#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 1.33 -0.40 0.00 2.01 -1.24 -5.00 115.64 112.35 1rk7 s THR 2 Ca 0.00 -0.68 0.06 0.00 0.31 0.00 0.00 61.69 61.39 1rk7 s THR 2 Cb 0.00 -1.14 0.17 0.00 0.01 0.00 0.00 72.50 71.54 1rk7 s THR 2 CO 0.00 0.39 0.55 -0.75 -0.69 0.00 0.00 174.62 174.11 1rk7 s LYS 3 N -0.05 0.77 0.57 4.92 2.20 -1.26 -2.33 119.74 124.55 1rk7 s LYS 3 Ca -0.01 -0.47 -0.07 0.00 -0.36 0.00 0.00 55.97 55.05 1rk7 s LYS 3 Cb -0.10 -0.17 -0.02 0.00 -1.51 0.00 0.00 37.83 36.03 1rk7 s LYS 3 CO 0.01 -1.19 0.91 0.00 -0.36 0.00 0.00 175.35 174.72 1rk7 s ALA 4 N 1.70 3.25 0.07 3.13 0.00 0.28 -1.65 121.76 128.54 1rk7 s ALA 4 Ca 0.16 -0.44 -0.08 0.00 0.00 0.00 0.00 51.96 51.60 1rk7 s ALA 4 Cb -0.08 -2.76 -0.00 0.00 0.00 0.00 0.00 23.12 20.28 1rk7 s ALA 4 CO -0.05 -0.64 0.17 0.08 0.00 0.00 0.00 175.76 175.32 1rk7 s VAL 5 N -2.98 0.14 -0.37 0.00 1.01 -0.57 0.15 120.40 117.79 1rk7 s VAL 5 Ca 0.52 -1.17 0.05 0.00 0.00 0.00 0.00 61.98 61.38 1rk7 s VAL 5 Cb -0.11 -1.26 0.17 0.00 0.00 0.00 0.00 36.38 35.19 1rk7 s VAL 5 CO 0.48 -0.65 0.51 0.00 0.00 0.00 0.00 175.10 175.45 1rk7 s ALA 6 N -3.58 -1.60 -0.53 5.51 0.00 0.18 -0.95 121.76 120.79 1rk7 s ALA 6 Ca 0.03 -0.07 -0.27 0.00 0.00 0.00 0.00 51.96 51.66 1rk7 s ALA 6 Cb 0.04 -2.41 0.03 0.00 0.00 0.00 0.00 23.12 20.78 1rk7 s ALA 6 CO -0.09 -2.08 1.05 0.14 0.00 0.00 0.00 175.76 174.78 1rk7 s VAL 7 N 1.93 4.25 0.94 0.00 -7.23 -1.26 -1.99 120.40 117.04 1rk7 s VAL 7 Ca 0.15 0.75 -0.12 0.00 -1.81 0.00 0.00 61.98 60.94 1rk7 s VAL 7 Cb -0.09 -4.59 0.05 0.00 0.56 0.00 0.00 36.38 32.30 1rk7 s VAL 7 CO -0.11 -1.11 0.48 0.18 -0.31 0.00 0.00 175.10 174.22 1rk7 n LEU 8 N 7.79 0.12 0.00 1.32 7.99 0.32 -4.67 117.00 129.87 1rk7 n LEU 8 Ca 0.07 0.34 0.00 0.00 -0.01 0.00 0.00 56.01 56.41 1rk7 n LEU 8 Cb 0.48 -1.23 0.00 0.00 -0.11 0.00 0.00 43.42 42.56 1rk7 n LEU 8 CO 0.68 -3.49 0.00 2.29 -1.51 0.00 0.00 177.39 175.35 1rk7 n LYS 9 N -1.93 0.00 0.00 3.23 2.85 -1.21 -4.48 118.16 116.63 1rk7 n LYS 9 Ca 0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 1rk7 n LYS 9 Cb 0.53 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.91 1rk7 n LYS 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1rk7 n GLY 10 N 0.00 -0.78 0.20 2.58 0.00 -1.26 -4.24 105.19 101.69 1rk7 n GLY 10 Ca 0.00 0.42 -0.06 0.00 0.00 0.00 0.00 46.02 46.38 1rk7 n GLY 10 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1rk7 h ASP 11 N 0.00 -0.90 0.00 1.61 3.58 -1.83 -3.47 116.42 115.40 1rk7 h ASP 11 Ca 0.00 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1rk7 h ASP 11 Cb 0.00 0.38 0.00 0.00 1.72 0.00 0.00 39.33 41.43 1rk7 h ASP 11 CO 0.00 -0.15 0.00 0.61 -2.88 0.00 0.00 179.24 176.82 1rk7 n GLY 12 N -1.14 -1.02 0.20 -0.78 0.00 -1.26 -4.97 105.19 96.21 1rk7 n GLY 12 Ca -0.00 0.45 -0.19 0.00 0.00 0.00 0.00 46.02 46.27 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 0.70 -5.25 1.61 0.13 -1.91 -3.42 132.00 123.86 1rk7 h PRO 13 Ca 0.00 -0.68 -0.15 0.00 -0.87 0.00 0.00 66.00 64.30 1rk7 h PRO 13 Cb 0.00 0.18 -0.04 0.00 0.13 0.00 0.00 31.00 31.27 1rk7 h PRO 13 CO 0.00 1.27 0.74 0.28 -0.23 0.00 0.00 178.00 180.06 1rk7 n VAL 14 N -3.94 -0.01 -2.26 1.56 0.31 -1.07 -4.32 118.33 108.61 1rk7 n VAL 14 Ca -0.10 -0.50 -0.26 0.00 -0.01 0.00 0.00 64.34 63.47 1rk7 n VAL 14 Cb 0.81 -1.43 0.01 0.00 -0.91 0.00 0.00 33.84 32.32 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 7.86 3.51 -0.65 5.55 0.00 0.19 -3.28 117.38 130.56 1rk7 n GLN 15 Ca 0.53 -4.34 -0.31 0.00 -0.00 0.00 0.00 57.00 52.88 1rk7 n GLN 15 Cb 0.34 -2.26 0.18 0.00 0.00 0.00 0.00 30.24 28.50 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 -0.59 -1.64 2.59 1.69 0.00 -1.26 -4.49 105.19 101.49 1rk7 n GLY 16 Ca 0.42 -0.87 -0.26 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.44 -0.14 -0.14 -0.61 1.01 0.15 -0.52 121.20 118.52 1rk7 s ILE 17 Ca 0.63 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 1rk7 s ILE 17 Cb -0.21 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 1rk7 s ILE 17 CO 0.64 -0.62 -0.07 -0.51 0.00 0.00 0.00 174.94 174.38 1rk7 s ILE 18 N 2.16 3.63 0.07 2.92 1.10 -0.84 -1.66 121.20 128.58 1rk7 s ILE 18 Ca 0.08 -0.46 0.09 0.00 -0.51 0.00 0.00 60.65 59.86 1rk7 s ILE 18 Cb -0.16 -2.57 -0.03 0.00 0.15 0.00 0.00 42.46 39.86 1rk7 s ILE 18 CO -0.33 0.51 -0.24 0.20 -2.11 0.00 0.00 174.94 172.97 1rk7 s ASN 19 N 0.26 2.90 -0.10 4.50 0.01 -0.65 0.50 114.94 122.36 1rk7 s ASN 19 Ca -0.05 -0.62 0.01 0.00 -0.71 0.00 0.00 52.86 51.49 1rk7 s ASN 19 Cb -0.14 -0.22 -0.02 0.00 0.41 0.00 0.00 41.25 41.27 1rk7 s ASN 19 CO 0.04 0.18 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.32 1rk7 s PHE 20 N -0.92 2.79 -0.09 2.20 0.40 0.41 -2.84 117.98 119.93 1rk7 s PHE 20 Ca 0.10 -0.41 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 1rk7 s PHE 20 Cb -0.10 -1.77 0.01 0.00 0.51 0.00 0.00 43.02 41.68 1rk7 s PHE 20 CO 0.03 -0.03 -0.17 -1.21 0.70 0.00 0.00 175.22 174.54 1rk7 s GLU 21 N -0.10 2.29 -0.44 0.44 0.41 -1.03 -0.56 118.70 119.72 1rk7 s GLU 21 Ca -0.01 -0.61 0.07 0.00 -0.41 0.00 0.00 54.97 54.01 1rk7 s GLU 21 Cb -0.14 -1.82 0.33 0.00 -1.78 0.00 0.00 34.13 30.72 1rk7 s GLU 21 CO 0.03 0.06 1.02 0.94 -0.49 0.00 0.00 175.26 176.83 1rk7 n GLN 22 N 3.80 1.01 -1.36 1.61 7.27 -0.98 -0.44 117.38 128.29 1rk7 n GLN 22 Ca -0.21 -2.28 -0.38 0.00 0.07 0.00 0.00 57.00 54.20 1rk7 n GLN 22 Cb 0.52 -1.20 -0.02 0.00 2.41 0.00 0.00 30.24 31.95 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 0.34 2.73 0.00 3.69 5.02 -1.25 -3.22 118.16 125.46 1rk7 n LYS 23 Ca 0.11 -2.18 0.00 0.00 -2.02 0.00 0.00 58.31 54.22 1rk7 n LYS 23 Cb 0.69 -2.96 0.00 0.00 -0.02 0.00 0.00 35.03 32.74 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 5.28 0.00 0.00 1.97 -0.58 -1.26 -4.96 120.64 121.09 1rk7 n GLU 24 Ca 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 1rk7 n GLU 24 Cb 0.31 -0.09 0.00 0.00 -0.57 0.00 0.00 31.44 31.09 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 -2.03 0.00 -0.76 1.62 2.88 -1.20 -4.55 113.62 109.58 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 -0.20 0.00 -3.46 0.23 -1.26 -4.90 115.26 105.67 1rk7 n ASN 26 Ca 0.00 -1.57 0.00 0.00 -0.53 0.00 0.00 54.58 52.48 1rk7 n ASN 26 Cb 0.00 0.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rk7 n GLY 27 N 0.05 7.29 3.80 4.83 0.00 -1.26 -5.02 105.19 114.88 1rk7 n GLY 27 Ca -0.08 -2.01 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 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 1.20 1.80 -0.50 1.61 0.04 -1.25 -4.63 135.00 133.27 1rk7 s PRO 28 Ca 0.00 0.53 0.03 0.00 0.04 0.00 0.00 61.00 61.60 1rk7 s PRO 28 Cb 0.00 -1.89 0.13 0.00 0.04 0.00 0.00 34.50 32.78 1rk7 s PRO 28 CO 0.00 -1.79 0.26 0.08 0.04 0.00 0.00 177.00 175.59 1rk7 s VAL 29 N -3.20 2.18 -0.70 -0.36 1.01 -0.42 -4.50 120.40 114.41 1rk7 s VAL 29 Ca 0.62 -3.09 -0.26 0.00 0.00 0.00 0.00 61.98 59.24 1rk7 s VAL 29 Cb -0.14 -2.51 -0.11 0.00 0.00 0.00 0.00 36.38 33.61 1rk7 s VAL 29 CO 0.54 -0.84 2.39 -0.54 0.00 0.00 0.00 175.10 176.65 1rk7 s LYS 30 N -0.12 1.79 -0.18 2.72 1.02 0.42 -4.28 119.74 121.12 1rk7 s LYS 30 Ca 0.18 0.76 -0.13 0.00 0.02 0.00 0.00 55.97 56.79 1rk7 s LYS 30 Cb -0.24 -4.72 -0.05 0.00 -0.52 0.00 0.00 37.83 32.30 1rk7 s LYS 30 CO -0.01 -4.04 0.28 0.08 -0.92 0.00 0.00 175.35 170.74 1rk7 s VAL 31 N 13.83 5.31 -0.15 3.17 1.01 -0.38 -2.45 120.40 140.72 1rk7 s VAL 31 Ca 0.93 0.51 -0.24 0.00 0.00 0.00 0.00 61.98 63.18 1rk7 s VAL 31 Cb -0.14 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.68 1rk7 s VAL 31 CO 0.14 0.37 0.60 -1.66 0.00 0.00 0.00 175.10 174.55 1rk7 s TRP 32 N 0.63 -0.62 0.06 5.22 -2.14 -1.13 -0.17 118.94 120.80 1rk7 s TRP 32 Ca 0.15 1.35 -0.02 0.00 2.66 0.00 0.00 56.10 60.24 1rk7 s TRP 32 Cb -0.13 0.27 0.01 0.00 -3.10 0.00 0.00 33.47 30.52 1rk7 s TRP 32 CO 0.04 -0.42 0.13 0.41 -2.66 0.00 0.00 176.95 174.45 1rk7 n GLY 33 N 2.05 1.95 3.50 3.67 0.00 -1.00 -1.63 105.19 113.72 1rk7 n GLY 33 Ca -0.16 -1.09 -0.05 0.00 0.00 0.00 0.00 46.02 44.72 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 -1.34 -0.80 0.53 1.61 1.04 -0.67 -0.33 113.70 113.74 1rk7 s SER 34 Ca 0.03 1.34 -0.07 0.00 0.48 0.00 0.00 55.95 57.73 1rk7 s SER 34 Cb -0.01 1.76 -0.03 0.00 0.10 0.00 0.00 66.02 67.84 1rk7 s SER 34 CO 0.02 -0.22 0.86 -0.63 0.98 0.00 0.00 173.24 174.25 1rk7 s ILE 35 N 2.51 4.75 -0.35 -1.02 1.09 0.37 0.34 121.20 128.89 1rk7 s ILE 35 Ca -0.06 0.38 0.02 0.00 -1.10 0.00 0.00 60.65 59.89 1rk7 s ILE 35 Cb -0.11 -3.83 0.15 0.00 -1.06 0.00 0.00 42.46 37.61 1rk7 s ILE 35 CO -0.17 -0.90 0.35 -0.54 -0.10 0.00 0.00 174.94 173.57 1rk7 s LYS 36 N -4.89 0.55 0.00 2.79 1.02 -1.26 -3.30 119.74 114.65 1rk7 s LYS 36 Ca 0.50 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.79 1rk7 s LYS 36 Cb -0.10 -0.74 0.00 0.00 -0.52 0.00 0.00 37.83 36.47 1rk7 s LYS 36 CO 0.48 -1.15 0.00 0.41 -0.92 0.00 0.00 175.35 174.16 1rk7 n GLY 37 N 4.51 2.24 0.00 -3.33 0.00 -1.26 -0.63 105.19 106.72 1rk7 n GLY 37 Ca 0.08 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1rk7 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rk7 n LEU 38 N 0.00 0.00 -3.75 0.99 7.99 -1.26 -4.83 117.00 116.14 1rk7 n LEU 38 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 56.01 55.87 1rk7 n LEU 38 Cb 0.00 0.00 -0.14 0.00 -0.11 0.00 0.00 43.42 43.17 1rk7 n LEU 38 CO 0.00 -1.23 -0.20 0.42 -1.51 0.00 0.00 177.39 174.88 1rk7 s THR 39 N -0.59 -0.04 -0.44 -5.08 -4.23 -1.26 -3.90 115.64 100.10 1rk7 s THR 39 Ca 0.00 0.15 -0.38 0.00 -1.18 0.00 0.00 61.69 60.27 1rk7 s THR 39 Cb 0.00 -0.27 -0.17 0.00 1.34 0.00 0.00 72.50 73.40 1rk7 s THR 39 CO 0.00 0.06 1.86 -1.84 -0.54 0.00 0.00 174.62 174.16 1rk7 n GLU 40 N 4.03 0.00 0.00 3.99 0.28 -1.26 -4.47 120.64 123.21 1rk7 n GLU 40 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.76 1rk7 n GLU 40 Cb 0.53 -1.31 0.00 0.00 1.43 0.00 0.00 31.44 32.09 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 6.51 3.47 3.40 -1.84 0.00 -1.26 -4.89 105.19 110.57 1rk7 n GLY 41 Ca 0.48 -1.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.68 -3.77 0.99 4.77 -1.26 -2.59 117.00 114.46 1rk7 n LEU 42 Ca 0.00 0.14 -0.11 0.00 -0.03 0.00 0.00 56.01 56.01 1rk7 n LEU 42 Cb 0.00 -1.16 -0.07 0.00 -2.33 0.00 0.00 43.42 39.86 1rk7 n LEU 42 CO 0.00 -3.28 0.00 -1.00 -1.33 0.00 0.00 177.39 171.79 1rk7 s HIS 43 N -2.37 -0.06 0.00 -1.77 3.76 0.37 -3.98 115.29 111.25 1rk7 s HIS 43 Ca 0.59 -0.13 0.00 0.00 -0.15 0.00 0.00 55.06 55.36 1rk7 s HIS 43 Cb -0.19 0.07 0.00 0.00 1.11 0.00 0.00 32.58 33.57 1rk7 s HIS 43 CO 0.66 -0.51 0.00 0.41 -0.85 0.00 0.00 174.74 174.45 1rk7 n GLY 44 N 0.47 -3.07 3.79 -2.22 0.00 -0.58 -2.23 105.19 101.35 1rk7 n GLY 44 Ca -0.18 -1.01 -0.22 0.00 0.00 0.00 0.00 46.02 44.61 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 0.00 2.97 0.52 1.61 0.40 -1.25 -2.88 117.98 119.34 1rk7 s PHE 45 Ca 0.00 -0.18 0.07 0.00 -0.60 0.00 0.00 56.93 56.22 1rk7 s PHE 45 Cb 0.00 -1.44 0.04 0.00 0.51 0.00 0.00 43.02 42.13 1rk7 s PHE 45 CO 0.00 0.48 0.51 -3.38 0.70 0.00 0.00 175.22 173.52 1rk7 s HIS 46 N -2.22 1.85 0.00 0.36 -3.43 -1.26 -4.25 115.29 106.34 1rk7 s HIS 46 Ca 0.34 -0.72 0.00 0.00 -0.80 0.00 0.00 55.06 53.88 1rk7 s HIS 46 Cb -0.07 -2.07 0.00 0.00 -1.43 0.00 0.00 32.58 29.01 1rk7 s HIS 46 CO 0.24 -0.58 0.00 0.28 -2.00 0.00 0.00 174.74 172.68 1rk7 n VAL 47 N -1.85 -1.07 -3.64 -5.38 0.31 0.23 -4.47 118.33 102.46 1rk7 n VAL 47 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.28 1rk7 n VAL 47 Cb 0.63 -1.07 -0.07 0.00 -0.91 0.00 0.00 33.84 32.42 1rk7 n VAL 47 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1rk7 s HIS 48 N -0.50 -0.76 -0.26 3.52 -3.43 -1.26 -4.79 115.29 107.81 1rk7 s HIS 48 Ca 0.00 1.69 -0.00 0.00 -0.80 0.00 0.00 55.06 55.94 1rk7 s HIS 48 Cb 0.00 0.40 0.00 0.00 -1.43 0.00 0.00 32.58 31.56 1rk7 s HIS 48 CO 0.00 -0.37 0.01 -1.91 -2.00 0.00 0.00 174.74 170.47 1rk7 n GLU 49 N 3.18 -3.04 -1.62 -0.38 2.13 -1.26 -4.75 120.64 114.91 1rk7 n GLU 49 Ca -0.16 2.49 -0.60 0.00 0.66 0.00 0.00 57.16 59.54 1rk7 n GLU 49 Cb 0.57 -4.74 -0.09 0.00 0.27 0.00 0.00 31.44 27.45 1rk7 n GLU 49 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1rk7 n GLU 50 N 0.63 0.59 0.00 5.31 -0.58 -1.26 -3.20 120.64 122.14 1rk7 n GLU 50 Ca -0.01 0.20 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 1rk7 n GLU 50 Cb 0.02 -1.86 0.00 0.00 -0.57 0.00 0.00 31.44 29.03 1rk7 n GLU 50 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1rk7 n GLU 51 N 5.66 0.00 -0.57 3.49 4.07 -1.25 -4.88 120.64 127.14 1rk7 n GLU 51 Ca 0.34 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.45 1rk7 n GLU 51 Cb 0.05 0.00 -0.00 0.00 -0.06 0.00 0.00 31.44 31.43 1rk7 n GLU 51 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1rk7 n ASP 52 N 2.74 -3.10 -0.00 4.31 -0.08 -1.19 -4.88 116.55 114.35 1rk7 n ASP 52 Ca 0.00 0.68 0.03 0.00 -1.51 0.00 0.00 54.79 53.99 1rk7 n ASP 52 Cb 0.00 -1.32 -0.04 0.00 2.34 0.00 0.00 41.12 42.11 1rk7 n ASP 52 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1rk7 n ASN 53 N -2.02 0.32 0.00 1.67 0.23 -1.26 -4.88 115.26 109.32 1rk7 n ASN 53 Ca -0.00 -0.66 0.00 0.00 -0.53 0.00 0.00 54.58 53.39 1rk7 n ASN 53 Cb 0.19 1.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.89 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 1rk7 n THR 54 N -1.16 0.00 0.00 5.53 5.66 -1.26 -5.04 114.28 118.02 1rk7 n THR 54 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1rk7 n THR 54 Cb 0.10 -0.11 0.00 0.00 -1.55 0.00 0.00 70.33 68.77 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 -2.46 0.00 0.00 1.79 0.00 -1.26 -4.45 120.51 114.13 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 3.10 3.38 0.00 0.00 -1.26 -4.67 105.19 105.75 1rk7 n GLY 56 Ca 0.00 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 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 -3.81 0.00 -3.44 0.00 -2.24 -1.26 -4.68 114.28 98.85 1rk7 n THR 58 Ca -0.21 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.33 1rk7 n THR 58 Cb 0.65 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.77 1rk7 n THR 58 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1rk7 s SER 59 N 0.41 2.45 0.00 3.42 0.15 -1.26 -4.57 113.70 114.30 1rk7 s SER 59 Ca 0.00 -1.75 0.00 0.00 0.70 0.00 0.00 55.95 54.90 1rk7 s SER 59 Cb 0.00 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1rk7 s SER 59 CO 0.00 -0.32 0.00 0.00 1.20 0.00 0.00 173.24 174.12 1rk7 n ALA 60 N 4.40 2.96 0.00 5.45 0.00 -1.26 -5.14 120.51 126.92 1rk7 n ALA 60 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1rk7 n ALA 60 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 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 1.95 1.07 3.75 0.00 0.00 -1.26 -5.04 105.19 105.66 1rk7 n GLY 61 Ca 0.00 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 4.61 -0.64 1.61 0.04 -1.26 -4.99 135.00 134.37 1rk7 s PRO 62 Ca 0.00 1.76 0.06 0.00 0.04 0.00 0.00 61.00 62.85 1rk7 s PRO 62 Cb 0.00 -3.24 0.26 0.00 0.04 0.00 0.00 34.50 31.56 1rk7 s PRO 62 CO 0.00 0.13 0.80 0.72 0.04 0.00 0.00 177.00 178.68 1rk7 n HIS 63 N 1.92 3.69 -2.10 0.56 8.25 -1.26 -4.87 115.22 121.42 1rk7 n HIS 63 Ca 0.01 -4.10 -0.30 0.00 -0.26 0.00 0.00 57.72 53.07 1rk7 n HIS 63 Cb 0.46 -0.57 0.02 0.00 1.12 0.00 0.00 29.99 31.02 1rk7 n HIS 63 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1rk7 n PHE 64 N 0.70 3.13 -2.88 4.41 3.01 -1.26 -4.77 117.46 119.80 1rk7 n PHE 64 Ca 0.30 -2.71 -0.10 0.00 1.01 0.00 0.00 57.45 55.95 1rk7 n PHE 64 Cb 0.41 -0.55 -0.00 0.00 -0.01 0.00 0.00 39.48 39.32 1rk7 n PHE 64 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1rk7 n ASN 65 N -0.61 -2.65 -0.03 4.37 6.94 -1.26 -4.58 115.26 117.43 1rk7 n ASN 65 Ca 0.46 -2.90 -0.14 0.00 -0.02 0.00 0.00 54.58 51.98 1rk7 n ASN 65 Cb 0.66 1.26 -0.11 0.00 -2.36 0.00 0.00 39.78 39.23 1rk7 n ASN 65 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 1rk7 h PRO 66 N 4.82 0.10 -0.96 -0.53 0.13 -1.86 -3.12 132.00 130.58 1rk7 h PRO 66 Ca 0.05 -0.10 0.15 0.00 -0.87 0.00 0.00 66.00 65.23 1rk7 h PRO 66 Cb 1.05 0.03 -0.10 0.00 0.13 0.00 0.00 31.00 32.11 1rk7 h PRO 66 CO 0.16 0.82 0.57 -0.07 -0.23 0.00 0.00 178.00 179.26 1rk7 h LEU 67 N -0.58 0.76 -2.06 1.56 3.38 -1.90 0.71 115.31 117.18 1rk7 h LEU 67 Ca -0.01 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1rk7 h LEU 67 Cb 0.86 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1rk7 h LEU 67 CO 0.03 0.34 -0.05 -1.28 0.09 0.00 0.00 178.44 177.56 1rk7 h SER 68 N 0.80 0.00 0.00 -0.43 0.87 -1.67 -3.37 113.55 109.75 1rk7 h SER 68 Ca 0.52 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 1rk7 h SER 68 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1rk7 h SER 68 CO -0.33 0.05 0.00 0.54 -0.53 0.00 0.00 176.83 176.56 1rk7 n ARG 69 N -4.16 0.00 0.00 2.24 1.74 0.25 -2.94 116.66 113.79 1rk7 n ARG 69 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1rk7 n ARG 69 Cb 0.14 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.58 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1rk7 n LYS 70 N 0.00 0.00 -1.69 5.56 5.02 -1.26 -4.94 118.16 120.85 1rk7 n LYS 70 Ca 0.00 0.00 -0.55 0.00 -2.02 0.00 0.00 58.31 55.74 1rk7 n LYS 70 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 1rk7 n LYS 70 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1rk7 n HIS 71 N 0.00 2.05 -3.62 2.13 -0.00 0.40 -4.50 115.22 111.67 1rk7 n HIS 71 Ca 0.00 0.44 -0.06 0.00 -0.00 0.00 0.00 57.72 58.10 1rk7 n HIS 71 Cb 0.00 -2.49 -0.05 0.00 -0.00 0.00 0.00 29.99 27.45 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 3.20 -0.04 0.00 1.57 0.00 -1.26 -3.71 107.32 107.07 1rk7 s GLY 72 Ca 0.95 2.59 0.00 0.00 0.00 0.00 0.00 44.72 48.26 1rk7 s GLY 72 CO 0.60 1.28 0.00 0.61 0.00 0.00 0.00 173.10 175.59 1rk7 n GLY 73 N 0.95 0.32 0.16 0.20 0.00 -1.26 -4.87 105.19 100.69 1rk7 n GLY 73 Ca -0.07 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.81 1rk7 n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 h PRO 74 N 0.00 -0.30 0.00 1.61 0.13 -1.99 -3.27 132.00 128.17 1rk7 h PRO 74 Ca 0.00 0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1rk7 h PRO 74 Cb 0.00 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.20 1rk7 h PRO 74 CO 0.00 -0.14 -0.10 0.87 -0.23 0.00 0.00 178.00 178.40 1rk7 h LYS 75 N -1.06 0.00 -5.78 0.86 1.57 -1.98 -3.47 116.57 106.70 1rk7 h LYS 75 Ca -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1rk7 h LYS 75 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1rk7 h LYS 75 CO 0.05 0.10 -1.00 -0.25 -0.57 0.00 0.00 179.45 177.78 1rk7 n ASP 76 N -3.96 -7.28 -0.00 0.86 8.00 -1.24 -4.95 116.55 107.98 1rk7 n ASP 76 Ca -0.02 0.89 0.02 0.00 0.71 0.00 0.00 54.79 56.39 1rk7 n ASP 76 Cb 0.19 -3.42 -0.04 0.00 -0.02 0.00 0.00 41.12 37.83 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1rk7 n GLU 77 N 0.97 1.03 0.00 -1.24 0.00 -1.26 -4.95 120.64 115.20 1rk7 n GLU 77 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 57.16 57.12 1rk7 n GLU 77 Cb 0.27 -1.05 0.00 0.00 0.00 0.00 0.00 31.44 30.66 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 -1.58 0.00 0.00 5.31 -0.58 -1.24 -5.04 120.64 117.50 1rk7 n GLU 78 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1rk7 n GLU 78 Cb 0.12 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.99 1rk7 n GLU 78 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1rk7 n ARG 79 N 0.00 0.00 -0.08 3.49 1.85 -1.15 -4.79 116.66 115.98 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 0.00 0.00 -3.47 2.89 -0.00 -1.26 -3.88 115.22 109.50 1rk7 n HIS 80 Ca 0.00 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.89 1rk7 n HIS 80 Cb 0.00 0.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.75 1rk7 n HIS 80 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1rk7 s VAL 81 N -2.70 0.14 0.00 3.57 1.01 -1.26 -4.96 120.40 116.19 1rk7 s VAL 81 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.33 1rk7 s VAL 81 Cb 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1rk7 s VAL 81 CO 0.00 -0.97 0.00 0.61 0.00 0.00 0.00 175.10 174.74 1rk7 n GLY 82 N 4.12 1.98 3.33 4.51 0.00 -1.26 -3.95 105.19 113.92 1rk7 n GLY 82 Ca 0.11 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1rk7 n GLY 82 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rk7 n ASP 83 N 3.66 -2.81 0.00 1.61 8.00 -1.26 -4.75 116.55 121.00 1rk7 n ASP 83 Ca 0.00 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.76 1rk7 n ASP 83 Cb 0.00 -1.10 0.00 0.00 -0.02 0.00 0.00 41.12 40.00 1rk7 n ASP 83 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1rk7 n LEU 84 N -0.44 0.00 -3.82 0.64 -0.00 -1.26 -4.38 117.00 107.75 1rk7 n LEU 84 Ca 0.05 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 56.00 1rk7 n LEU 84 Cb 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.96 1rk7 n LEU 84 CO 0.51 0.00 0.60 -0.83 -0.00 0.00 0.00 177.39 177.67 1rk7 s GLY 85 N -1.46 -0.07 -0.13 -3.96 0.00 -1.26 -4.66 107.32 95.78 1rk7 s GLY 85 Ca 0.00 -0.20 -0.17 0.00 0.00 0.00 0.00 44.72 44.34 1rk7 s GLY 85 CO 0.00 0.12 0.44 -1.31 0.00 0.00 0.00 173.10 172.35 1rk7 s ASN 86 N -2.99 6.63 0.44 1.64 0.01 -1.26 -3.88 114.94 115.54 1rk7 s ASN 86 Ca 0.13 0.75 0.06 0.00 -0.71 0.00 0.00 52.86 53.09 1rk7 s ASN 86 Cb -0.04 -2.27 0.01 0.00 0.41 0.00 0.00 41.25 39.37 1rk7 s ASN 86 CO 0.06 0.01 0.61 0.68 -1.51 0.00 0.00 177.10 176.95 1rk7 s VAL 87 N 0.63 3.05 0.02 1.60 -7.23 -0.95 -4.82 120.40 112.70 1rk7 s VAL 87 Ca 0.24 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 1rk7 s VAL 87 Cb -0.15 -3.05 -0.02 0.00 0.56 0.00 0.00 36.38 33.72 1rk7 s VAL 87 CO 0.09 -0.02 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.93 1rk7 s THR 88 N -2.44 0.18 0.73 5.32 2.01 -1.26 0.14 115.64 120.33 1rk7 s THR 88 Ca 0.54 -0.77 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 1rk7 s THR 88 Cb -0.10 -0.29 0.07 0.00 0.01 0.00 0.00 72.50 72.19 1rk7 s THR 88 CO 0.34 -0.38 1.05 0.00 -0.69 0.00 0.00 174.62 174.95 1rk7 s ALA 89 N -1.17 3.06 0.00 7.40 0.00 -1.07 -4.56 121.76 125.43 1rk7 s ALA 89 Ca -0.12 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1rk7 s ALA 89 Cb -0.08 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1rk7 s ALA 89 CO -0.01 -1.42 0.00 -3.47 0.00 0.00 0.00 175.76 170.87 1rk7 n ASP 90 N -3.02 0.00 0.00 0.00 2.03 0.14 -4.40 116.55 111.30 1rk7 n ASP 90 Ca 0.09 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.40 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 0.36 -0.76 -0.67 2.85 -1.26 -4.75 118.16 113.92 1rk7 n LYS 91 Ca 0.00 -0.55 -0.02 0.00 -1.05 0.00 0.00 58.31 56.69 1rk7 n LYS 91 Cb 0.00 -0.58 -0.02 0.00 -0.65 0.00 0.00 35.03 33.78 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 -0.27 0.00 -5.58 8.00 -1.26 -4.71 116.55 112.67 1rk7 n ASP 92 Ca 0.00 -1.55 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1rk7 n ASP 92 Cb 0.41 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rk7 n GLY 93 N 0.04 2.93 3.32 0.44 0.00 -1.25 -4.51 105.19 106.16 1rk7 n GLY 93 Ca -0.09 -0.78 -0.46 0.00 0.00 0.00 0.00 46.02 44.68 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 -3.43 1.61 0.31 -1.26 -3.86 118.33 111.70 1rk7 n VAL 94 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1rk7 n VAL 94 Cb 0.00 -0.49 -0.10 0.00 -0.91 0.00 0.00 33.84 32.35 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 7.79 3.48 0.10 3.52 0.00 -1.21 0.25 121.76 135.70 1rk7 s ALA 95 Ca 1.27 -1.46 -0.05 0.00 0.00 0.00 0.00 51.96 51.71 1rk7 s ALA 95 Cb -1.30 -2.86 -0.05 0.00 0.00 0.00 0.00 23.12 18.91 1rk7 s ALA 95 CO 0.53 -1.27 0.34 0.16 0.00 0.00 0.00 175.76 175.52 1rk7 s ASP 96 N 1.73 6.50 0.13 0.00 -4.77 -1.26 0.14 116.67 119.14 1rk7 s ASP 96 Ca 0.09 0.57 0.11 0.00 -3.30 0.00 0.00 52.55 50.02 1rk7 s ASP 96 Cb -0.18 -2.09 -0.04 0.00 -1.09 0.00 0.00 42.92 39.53 1rk7 s ASP 96 CO 0.11 0.12 -0.27 -0.69 0.70 0.00 0.00 175.17 175.14 1rk7 s VAL 97 N -1.54 2.25 -0.33 2.11 1.01 0.55 -4.88 120.40 119.58 1rk7 s VAL 97 Ca 0.37 -1.76 -0.03 0.00 0.00 0.00 0.00 61.98 60.57 1rk7 s VAL 97 Cb -0.13 -1.99 0.19 0.00 0.00 0.00 0.00 36.38 34.45 1rk7 s VAL 97 CO 0.23 0.09 0.85 -0.94 0.00 0.00 0.00 175.10 175.32 1rk7 s SER 98 N -2.06 -0.93 -0.05 3.32 1.04 -1.20 -2.38 113.70 111.44 1rk7 s SER 98 Ca 0.14 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.41 1rk7 s SER 98 Cb -0.10 1.40 0.03 0.00 0.10 0.00 0.00 66.02 67.46 1rk7 s SER 98 CO 0.06 -0.14 0.05 0.27 0.98 0.00 0.00 173.24 174.46 1rk7 s ILE 99 N 2.47 -0.04 -0.82 -1.02 -4.36 0.76 -5.01 121.20 113.18 1rk7 s ILE 99 Ca 0.18 0.35 -0.01 0.00 -0.26 0.00 0.00 60.65 60.92 1rk7 s ILE 99 Cb -0.03 -0.23 0.20 0.00 1.25 0.00 0.00 42.46 43.65 1rk7 s ILE 99 CO -0.19 0.17 0.68 -0.70 0.24 0.00 0.00 174.94 175.14 1rk7 s GLU 100 N 2.14 3.02 0.27 0.37 2.12 -1.26 -1.25 118.70 124.11 1rk7 s GLU 100 Ca 0.05 -3.17 -0.07 0.00 0.36 0.00 0.00 54.97 52.13 1rk7 s GLU 100 Cb -0.12 -3.83 -0.06 0.00 0.26 0.00 0.00 34.13 30.38 1rk7 s GLU 100 CO -0.04 -1.25 0.56 0.34 -0.54 0.00 0.00 175.26 174.34 1rk7 s ASP 101 N -0.24 6.52 -0.47 -1.70 -1.08 -1.26 -4.88 116.67 113.56 1rk7 s ASP 101 Ca 0.25 0.82 0.08 0.00 -0.52 0.00 0.00 52.55 53.19 1rk7 s ASP 101 Cb -0.09 -2.19 0.30 0.00 -1.46 0.00 0.00 42.92 39.48 1rk7 s ASP 101 CO -0.12 -0.16 0.71 -1.54 0.52 0.00 0.00 175.17 174.59 1rk7 n SER 102 N -0.63 1.97 0.00 -0.34 3.41 -1.26 -1.31 113.62 115.46 1rk7 n SER 102 Ca -0.01 -3.14 0.00 0.00 -0.26 0.00 0.00 58.87 55.47 1rk7 n SER 102 Cb 0.53 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 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 0.63 0.00 -0.96 -3.33 0.31 -1.26 -4.87 118.33 108.85 1rk7 n VAL 103 Ca 0.26 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.29 1rk7 n VAL 103 Cb 0.52 -0.15 0.25 0.00 -0.91 0.00 0.00 33.84 33.54 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 -1.67 1.56 -0.30 2.52 -0.00 -1.26 -4.93 121.20 117.12 1rk7 s ILE 104 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 60.65 60.52 1rk7 s ILE 104 Cb 0.00 -2.41 0.16 0.00 -0.00 0.00 0.00 42.46 40.20 1rk7 s ILE 104 CO 0.00 0.00 0.90 -0.44 -0.00 0.00 0.00 174.94 175.40 1rk7 s SER 105 N -3.73 -0.73 0.37 4.36 0.01 -0.64 -4.84 113.70 108.50 1rk7 s SER 105 Ca 0.70 0.98 0.15 0.00 1.31 0.00 0.00 55.95 59.09 1rk7 s SER 105 Cb -0.11 1.82 1.01 0.00 0.21 0.00 0.00 66.02 68.95 1rk7 s SER 105 CO 0.57 -0.14 1.78 -0.07 0.41 0.00 0.00 173.24 175.79 1rk7 h LEU 106 N 7.64 0.53 -8.38 2.44 4.07 -1.93 -2.45 115.31 117.24 1rk7 h LEU 106 Ca -0.16 0.09 -0.57 0.00 0.08 0.00 0.00 57.88 57.32 1rk7 h LEU 106 Cb 1.11 -0.00 -0.29 0.00 1.08 0.00 0.00 40.66 42.56 1rk7 h LEU 106 CO 0.08 0.14 -0.84 -0.44 -1.08 0.00 0.00 178.44 176.30 1rk7 s SER 107 N -5.34 2.22 0.00 -0.43 0.01 -1.26 -4.13 113.70 104.77 1rk7 s SER 107 Ca -0.09 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.80 1rk7 s SER 107 Cb 0.25 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.24 1rk7 s SER 107 CO 0.80 0.22 0.00 0.61 0.41 0.00 0.00 173.24 175.28 1rk7 n GLY 108 N 2.52 1.44 1.41 3.44 0.00 -1.26 -4.81 105.19 107.93 1rk7 n GLY 108 Ca -0.15 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 0.08 -2.92 1.61 9.92 -1.26 -4.88 116.55 119.10 1rk7 n ASP 109 Ca 0.00 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 53.95 1rk7 n ASP 109 Cb 0.00 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 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 -2.28 1.80 -1.63 1.24 8.25 -1.26 -4.93 115.22 116.41 1rk7 n HIS 110 Ca 0.00 -2.44 -0.43 0.00 -0.26 0.00 0.00 57.72 54.59 1rk7 n HIS 110 Cb 0.04 -1.87 -0.03 0.00 1.12 0.00 0.00 29.99 29.24 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 1.20 5.61 0.28 0.41 1.04 -0.92 -1.63 113.70 119.68 1rk7 s SER 111 Ca 0.62 1.97 0.20 0.00 0.48 0.00 0.00 55.95 59.23 1rk7 s SER 111 Cb 0.25 -2.51 0.10 0.00 0.10 0.00 0.00 66.02 63.96 1rk7 s SER 111 CO -0.09 -1.83 1.28 0.16 0.98 0.00 0.00 173.24 173.74 1rk7 h ILE 112 N 6.92 0.25 -3.79 -1.02 3.07 -1.71 -3.46 117.51 117.77 1rk7 h ILE 112 Ca -0.42 -1.39 -0.55 0.00 1.55 0.00 0.00 64.86 64.05 1rk7 h ILE 112 Cb 1.24 1.93 0.12 0.00 -0.27 0.00 0.00 36.82 39.83 1rk7 h ILE 112 CO 0.96 0.14 0.66 -0.38 -1.05 0.00 0.00 178.15 178.48 1rk7 n ILE 113 N -2.96 2.37 0.00 0.16 5.41 -1.26 -3.09 119.36 119.99 1rk7 n ILE 113 Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.25 1rk7 n ILE 113 Cb 0.62 -1.80 0.00 0.00 -0.71 0.00 0.00 39.64 37.75 1rk7 n ILE 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1rk7 n GLY 114 N 0.60 0.89 3.92 7.39 0.00 -1.25 -5.01 105.19 111.74 1rk7 n GLY 114 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.39 2.91 -0.21 1.61 1.81 -1.18 -3.88 118.95 119.63 1rk7 s ARG 115 Ca 0.00 -0.07 -0.10 0.00 -1.72 0.00 0.00 55.73 53.84 1rk7 s ARG 115 Cb 0.00 -2.30 0.08 0.00 -0.45 0.00 0.00 34.95 32.28 1rk7 s ARG 115 CO 0.00 -0.67 0.48 -0.08 -0.68 0.00 0.00 175.30 174.35 1rk7 s THR 116 N -2.95 -0.26 -1.05 0.02 -1.32 -1.26 -1.20 115.64 107.62 1rk7 s THR 116 Ca 0.54 0.09 -0.21 0.00 -1.21 0.00 0.00 61.69 60.90 1rk7 s THR 116 Cb -0.10 -0.73 -0.08 0.00 -1.51 0.00 0.00 72.50 70.07 1rk7 s THR 116 CO 0.44 0.04 1.95 -0.11 -2.21 0.00 0.00 174.62 174.73 1rk7 n LEU 117 N 4.66 4.27 -3.85 9.08 -0.00 -1.24 -0.60 117.00 129.32 1rk7 n LEU 117 Ca -0.18 -3.27 -0.42 0.00 -0.00 0.00 0.00 56.01 52.14 1rk7 n LEU 117 Cb 0.54 -1.45 0.00 0.00 -0.00 0.00 0.00 43.42 42.51 1rk7 n LEU 117 CO 0.03 -0.53 2.32 0.52 -0.00 0.00 0.00 177.39 179.72 1rk7 n VAL 118 N 6.45 3.86 -1.60 1.96 0.31 -1.26 -4.43 118.33 123.63 1rk7 n VAL 118 Ca 0.48 -3.68 -0.48 0.00 -0.01 0.00 0.00 64.34 60.65 1rk7 n VAL 118 Cb 0.43 -2.49 -0.04 0.00 -0.91 0.00 0.00 33.84 30.83 1rk7 n VAL 118 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1rk7 n VAL 119 N 4.43 0.80 -2.97 2.52 0.24 -1.26 -4.00 118.33 118.08 1rk7 n VAL 119 Ca 0.46 -0.20 -0.40 0.00 -2.04 0.00 0.00 64.34 62.17 1rk7 n VAL 119 Cb 0.38 -1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 31.70 1rk7 n VAL 119 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1rk7 s HIS 120 N -0.07 3.75 0.07 6.34 3.76 -1.26 -4.14 115.29 123.74 1rk7 s HIS 120 Ca 0.73 1.50 -0.17 0.00 -0.15 0.00 0.00 55.06 56.97 1rk7 s HIS 120 Cb -0.81 -2.83 -0.06 0.00 1.11 0.00 0.00 32.58 29.99 1rk7 s HIS 120 CO 0.51 0.29 1.29 1.49 -0.85 0.00 0.00 174.74 177.46 1rk7 h GLU 121 N 5.56 -0.22 0.00 1.40 4.81 -1.91 -3.35 114.58 120.88 1rk7 h GLU 121 Ca -0.44 0.02 -0.42 0.00 -0.13 0.00 0.00 59.36 58.38 1rk7 h GLU 121 Cb 1.21 0.05 0.02 0.00 0.63 0.00 0.00 28.75 30.65 1rk7 h GLU 121 CO 0.71 -0.15 -0.08 1.63 -0.73 0.00 0.00 179.01 180.39 1rk7 n LYS 122 N -4.10 0.67 -2.13 1.92 5.02 -1.26 -4.84 118.16 113.44 1rk7 n LYS 122 Ca -0.02 -2.70 -0.21 0.00 -2.02 0.00 0.00 58.31 53.37 1rk7 n LYS 122 Cb 0.18 -0.15 0.12 0.00 -0.02 0.00 0.00 35.03 35.16 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 -2.39 -0.15 -3.66 7.82 0.00 -1.26 -1.53 120.51 119.36 1rk7 n ALA 123 Ca -0.12 -1.62 -0.29 0.00 0.00 0.00 0.00 53.44 51.40 1rk7 n ALA 123 Cb 0.51 0.20 -0.14 0.00 0.00 0.00 0.00 19.45 20.02 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 -4.60 3.69 0.65 0.00 1.01 -1.26 -4.61 116.67 111.55 1rk7 s ASP 124 Ca 0.58 -1.92 0.30 0.00 0.71 0.00 0.00 52.55 52.21 1rk7 s ASP 124 Cb -0.03 -0.76 1.60 0.00 1.01 0.00 0.00 42.92 44.74 1rk7 s ASP 124 CO 0.39 -0.37 1.92 -0.78 0.21 0.00 0.00 175.17 176.54 1rk7 h ASP 125 N 7.62 0.00 -0.87 0.27 3.58 -1.96 -3.44 116.42 121.62 1rk7 h ASP 125 Ca -0.08 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.00 1rk7 h ASP 125 Cb 0.99 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 41.89 1rk7 h ASP 125 CO 0.43 0.00 -0.34 0.18 -2.88 0.00 0.00 179.24 176.64 1rk7 n LEU 126 N -3.07 -1.26 0.00 2.28 4.77 -0.53 -4.82 117.00 114.38 1rk7 n LEU 126 Ca -0.00 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1rk7 n LEU 126 Cb 0.43 -2.69 0.00 0.00 -2.33 0.00 0.00 43.42 38.83 1rk7 n LEU 126 CO 0.16 -1.02 0.00 0.61 -1.33 0.00 0.00 177.39 175.81 1rk7 n GLY 127 N -0.48 -1.53 0.30 -0.72 0.00 -1.23 -4.92 105.19 96.61 1rk7 n GLY 127 Ca -0.18 1.00 0.00 0.00 0.00 0.00 0.00 46.02 46.83 1rk7 n GLY 127 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1rk7 n LYS 128 N 0.00 0.00 -1.23 1.61 2.85 -1.26 -4.97 118.16 115.17 1rk7 n LYS 128 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1rk7 n LYS 128 Cb 0.00 -0.83 0.00 0.00 -0.65 0.00 0.00 35.03 33.56 1rk7 n LYS 128 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1rk7 n GLY 129 N 3.24 -0.67 3.13 2.58 0.00 -1.26 -5.07 105.19 107.13 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 -0.07 -0.39 3.01 -0.02 0.00 -1.26 -5.00 105.19 101.46 1rk7 n GLY 130 Ca -0.01 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.83 0.14 0.50 1.61 2.47 -1.26 -4.81 114.94 112.75 1rk7 s ASN 131 Ca -0.01 -0.33 0.45 0.00 0.42 0.00 0.00 52.86 53.40 1rk7 s ASN 131 Cb 0.00 0.13 1.55 0.00 -1.45 0.00 0.00 41.25 41.48 1rk7 s ASN 131 CO 0.07 -0.28 1.39 -0.62 -3.72 0.00 0.00 177.10 173.95 1rk7 n GLU 132 N 1.78 0.00 -0.05 0.43 4.71 -1.26 0.31 120.64 126.57 1rk7 n GLU 132 Ca -0.22 0.97 -0.22 0.00 -0.01 0.00 0.00 57.16 57.68 1rk7 n GLU 132 Cb 0.56 -2.24 -0.13 0.00 -1.01 0.00 0.00 31.44 28.62 1rk7 n GLU 132 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1rk7 n GLN 133 N -3.71 0.68 -0.00 3.49 3.00 -1.26 -4.29 117.38 115.30 1rk7 n GLN 133 Ca 0.40 0.34 -0.13 0.00 -0.01 0.00 0.00 57.00 57.60 1rk7 n GLN 133 Cb 1.81 -1.69 -0.10 0.00 0.00 0.00 0.00 30.24 30.26 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1rk7 h SER 134 N -0.31 -0.04 -1.07 1.08 4.64 0.27 0.88 113.55 119.01 1rk7 h SER 134 Ca -0.44 -0.49 0.37 0.00 -0.47 0.00 0.00 61.79 60.76 1rk7 h SER 134 Cb 1.79 0.01 -0.11 0.00 -0.31 0.00 0.00 62.40 63.78 1rk7 h SER 134 CO -0.05 0.49 0.68 0.35 -0.87 0.00 0.00 176.83 177.43 1rk7 n THR 135 N -4.86 -0.21 -0.12 2.95 -2.24 0.93 0.54 114.28 111.28 1rk7 n THR 135 Ca -0.09 1.43 -0.18 0.00 -2.27 0.00 0.00 64.05 62.95 1rk7 n THR 135 Cb 0.27 -2.34 -0.11 0.00 -2.10 0.00 0.00 70.33 66.05 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 -4.29 0.58 0.00 -0.78 2.85 -1.18 0.15 118.16 115.49 1rk7 n LYS 136 Ca 0.32 0.15 0.00 0.00 -1.05 0.00 0.00 58.31 57.73 1rk7 n LYS 136 Cb 1.22 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 34.14 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 -3.32 0.00 0.06 0.58 -2.24 0.30 -4.36 114.28 105.31 1rk7 n THR 137 Ca -0.43 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1rk7 n THR 137 Cb 0.93 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 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 1.58 -0.63 0.00 3.38 0.00 -0.89 -1.45 105.19 107.18 1rk7 n GLY 138 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1rk7 n GLY 138 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rk7 n ASN 139 N -2.86 0.00 0.04 1.61 6.94 -1.26 -2.32 115.26 117.41 1rk7 n ASN 139 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1rk7 n ASN 139 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rk7 n ALA 140 N 0.00 2.08 -1.50 -2.53 0.00 -1.26 -5.04 120.51 112.26 1rk7 n ALA 140 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1rk7 n ALA 140 Cb 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 19.45 19.26 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 0.58 -0.48 0.04 0.00 0.00 -1.26 -4.58 105.19 99.49 1rk7 n GLY 141 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 46.02 46.57 1rk7 n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rk7 n SER 142 N 8.15 1.27 -1.60 1.61 7.64 -1.26 -4.99 113.62 124.44 1rk7 n SER 142 Ca 0.66 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 58.74 1rk7 n SER 142 Cb 0.10 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 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 -0.41 -4.57 0.00 1.43 3.00 -1.26 -4.35 116.66 110.50 1rk7 n ARG 143 Ca 0.02 3.39 0.00 0.00 -0.01 0.00 0.00 57.85 61.25 1rk7 n ARG 143 Cb 0.40 -3.81 0.00 0.00 0.00 0.00 0.00 32.46 29.05 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 -0.72 0.00 -4.48 0.55 7.99 -1.26 -4.67 117.00 114.42 1rk7 n LEU 144 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 56.01 55.70 1rk7 n LEU 144 Cb 0.00 0.00 0.25 0.00 -0.11 0.00 0.00 43.42 43.56 1rk7 n LEU 144 CO 0.00 0.00 0.53 0.00 -1.51 0.00 0.00 177.39 176.41 1rk7 s ALA 145 N -2.00 -0.09 -0.46 -1.18 0.00 -1.26 -4.55 121.76 112.22 1rk7 s ALA 145 Ca 0.00 -0.64 0.07 0.00 0.00 0.00 0.00 51.96 51.38 1rk7 s ALA 145 Cb 0.00 -3.02 0.25 0.00 0.00 0.00 0.00 23.12 20.35 1rk7 s ALA 145 CO 0.00 -3.91 0.79 0.00 0.00 0.00 0.00 175.76 172.64 1rk7 n GLY 147 N 1.55 4.26 3.70 0.00 0.00 -1.26 -4.81 105.19 108.63 1rk7 n GLY 147 Ca 0.12 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1rk7 n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rk7 n VAL 148 N 4.90 0.22 -2.74 1.61 0.31 -1.26 -3.67 118.33 117.70 1rk7 n VAL 148 Ca 0.56 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 64.43 1rk7 n VAL 148 Cb 0.36 -2.01 -0.03 0.00 -0.91 0.00 0.00 33.84 31.26 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 2.08 4.79 -0.01 2.52 1.09 -0.34 -4.31 121.20 127.01 1rk7 s ILE 149 Ca 0.80 1.93 -0.01 0.00 -1.10 0.00 0.00 60.65 62.27 1rk7 s ILE 149 Cb -0.52 -4.26 0.00 0.00 -1.06 0.00 0.00 42.46 36.62 1rk7 s ILE 149 CO 0.36 -0.03 0.03 -0.83 -0.10 0.00 0.00 174.94 174.37 1rk7 s GLY 150 N 1.14 -0.01 0.40 6.18 0.00 -0.13 -3.77 107.32 111.14 1rk7 s GLY 150 Ca 0.44 0.10 -0.23 0.00 0.00 0.00 0.00 44.72 45.03 1rk7 s GLY 150 CO 0.14 0.11 0.58 1.39 0.00 0.00 0.00 173.10 175.32 1rk7 n ILE 151 N 3.14 1.81 -4.30 0.90 2.08 -1.26 -1.51 119.36 120.21 1rk7 n ILE 151 Ca -0.13 -0.50 -0.16 0.00 0.56 0.00 0.00 62.75 62.51 1rk7 n ILE 151 Cb 0.59 -0.56 -0.10 0.00 -0.75 0.00 0.00 39.64 38.82 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 -1.42 1.70 0.00 -1.39 0.00 -0.66 -4.77 121.76 115.22 1rk7 s ALA 152 Ca 0.63 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1rk7 s ALA 152 Cb -0.62 1.18 0.00 0.00 0.00 0.00 0.00 23.12 23.68 1rk7 s ALA 152 CO 0.58 -0.52 0.00 0.94 0.00 0.00 0.00 175.76 176.77