 0.00 0.00 66.41 64.85 1rk7 h THR 135 Cb 0.57 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.93 1rk7 h THR 135 CO 0.00 0.00 -1.45 2.29 -0.25 0.00 0.00 175.52 176.11 1rk7 n LYS 136 N -3.04 1.25 0.00 4.72 2.85 -1.03 -2.13 118.16 120.78 1rk7 n LYS 136 Ca 0.04 -0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1rk7 n LYS 136 Cb 0.52 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 33.70 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 -2.00 0.00 0.00 0.58 -2.24 0.97 -4.54 114.28 107.06 1rk7 n THR 137 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1rk7 n THR 137 Cb 0.44 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 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 4.26 0.00 2.47 3.38 0.00 -1.16 -4.17 105.19 109.97 1rk7 n GLY 138 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -4.48 0.00 1.61 5.15 -1.26 0.16 115.26 116.45 1rk7 n ASN 139 Ca 0.00 0.06 0.00 0.00 -0.60 0.00 0.00 54.58 54.04 1rk7 n ASN 139 Cb 0.00 -2.17 0.00 0.00 -0.53 0.00 0.00 39.78 37.08 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 1.04 -0.03 0.00 5.20 0.00 -0.81 -3.94 120.51 121.98 1rk7 n ALA 140 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1rk7 n ALA 140 Cb 0.27 0.39 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk7 n GLY 141 N -0.99 0.72 2.93 0.00 0.00 -1.26 -2.94 105.19 103.65 1rk7 n GLY 141 Ca 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.30 1rk7 n GLY 141 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rk7 s SER 142 N -4.00 0.55 0.24 1.61 0.15 -1.26 -4.94 113.70 106.04 1rk7 s SER 142 Ca 0.00 -0.08 -0.30 0.00 0.70 0.00 0.00 55.95 56.27 1rk7 s SER 142 Cb 0.00 -0.11 -0.09 0.00 -1.71 0.00 0.00 66.02 64.11 1rk7 s SER 142 CO 0.00 0.03 1.35 -0.60 1.20 0.00 0.00 173.24 175.21 1rk7 s ARG 143 N 0.11 4.35 0.28 5.44 3.52 -1.26 -2.98 118.95 128.41 1rk7 s ARG 143 Ca -0.01 2.15 -0.13 0.00 -0.13 0.00 0.00 55.73 57.62 1rk7 s ARG 143 Cb -0.04 -3.15 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 1rk7 s ARG 143 CO -0.00 -0.28 0.54 -0.48 -0.81 0.00 0.00 175.30 174.26 1rk7 s LEU 144 N -0.48 0.31 0.49 -0.88 0.05 -1.10 -5.00 118.68 112.06 1rk7 s LEU 144 Ca 0.56 -0.98 0.00 0.00 0.05 0.00 0.00 54.13 53.76 1rk7 s LEU 144 Cb -0.39 1.95 0.00 0.00 -2.05 0.00 0.00 46.19 45.70 1rk7 s LEU 144 CO 0.42 -1.24 0.00 0.00 -0.55 0.00 0.00 176.35 174.98 1rk7 n ALA 145 N -0.43 -3.15 -2.84 1.48 0.00 -1.26 -3.27 120.51 111.04 1rk7 n ALA 145 Ca -0.02 0.72 -0.11 0.00 0.00 0.00 0.00 53.44 54.03 1rk7 n ALA 145 Cb 0.61 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.81 1rk7 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk7 n GLY 147 N 1.60 4.07 3.65 0.00 0.00 -1.24 -4.44 105.19 108.82 1rk7 n GLY 147 Ca 0.11 -1.57 -0.48 0.00 0.00 0.00 0.00 46.02 44.09 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 2.56 0.05 -2.74 1.61 0.31 -1.26 -3.46 118.33 115.40 1rk7 n VAL 148 Ca 0.61 -0.01 -0.43 0.00 -0.01 0.00 0.00 64.34 64.51 1rk7 n VAL 148 Cb 0.48 -1.35 -0.03 0.00 -0.91 0.00 0.00 33.84 32.03 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 1.09 4.29 -0.03 2.52 -1.09 -1.26 -4.15 121.20 122.57 1rk7 s ILE 149 Ca 0.82 0.68 0.03 0.00 -2.23 0.00 0.00 60.65 59.95 1rk7 s ILE 149 Cb -0.77 -4.57 -0.00 0.00 -1.58 0.00 0.00 42.46 35.54 1rk7 s ILE 149 CO 0.42 -1.09 -0.12 -0.83 -1.23 0.00 0.00 174.94 172.09 1rk7 s GLY 150 N 2.67 0.64 0.48 6.18 0.00 -0.91 -1.68 107.32 114.70 1rk7 s GLY 150 Ca 0.38 -0.47 -0.22 0.00 0.00 0.00 0.00 44.72 44.40 1rk7 s GLY 150 CO 0.24 -0.25 0.87 1.39 0.00 0.00 0.00 173.10 175.35 1rk7 n ILE 151 N 3.11 2.58 -4.25 0.90 2.08 -1.26 -1.05 119.36 121.47 1rk7 n ILE 151 Ca -0.17 -0.50 -0.15 0.00 0.56 0.00 0.00 62.75 62.49 1rk7 n ILE 151 Cb 0.54 -1.01 -0.09 0.00 -0.75 0.00 0.00 39.64 38.33 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 -1.41 1.50 -2.00 -1.39 0.00 0.21 -4.77 121.76 113.89 1rk7 s ALA 152 Ca 0.66 -1.83 0.22 0.00 0.00 0.00 0.00 51.96 51.02 1rk7 s ALA 152 Cb -0.52 1.38 1.32 0.00 0.00 0.00 0.00 23.12 25.30 1rk7 s ALA 152 CO 0.55 -0.60 1.70 0.94 0.00 0.00 0.00 175.76 178.35