#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 2.05 -0.05 0.00 2.01 -0.97 -4.98 115.64 113.69 1rk7 s THR 2 Ca 0.00 -3.66 0.01 0.00 0.31 0.00 0.00 61.69 58.35 1rk7 s THR 2 Cb 0.00 -2.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 1rk7 s THR 2 CO 0.00 -1.06 -0.04 -0.75 -0.69 0.00 0.00 174.62 172.08 1rk7 s LYS 3 N -0.85 2.77 0.22 4.92 2.20 -1.26 -2.06 119.74 125.68 1rk7 s LYS 3 Ca 0.26 -0.56 0.06 0.00 -0.36 0.00 0.00 55.97 55.38 1rk7 s LYS 3 Cb -0.04 -2.63 -0.05 0.00 -1.51 0.00 0.00 37.83 33.60 1rk7 s LYS 3 CO -0.16 0.66 -0.08 0.00 -0.36 0.00 0.00 175.35 175.41 1rk7 s ALA 4 N -0.90 1.95 -0.01 3.13 0.00 0.69 0.59 121.76 127.22 1rk7 s ALA 4 Ca 0.14 -1.71 -0.11 0.00 0.00 0.00 0.00 51.96 50.28 1rk7 s ALA 4 Cb -0.11 0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.16 1rk7 s ALA 4 CO 0.04 -0.07 0.22 0.14 0.00 0.00 0.00 175.76 176.09 1rk7 s VAL 5 N -3.15 0.07 -0.28 0.00 -7.23 -0.03 0.13 120.40 109.92 1rk7 s VAL 5 Ca 0.24 -0.57 -0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1rk7 s VAL 5 Cb 0.02 -0.52 0.11 0.00 0.56 0.00 0.00 36.38 36.56 1rk7 s VAL 5 CO 0.07 -0.31 0.21 0.00 -0.31 0.00 0.00 175.10 174.76 1rk7 s ALA 6 N -1.32 0.06 -0.99 1.32 0.00 0.32 -1.73 121.76 119.42 1rk7 s ALA 6 Ca -0.14 -0.60 -0.21 0.00 0.00 0.00 0.00 51.96 51.01 1rk7 s ALA 6 Cb -0.06 -1.55 0.08 0.00 0.00 0.00 0.00 23.12 21.59 1rk7 s ALA 6 CO 0.03 -1.62 1.33 0.54 0.00 0.00 0.00 175.76 176.04 1rk7 s VAL 7 N 2.24 4.21 0.20 0.00 0.11 -1.26 -1.66 120.40 124.24 1rk7 s VAL 7 Ca 0.09 -1.06 -0.28 0.00 -2.93 0.00 0.00 61.98 57.81 1rk7 s VAL 7 Cb -0.15 -4.96 -0.17 0.00 -1.53 0.00 0.00 36.38 29.57 1rk7 s VAL 7 CO -0.32 -1.78 0.50 0.18 -3.33 0.00 0.00 175.10 170.35 1rk7 n LEU 8 N 8.04 -1.28 -3.30 2.54 7.99 0.10 -4.78 117.00 126.31 1rk7 n LEU 8 Ca 0.30 1.11 0.03 0.00 -0.01 0.00 0.00 56.01 57.44 1rk7 n LEU 8 Cb 0.50 -0.94 -0.04 0.00 -0.11 0.00 0.00 43.42 42.83 1rk7 n LEU 8 CO 0.60 -2.99 0.87 -0.75 -1.51 0.00 0.00 177.39 173.61 1rk7 s LYS 9 N -0.99 0.09 0.00 3.23 2.20 -1.24 -4.08 119.74 118.96 1rk7 s LYS 9 Ca 0.63 0.22 0.00 0.00 -0.36 0.00 0.00 55.97 56.46 1rk7 s LYS 9 Cb -0.91 0.12 0.00 0.00 -1.51 0.00 0.00 37.83 35.52 1rk7 s LYS 9 CO 0.56 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 1rk7 n GLY 10 N 4.40 -2.07 0.38 5.54 0.00 -1.26 -3.69 105.19 108.49 1rk7 n GLY 10 Ca -0.09 0.70 -0.12 0.00 0.00 0.00 0.00 46.02 46.51 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 -1.21 0.00 1.61 1.82 -1.84 -3.47 116.42 113.32 1rk7 h ASP 11 Ca 0.00 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 1rk7 h ASP 11 Cb 0.00 0.49 0.00 0.00 0.68 0.00 0.00 39.33 40.50 1rk7 h ASP 11 CO 0.00 -0.42 0.00 0.61 -1.61 0.00 0.00 179.24 177.82 1rk7 n GLY 12 N -1.43 1.95 0.18 -0.78 0.00 -1.26 -4.92 105.19 98.92 1rk7 n GLY 12 Ca -0.04 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.83 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 0.00 -6.31 1.61 0.13 -1.91 -3.41 132.00 122.11 1rk7 h PRO 13 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 1rk7 h PRO 13 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 1rk7 h PRO 13 CO 0.00 0.38 0.89 0.08 -0.23 0.00 0.00 178.00 179.12 1rk7 s VAL 14 N -3.37 4.04 -0.26 1.56 1.01 -1.23 -3.64 120.40 118.50 1rk7 s VAL 14 Ca 0.02 0.57 0.15 0.00 0.00 0.00 0.00 61.98 62.72 1rk7 s VAL 14 Cb 0.09 -4.74 0.48 0.00 0.00 0.00 0.00 36.38 32.22 1rk7 s VAL 14 CO 0.69 -1.43 1.16 1.67 0.00 0.00 0.00 175.10 177.19 1rk7 n GLN 15 N 8.43 2.59 -0.72 2.72 0.00 -0.34 -3.59 117.38 126.48 1rk7 n GLN 15 Ca 0.05 -3.78 -0.33 0.00 -0.00 0.00 0.00 57.00 52.95 1rk7 n GLN 15 Cb 0.48 -1.89 0.15 0.00 0.00 0.00 0.00 30.24 28.99 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 -0.64 -2.45 2.66 1.69 0.00 -1.26 -4.54 105.19 100.66 1rk7 n GLY 16 Ca 0.26 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.26 -0.21 -0.08 -0.61 1.01 0.32 0.01 121.20 119.38 1rk7 s ILE 17 Ca 0.55 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.91 1rk7 s ILE 17 Cb -0.13 -0.75 -0.02 0.00 0.01 0.00 0.00 42.46 41.57 1rk7 s ILE 17 CO 0.67 -0.37 -0.14 -0.51 0.00 0.00 0.00 174.94 174.59 1rk7 s ILE 18 N 2.22 3.05 0.03 2.92 1.10 -0.66 -0.45 121.20 129.41 1rk7 s ILE 18 Ca 0.06 -0.70 0.05 0.00 -0.51 0.00 0.00 60.65 59.55 1rk7 s ILE 18 Cb -0.16 -2.23 -0.02 0.00 0.15 0.00 0.00 42.46 40.20 1rk7 s ILE 18 CO -0.19 0.56 -0.14 0.20 -2.11 0.00 0.00 174.94 173.26 1rk7 s ASN 19 N -0.25 1.68 -0.13 4.50 0.01 -0.56 0.12 114.94 120.30 1rk7 s ASN 19 Ca 0.01 -0.43 -0.01 0.00 -0.71 0.00 0.00 52.86 51.73 1rk7 s ASN 19 Cb -0.13 -0.12 -0.02 0.00 0.41 0.00 0.00 41.25 41.39 1rk7 s ASN 19 CO 0.03 0.06 -0.10 -0.36 -1.51 0.00 0.00 177.10 175.21 1rk7 s PHE 20 N -0.77 2.87 -0.16 2.20 0.40 0.36 -2.50 117.98 120.39 1rk7 s PHE 20 Ca 0.02 -0.50 -0.01 0.00 -0.60 0.00 0.00 56.93 55.84 1rk7 s PHE 20 Cb -0.07 -1.86 -0.01 0.00 0.51 0.00 0.00 43.02 41.58 1rk7 s PHE 20 CO 0.01 -0.13 -0.10 -2.00 0.70 0.00 0.00 175.22 173.70 1rk7 s GLU 21 N 0.27 3.41 -0.44 0.44 2.56 -0.97 -0.22 118.70 123.75 1rk7 s GLU 21 Ca -0.07 -0.65 0.07 0.00 0.00 0.00 0.00 54.97 54.32 1rk7 s GLU 21 Cb -0.15 -2.75 0.32 0.00 2.00 0.00 0.00 34.13 33.54 1rk7 s GLU 21 CO 0.05 0.11 1.00 0.94 -0.56 0.00 0.00 175.26 176.80 1rk7 n GLN 22 N 3.85 0.98 -1.27 4.30 -0.06 -0.87 -0.56 117.38 123.75 1rk7 n GLN 22 Ca -0.18 -2.27 -0.37 0.00 -2.00 0.00 0.00 57.00 52.18 1rk7 n GLN 22 Cb 0.52 -1.22 -0.03 0.00 -4.06 0.00 0.00 30.24 25.46 1rk7 n GLN 22 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1rk7 n LYS 23 N 0.47 3.43 0.00 3.69 5.02 -1.26 -2.30 118.16 127.21 1rk7 n LYS 23 Ca 0.11 -2.14 0.00 0.00 -2.02 0.00 0.00 58.31 54.26 1rk7 n LYS 23 Cb 0.68 -2.80 0.00 0.00 -0.02 0.00 0.00 35.03 32.89 1rk7 n LYS 23 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1rk7 n GLU 24 N 3.88 0.00 -0.65 1.97 2.13 -1.26 -4.86 120.64 121.85 1rk7 n GLU 24 Ca 0.73 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.55 1rk7 n GLU 24 Cb 0.23 -0.06 0.00 0.00 0.27 0.00 0.00 31.44 31.88 1rk7 n GLU 24 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1rk7 n SER 25 N -1.96 0.00 -0.89 4.31 2.88 -1.19 -4.66 113.62 112.11 1rk7 n SER 25 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1rk7 n SER 25 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 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 -0.78 -0.53 -3.46 0.23 -1.26 -4.74 115.26 104.71 1rk7 n ASN 26 Ca 0.00 -1.58 0.00 0.00 -0.53 0.00 0.00 54.58 52.47 1rk7 n ASN 26 Cb 0.00 0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 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 0.00 6.24 3.73 4.83 0.00 -1.26 -5.08 105.19 113.65 1rk7 n GLY 27 Ca -0.22 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 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 0.08 4.51 -0.98 1.61 0.04 -1.26 -4.70 135.00 134.31 1rk7 s PRO 28 Ca 0.00 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 62.61 1rk7 s PRO 28 Cb 0.00 -3.32 0.16 0.00 0.04 0.00 0.00 34.50 31.39 1rk7 s PRO 28 CO 0.00 -0.09 1.13 0.08 0.04 0.00 0.00 177.00 178.16 1rk7 s VAL 29 N 0.41 5.01 -0.87 -0.36 1.01 -0.41 -4.61 120.40 120.57 1rk7 s VAL 29 Ca 0.54 -2.04 -0.26 0.00 0.00 0.00 0.00 61.98 60.21 1rk7 s VAL 29 Cb -0.29 -4.74 -0.16 0.00 0.00 0.00 0.00 36.38 31.19 1rk7 s VAL 29 CO 0.32 -1.43 2.32 -0.54 0.00 0.00 0.00 175.10 175.77 1rk7 s LYS 30 N 1.82 1.53 0.04 2.72 1.02 0.27 -4.38 119.74 122.76 1rk7 s LYS 30 Ca 0.32 0.22 -0.19 0.00 0.02 0.00 0.00 55.97 56.35 1rk7 s LYS 30 Cb -0.06 -4.85 -0.06 0.00 -0.52 0.00 0.00 37.83 32.35 1rk7 s LYS 30 CO -0.07 -4.68 0.55 0.08 -0.92 0.00 0.00 175.35 170.31 1rk7 s VAL 31 N 15.18 4.83 -0.25 3.17 1.01 -0.74 -2.30 120.40 141.30 1rk7 s VAL 31 Ca 0.89 1.17 -0.26 0.00 0.00 0.00 0.00 61.98 63.78 1rk7 s VAL 31 Cb -0.11 -3.88 0.12 0.00 0.00 0.00 0.00 36.38 32.51 1rk7 s VAL 31 CO 0.10 0.52 1.01 -1.66 0.00 0.00 0.00 175.10 175.07 1rk7 s TRP 32 N -0.83 -0.46 0.00 5.22 -2.14 -1.04 -1.17 118.94 118.51 1rk7 s TRP 32 Ca 0.29 1.05 0.00 0.00 2.66 0.00 0.00 56.10 60.10 1rk7 s TRP 32 Cb -0.19 0.38 0.00 0.00 -3.10 0.00 0.00 33.47 30.56 1rk7 s TRP 32 CO 0.18 -0.26 0.00 0.41 -2.66 0.00 0.00 176.95 174.61 1rk7 n GLY 33 N 1.88 2.85 3.53 3.67 0.00 -1.10 -1.49 105.19 114.53 1rk7 n GLY 33 Ca -0.12 -1.27 -0.04 0.00 0.00 0.00 0.00 46.02 44.58 1rk7 n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 s SER 34 N -0.94 -0.86 0.67 1.61 0.01 0.40 -2.14 113.70 112.45 1rk7 s SER 34 Ca 0.00 1.38 -0.08 0.00 1.31 0.00 0.00 55.95 58.56 1rk7 s SER 34 Cb 0.00 1.84 0.03 0.00 0.21 0.00 0.00 66.02 68.10 1rk7 s SER 34 CO 0.00 -0.22 1.00 -0.63 0.41 0.00 0.00 173.24 173.80 1rk7 s ILE 35 N 2.55 3.00 -0.26 1.44 1.01 0.36 0.12 121.20 129.41 1rk7 s ILE 35 Ca -0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 1rk7 s ILE 35 Cb -0.11 -3.26 0.14 0.00 0.01 0.00 0.00 42.46 39.24 1rk7 s ILE 35 CO -0.17 -0.29 0.52 -0.54 0.00 0.00 0.00 174.94 174.46 1rk7 s LYS 36 N -5.20 0.46 0.00 2.79 1.02 -1.26 -3.54 119.74 114.02 1rk7 s LYS 36 Ca 0.58 1.01 0.00 0.00 0.02 0.00 0.00 55.97 57.58 1rk7 s LYS 36 Cb -0.11 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 1rk7 s LYS 36 CO 0.46 -0.44 0.00 0.41 -0.92 0.00 0.00 175.35 174.86 1rk7 n GLY 37 N 5.41 3.81 0.00 -3.33 0.00 -1.24 -1.20 105.19 108.64 1rk7 n GLY 37 Ca -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 -3.92 0.99 4.32 -1.26 -4.89 117.00 112.24 1rk7 n LEU 38 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.89 1rk7 n LEU 38 Cb 0.00 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 41.69 1rk7 n LEU 38 CO 0.00 -1.28 -0.29 0.42 -1.22 0.00 0.00 177.39 175.01 1rk7 s THR 39 N -0.63 0.08 -0.72 -5.08 -4.23 -1.26 -3.64 115.64 100.16 1rk7 s THR 39 Ca 0.00 -0.63 -0.35 0.00 -1.18 0.00 0.00 61.69 59.52 1rk7 s THR 39 Cb 0.00 -0.27 -0.19 0.00 1.34 0.00 0.00 72.50 73.39 1rk7 s THR 39 CO 0.00 -0.35 2.44 1.21 -0.54 0.00 0.00 174.62 177.38 1rk7 n GLU 40 N 1.90 0.21 -3.74 3.99 2.13 -1.26 -4.45 120.64 119.42 1rk7 n GLU 40 Ca -0.21 0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.65 1rk7 n GLU 40 Cb 0.56 -1.77 0.00 0.00 0.27 0.00 0.00 31.44 30.50 1rk7 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rk7 n GLY 41 N 6.79 -2.26 3.73 8.31 0.00 -1.26 -4.93 105.19 115.58 1rk7 n GLY 41 Ca 0.57 -1.22 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rk7 s LEU 42 N 0.00 4.34 0.10 0.99 1.02 -1.26 -1.51 118.68 122.35 1rk7 s LEU 42 Ca 0.00 1.06 0.04 0.00 0.02 0.00 0.00 54.13 55.25 1rk7 s LEU 42 Cb 0.00 -2.91 -0.04 0.00 0.02 0.00 0.00 46.19 43.26 1rk7 s LEU 42 CO 0.00 -0.01 0.03 -1.00 0.02 0.00 0.00 176.35 175.39 1rk7 s HIS 43 N 0.42 3.05 1.00 0.29 3.76 0.33 -3.52 115.29 120.62 1rk7 s HIS 43 Ca 0.32 0.00 -0.19 0.00 -0.15 0.00 0.00 55.06 55.04 1rk7 s HIS 43 Cb -0.17 -1.55 -0.13 0.00 1.11 0.00 0.00 32.58 31.84 1rk7 s HIS 43 CO 0.15 0.50 -0.78 0.41 -0.85 0.00 0.00 174.74 174.17 1rk7 n GLY 44 N 0.45 -3.90 3.70 -2.22 0.00 -0.82 -2.61 105.19 99.79 1rk7 n GLY 44 Ca -0.10 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.06 3.51 1.26 1.61 0.40 -1.26 -4.22 117.98 117.22 1rk7 s PHE 45 Ca 0.42 1.52 -0.18 0.00 -0.60 0.00 0.00 56.93 58.09 1rk7 s PHE 45 Cb -0.12 -3.24 0.31 0.00 0.51 0.00 0.00 43.02 40.48 1rk7 s PHE 45 CO 0.77 -0.51 1.02 -3.38 0.70 0.00 0.00 175.22 173.82 1rk7 s HIS 46 N 1.42 0.44 -0.55 0.36 -3.43 -1.20 -4.44 115.29 107.87 1rk7 s HIS 46 Ca 0.53 0.73 -0.03 0.00 -0.80 0.00 0.00 55.06 55.50 1rk7 s HIS 46 Cb -0.23 -3.13 -0.03 0.00 -1.43 0.00 0.00 32.58 27.76 1rk7 s HIS 46 CO 0.25 -4.23 0.48 0.28 -2.00 0.00 0.00 174.74 169.53 1rk7 n VAL 47 N -5.09 -5.19 -4.02 -5.38 0.31 -1.05 -4.54 118.33 93.36 1rk7 n VAL 47 Ca 0.09 -0.69 -0.08 0.00 -0.01 0.00 0.00 64.34 63.66 1rk7 n VAL 47 Cb 0.58 -4.80 -0.09 0.00 -0.91 0.00 0.00 33.84 28.62 1rk7 n VAL 47 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1rk7 s HIS 48 N -3.20 0.42 -0.30 3.52 4.02 -1.26 -4.50 115.29 113.98 1rk7 s HIS 48 Ca 0.23 -0.92 -0.10 0.00 1.02 0.00 0.00 55.06 55.29 1rk7 s HIS 48 Cb -0.03 -0.29 0.17 0.00 -1.02 0.00 0.00 32.58 31.41 1rk7 s HIS 48 CO 0.39 -0.44 0.83 -2.00 1.02 0.00 0.00 174.74 174.54 1rk7 s GLU 49 N -3.91 0.40 0.00 1.40 2.56 -1.26 -5.01 118.70 112.88 1rk7 s GLU 49 Ca 0.07 0.86 0.00 0.00 0.00 0.00 0.00 54.97 55.90 1rk7 s GLU 49 Cb 0.07 0.50 0.00 0.00 2.00 0.00 0.00 34.13 36.70 1rk7 s GLU 49 CO -0.10 -0.28 0.00 -1.91 -0.56 0.00 0.00 175.26 172.41 1rk7 n GLU 50 N 5.30 -3.16 0.00 4.30 0.00 -1.26 -2.94 120.64 122.88 1rk7 n GLU 50 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.09 1rk7 n GLU 50 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.96 1rk7 n GLU 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1rk7 n GLU 51 N -0.26 0.00 -3.25 5.31 4.07 -1.26 -4.65 120.64 120.60 1rk7 n GLU 51 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 1rk7 n GLU 51 Cb 0.00 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.31 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1rk7 s ASP 52 N 0.00 6.55 -0.66 4.31 1.11 -1.26 -4.96 116.67 121.77 1rk7 s ASP 52 Ca 0.00 0.66 0.00 0.00 0.18 0.00 0.00 52.55 53.40 1rk7 s ASP 52 Cb 0.00 -2.29 0.41 0.00 1.07 0.00 0.00 42.92 42.11 1rk7 s ASP 52 CO 0.00 -0.18 1.78 0.59 1.18 0.00 0.00 175.17 178.54 1rk7 n ASN 53 N 4.82 6.83 -0.08 0.27 3.02 -1.26 -4.41 115.26 124.45 1rk7 n ASN 53 Ca -0.05 -3.79 -0.09 0.00 -0.03 0.00 0.00 54.58 50.62 1rk7 n ASN 53 Cb 0.50 -0.85 -0.11 0.00 -0.61 0.00 0.00 39.78 38.71 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1rk7 n THR 54 N -0.68 1.01 -1.94 3.41 5.66 -1.26 -5.10 114.28 115.39 1rk7 n THR 54 Ca 0.53 -0.55 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1rk7 n THR 54 Cb 0.53 -0.78 0.00 0.00 -1.55 0.00 0.00 70.33 68.53 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 -2.69 -2.22 -2.59 1.79 0.00 -1.26 -5.04 120.51 108.50 1rk7 n ALA 55 Ca -0.26 0.39 -0.02 0.00 0.00 0.00 0.00 53.44 53.55 1rk7 n ALA 55 Cb 0.93 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 1.49 -0.70 1.55 0.00 0.00 -1.26 -4.90 105.19 101.37 1rk7 n GLY 56 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.37 0.80 -3.65 0.00 5.66 -1.26 -4.97 114.28 108.49 1rk7 n THR 58 Ca 0.00 -0.35 -0.28 0.00 -3.05 0.00 0.00 64.05 60.37 1rk7 n THR 58 Cb 0.00 -0.93 0.01 0.00 -1.55 0.00 0.00 70.33 67.87 1rk7 n THR 58 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1rk7 n SER 59 N -2.78 -4.71 0.04 1.09 3.41 -1.26 -4.76 113.62 104.65 1rk7 n SER 59 Ca -0.23 -0.73 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 1rk7 n SER 59 Cb 0.79 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 1rk7 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rk7 n ALA 60 N -1.89 0.00 -2.96 7.33 0.00 -1.26 -5.06 120.51 116.66 1rk7 n ALA 60 Ca -0.25 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.07 1rk7 n ALA 60 Cb 0.66 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.09 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 -1.46 0.40 2.50 0.00 0.00 -1.26 -5.03 105.19 100.34 1rk7 n GLY 61 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1rk7 n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 62 N 2.74 2.76 -2.89 1.61 -0.04 -1.26 -4.19 135.00 133.73 1rk7 n PRO 62 Ca 0.21 -1.80 -0.12 0.00 -0.04 0.00 0.00 63.50 61.75 1rk7 n PRO 62 Cb 0.54 -2.63 0.05 0.00 -0.04 0.00 0.00 33.50 31.42 1rk7 n PRO 62 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1rk7 n HIS 63 N 4.07 -1.47 -1.21 0.54 1.44 -1.15 -4.11 115.22 113.34 1rk7 n HIS 63 Ca 0.59 -2.77 0.00 0.00 -2.01 0.00 0.00 57.72 53.53 1rk7 n HIS 63 Cb 0.18 0.75 0.00 0.00 0.12 0.00 0.00 29.99 31.05 1rk7 n HIS 63 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1rk7 n PHE 64 N 0.22 -0.20 -3.82 -1.40 3.72 -1.15 -4.89 117.46 109.94 1rk7 n PHE 64 Ca 0.12 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.43 1rk7 n PHE 64 Cb 0.71 0.04 -0.07 0.00 -0.94 0.00 0.00 39.48 39.22 1rk7 n PHE 64 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1rk7 s ASN 65 N -4.00 0.05 -0.06 4.37 0.01 -1.26 -5.02 114.94 109.03 1rk7 s ASN 65 Ca 0.00 -0.56 -0.25 0.00 -0.71 0.00 0.00 52.86 51.33 1rk7 s ASN 65 Cb 0.00 0.36 -0.23 0.00 0.41 0.00 0.00 41.25 41.79 1rk7 s ASN 65 CO 0.00 -0.74 1.04 1.55 -1.51 0.00 0.00 177.10 177.45 1rk7 h PRO 66 N 2.74 0.11 -0.94 -0.60 0.13 -1.90 -2.19 132.00 129.34 1rk7 h PRO 66 Ca -0.34 -0.11 0.18 0.00 -0.87 0.00 0.00 66.00 64.87 1rk7 h PRO 66 Cb 1.21 0.03 -0.18 0.00 0.13 0.00 0.00 31.00 32.19 1rk7 h PRO 66 CO 0.54 0.83 -0.25 1.28 -0.23 0.00 0.00 178.00 180.17 1rk7 n LEU 67 N -4.61 -0.37 -0.06 1.56 4.77 -1.26 0.12 117.00 117.15 1rk7 n LEU 67 Ca -0.09 1.63 -0.14 0.00 -0.03 0.00 0.00 56.01 57.37 1rk7 n LEU 67 Cb 0.44 -0.48 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 1rk7 n LEU 67 CO 0.37 -1.55 0.49 -1.28 -1.33 0.00 0.00 177.39 174.09 1rk7 h SER 68 N 0.00 0.68 0.00 -1.43 0.87 -1.73 -3.36 113.55 108.58 1rk7 h SER 68 Ca 0.44 -0.54 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1rk7 h SER 68 Cb 0.67 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1rk7 h SER 68 CO -0.97 1.08 0.00 0.54 -0.53 0.00 0.00 176.83 176.96 1rk7 n ARG 69 N -4.27 0.00 -0.38 2.24 5.12 0.33 -0.43 116.66 119.26 1rk7 n ARG 69 Ca -0.06 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 55.91 1rk7 n ARG 69 Cb 0.51 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.80 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1rk7 n LYS 70 N 0.00 -0.83 -2.54 5.56 5.02 -1.26 -4.96 118.16 119.14 1rk7 n LYS 70 Ca 0.00 0.61 -0.02 0.00 -2.02 0.00 0.00 58.31 56.88 1rk7 n LYS 70 Cb 0.00 -0.99 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 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 -2.88 -2.22 0.00 2.13 -0.00 -0.07 -4.94 115.22 107.24 1rk7 n HIS 71 Ca -0.01 0.87 0.00 0.00 -0.00 0.00 0.00 57.72 58.58 1rk7 n HIS 71 Cb 0.18 -3.33 0.00 0.00 -0.00 0.00 0.00 29.99 26.84 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rk7 n GLY 72 N -1.12 -0.29 3.60 1.57 0.00 -1.25 -5.01 105.19 102.69 1rk7 n GLY 72 Ca 0.03 0.40 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 1rk7 n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk7 s GLY 73 N 0.00 1.75 -0.92 -0.02 0.00 -1.26 -4.96 107.32 101.91 1rk7 s GLY 73 Ca 0.00 -0.85 -0.24 0.00 0.00 0.00 0.00 44.72 43.63 1rk7 s GLY 73 CO 0.00 -0.55 1.67 2.56 0.00 0.00 0.00 173.10 176.78 1rk7 s PRO 74 N -0.67 3.06 -0.62 2.90 0.04 -1.26 -2.96 135.00 135.50 1rk7 s PRO 74 Ca 0.10 -0.58 0.00 0.00 0.04 0.00 0.00 61.00 60.56 1rk7 s PRO 74 Cb -0.12 -5.07 0.00 0.00 0.04 0.00 0.00 34.50 29.35 1rk7 s PRO 74 CO 0.02 -2.72 0.00 1.17 0.04 0.00 0.00 177.00 175.51 1rk7 n LYS 75 N 8.94 -0.57 0.00 4.56 0.00 -1.20 -4.91 118.16 124.98 1rk7 n LYS 75 Ca 0.33 0.36 0.00 0.00 0.00 0.00 0.00 58.31 58.99 1rk7 n LYS 75 Cb 0.49 -4.25 0.00 0.00 0.00 0.00 0.00 35.03 31.27 1rk7 n LYS 75 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1rk7 n ASP 76 N 0.63 0.00 -1.35 3.14 9.92 -1.17 -4.86 116.55 122.86 1rk7 n ASP 76 Ca -0.09 0.00 0.12 0.00 -0.53 0.00 0.00 54.79 54.29 1rk7 n ASP 76 Cb 0.56 0.00 0.32 0.00 -0.64 0.00 0.00 41.12 41.36 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1rk7 n GLU 77 N -1.68 2.71 0.00 -1.24 2.13 -1.25 -4.97 120.64 116.34 1rk7 n GLU 77 Ca 0.00 -2.65 0.00 0.00 0.66 0.00 0.00 57.16 55.17 1rk7 n GLU 77 Cb 0.00 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.14 1rk7 n GLU 77 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1rk7 n GLU 78 N 1.66 0.00 -1.02 5.31 4.07 -1.15 -4.62 120.64 124.89 1rk7 n GLU 78 Ca 0.24 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.36 1rk7 n GLU 78 Cb 0.63 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.00 1rk7 n GLU 78 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1rk7 n ARG 79 N 0.00 -2.64 0.00 5.31 0.00 0.43 -3.23 116.66 116.53 1rk7 n ARG 79 Ca 0.00 2.06 0.00 0.00 -0.00 0.00 0.00 57.85 59.91 1rk7 n ARG 79 Cb 0.00 -2.61 0.00 0.00 0.00 0.00 0.00 32.46 29.85 1rk7 n ARG 79 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1rk7 n HIS 80 N -2.38 0.00 -3.17 -0.14 8.25 -1.26 -4.67 115.22 111.85 1rk7 n HIS 80 Ca -0.01 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.24 1rk7 n HIS 80 Cb 0.33 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.39 1rk7 n HIS 80 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1rk7 n VAL 81 N 0.00 -0.47 0.00 1.59 0.31 -1.26 -4.80 118.33 113.69 1rk7 n VAL 81 Ca 0.00 -4.14 0.00 0.00 -0.01 0.00 0.00 64.34 60.19 1rk7 n VAL 81 Cb 0.00 -1.18 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 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 0.96 -1.36 3.61 2.92 0.00 -1.26 -4.23 105.19 105.84 1rk7 n GLY 82 Ca 0.22 0.50 -0.53 0.00 0.00 0.00 0.00 46.02 46.21 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 0.00 1.69 0.02 1.61 8.00 -1.26 -4.69 116.55 121.91 1rk7 n ASP 83 Ca 0.00 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.61 1rk7 n ASP 83 Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.93 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 2.97 0.06 0.00 0.64 0.00 -1.26 -4.52 117.00 114.88 1rk7 n LEU 84 Ca 0.20 0.05 0.00 0.00 0.00 0.00 0.00 56.01 56.26 1rk7 n LEU 84 Cb 0.17 0.01 0.00 0.00 0.00 0.00 0.00 43.42 43.61 1rk7 n LEU 84 CO 0.66 -0.35 0.00 0.61 0.00 0.00 0.00 177.39 178.30 1rk7 n GLY 85 N 2.21 1.72 3.85 -3.96 0.00 -1.26 -5.02 105.19 102.72 1rk7 n GLY 85 Ca 0.00 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 6.74 -0.11 1.61 0.01 -1.26 -3.97 114.94 117.95 1rk7 s ASN 86 Ca 0.00 1.24 -0.01 0.00 -0.71 0.00 0.00 52.86 53.38 1rk7 s ASN 86 Cb 0.00 -2.36 -0.03 0.00 0.41 0.00 0.00 41.25 39.27 1rk7 s ASN 86 CO 0.00 -0.22 -0.07 0.68 -1.51 0.00 0.00 177.10 175.98 1rk7 s VAL 87 N -2.02 3.65 0.05 1.60 -7.23 -1.07 -4.91 120.40 110.46 1rk7 s VAL 87 Ca 0.54 -0.47 0.03 0.00 -1.81 0.00 0.00 61.98 60.27 1rk7 s VAL 87 Cb -0.10 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.26 1rk7 s VAL 87 CO 0.19 0.54 0.02 -0.89 -0.31 0.00 0.00 175.10 174.65 1rk7 s THR 88 N -0.11 4.22 0.79 5.32 2.01 -1.26 0.12 115.64 126.72 1rk7 s THR 88 Ca 0.01 -0.75 -0.07 0.00 0.31 0.00 0.00 61.69 61.19 1rk7 s THR 88 Cb -0.13 -2.96 0.13 0.00 0.01 0.00 0.00 72.50 69.55 1rk7 s THR 88 CO 0.03 0.24 1.10 0.00 -0.69 0.00 0.00 174.62 175.29 1rk7 s ALA 89 N -1.23 3.11 0.00 7.40 0.00 -0.57 -4.47 121.76 126.00 1rk7 s ALA 89 Ca 0.24 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1rk7 s ALA 89 Cb -0.12 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.60 1rk7 s ALA 89 CO 0.15 -1.71 0.00 -3.47 0.00 0.00 0.00 175.76 170.74 1rk7 n ASP 90 N -3.14 0.00 0.00 0.00 2.03 0.52 -4.58 116.55 111.39 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 0.56 -0.81 -0.67 2.85 -1.26 -4.77 118.16 114.06 1rk7 n LYS 91 Ca 0.00 -0.64 -0.03 0.00 -1.05 0.00 0.00 58.31 56.59 1rk7 n LYS 91 Cb 0.00 -0.62 -0.03 0.00 -0.65 0.00 0.00 35.03 33.73 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 -0.10 -0.41 0.00 -5.58 8.00 -1.26 -4.76 116.55 112.44 1rk7 n ASP 92 Ca 0.00 -1.60 0.00 0.00 0.71 0.00 0.00 54.79 53.90 1rk7 n ASP 92 Cb 0.40 0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 0.03 2.78 3.37 0.44 0.00 -1.24 -4.54 105.19 106.04 1rk7 n GLY 93 Ca -0.13 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.80 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 -3.54 1.61 0.31 -1.26 -3.86 118.33 111.59 1rk7 n VAL 94 Ca 0.00 -0.09 -0.41 0.00 -0.01 0.00 0.00 64.34 63.84 1rk7 n VAL 94 Cb 0.00 -0.39 -0.11 0.00 -0.91 0.00 0.00 33.84 32.43 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 7.11 3.42 0.01 3.52 0.00 -1.23 -0.35 121.76 134.24 1rk7 s ALA 95 Ca 1.30 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 51.77 1rk7 s ALA 95 Cb -1.14 -2.66 -0.03 0.00 0.00 0.00 0.00 23.12 19.28 1rk7 s ALA 95 CO 0.49 -1.16 -0.08 0.34 0.00 0.00 0.00 175.76 175.35 1rk7 s ASP 96 N 1.66 4.51 0.31 0.00 -1.08 -1.26 0.14 116.67 120.95 1rk7 s ASP 96 Ca 0.05 -0.18 0.10 0.00 -0.52 0.00 0.00 52.55 52.00 1rk7 s ASP 96 Cb -0.18 -1.01 -0.06 0.00 -1.46 0.00 0.00 42.92 40.21 1rk7 s ASP 96 CO 0.09 0.28 -0.13 -0.69 0.52 0.00 0.00 175.17 175.23 1rk7 s VAL 97 N -0.99 2.25 -0.32 1.11 1.01 -0.91 -4.91 120.40 117.64 1rk7 s VAL 97 Ca 0.17 -2.28 -0.02 0.00 0.00 0.00 0.00 61.98 59.85 1rk7 s VAL 97 Cb -0.11 -2.47 0.19 0.00 0.00 0.00 0.00 36.38 33.99 1rk7 s VAL 97 CO 0.07 -0.31 0.84 -0.55 0.00 0.00 0.00 175.10 175.15 1rk7 s SER 98 N -3.54 -0.96 0.02 3.32 0.15 -1.24 -2.70 113.70 108.74 1rk7 s SER 98 Ca 0.31 -0.12 0.06 0.00 0.70 0.00 0.00 55.95 56.90 1rk7 s SER 98 Cb -0.00 1.44 -0.02 0.00 -1.71 0.00 0.00 66.02 65.73 1rk7 s SER 98 CO 0.15 -0.15 -0.19 -0.63 1.20 0.00 0.00 173.24 173.62 1rk7 s ILE 99 N 2.49 1.51 -0.53 6.45 1.01 -0.32 -5.01 121.20 126.80 1rk7 s ILE 99 Ca 0.18 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.84 1rk7 s ILE 99 Cb -0.03 -1.30 0.15 0.00 0.01 0.00 0.00 42.46 41.28 1rk7 s ILE 99 CO -0.19 0.25 0.32 -0.70 0.00 0.00 0.00 174.94 174.62 1rk7 s GLU 100 N -0.91 1.75 -0.10 2.79 2.12 -1.26 -1.80 118.70 121.29 1rk7 s GLU 100 Ca 0.06 -2.53 -0.03 0.00 0.36 0.00 0.00 54.97 52.84 1rk7 s GLU 100 Cb -0.08 -2.81 -0.03 0.00 0.26 0.00 0.00 34.13 31.47 1rk7 s GLU 100 CO 0.01 -1.20 0.00 -0.51 -0.54 0.00 0.00 175.26 173.02 1rk7 s ASP 101 N -0.31 5.21 -0.27 -1.70 1.11 -1.26 -4.94 116.67 114.51 1rk7 s ASP 101 Ca 0.21 0.10 0.09 0.00 0.18 0.00 0.00 52.55 53.13 1rk7 s ASP 101 Cb -0.17 -1.56 0.46 0.00 1.07 0.00 0.00 42.92 42.72 1rk7 s ASP 101 CO -0.06 0.33 1.33 -1.54 1.18 0.00 0.00 175.17 176.42 1rk7 n SER 102 N 2.46 2.68 -0.10 0.27 3.41 -1.26 -1.29 113.62 119.79 1rk7 n SER 102 Ca -0.18 -3.84 -0.21 0.00 -0.26 0.00 0.00 58.87 54.38 1rk7 n SER 102 Cb 0.53 -0.55 -0.07 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 -1.05 1.07 -0.80 -3.33 0.31 -1.26 -4.79 118.33 108.47 1rk7 n VAL 103 Ca 0.30 -0.27 -0.20 0.00 -0.01 0.00 0.00 64.34 64.16 1rk7 n VAL 103 Cb 0.86 -1.77 0.17 0.00 -0.91 0.00 0.00 33.84 32.20 1rk7 n VAL 103 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1rk7 n ILE 104 N -3.87 0.00 -3.62 2.52 -0.00 -1.26 -4.94 119.36 108.19 1rk7 n ILE 104 Ca -0.38 -0.30 -0.05 0.00 -0.00 0.00 0.00 62.75 62.03 1rk7 n ILE 104 Cb 0.77 -1.11 -0.04 0.00 -0.00 0.00 0.00 39.64 39.26 1rk7 n ILE 104 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 1rk7 s SER 105 N -3.44 -0.14 0.00 7.28 0.15 -1.26 -4.86 113.70 111.42 1rk7 s SER 105 Ca 0.48 0.12 0.16 0.00 0.70 0.00 0.00 55.95 57.41 1rk7 s SER 105 Cb -0.05 0.12 0.53 0.00 -1.71 0.00 0.00 66.02 64.91 1rk7 s SER 105 CO 0.37 -0.15 1.41 0.18 1.20 0.00 0.00 173.24 176.24 1rk7 n LEU 106 N 0.43 1.86 0.00 3.45 4.32 -1.26 0.15 117.00 125.96 1rk7 n LEU 106 Ca -0.02 -0.86 -0.21 0.00 -0.02 0.00 0.00 56.01 54.89 1rk7 n LEU 106 Cb 0.58 -0.18 0.10 0.00 -1.62 0.00 0.00 43.42 42.31 1rk7 n LEU 106 CO 0.10 0.43 0.50 -1.20 -1.22 0.00 0.00 177.39 176.00 1rk7 n SER 107 N 0.48 1.40 -4.58 -1.43 7.64 -1.26 -4.71 113.62 111.16 1rk7 n SER 107 Ca 0.14 -2.14 -0.33 0.00 1.01 0.00 0.00 58.87 57.55 1rk7 n SER 107 Cb 0.33 -0.58 -0.04 0.00 -1.01 0.00 0.00 64.21 62.91 1rk7 n SER 107 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1rk7 s GLY 108 N -4.88 0.62 0.27 0.23 0.00 -1.26 -2.67 107.32 99.64 1rk7 s GLY 108 Ca 0.62 -2.40 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1rk7 s GLY 108 CO 0.41 3.30 0.00 1.22 0.00 0.00 0.00 173.10 178.03 1rk7 n ASP 109 N 12.54 -2.42 -0.05 1.64 8.00 -1.26 -4.99 116.55 130.01 1rk7 n ASP 109 Ca 0.46 0.69 -0.08 0.00 0.71 0.00 0.00 54.79 56.58 1rk7 n ASP 109 Cb 0.46 2.44 -0.04 0.00 -0.02 0.00 0.00 41.12 43.96 1rk7 n ASP 109 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1rk7 n HIS 110 N -3.19 0.00 -3.01 1.24 8.25 -1.23 -5.03 115.22 112.25 1rk7 n HIS 110 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 1rk7 n HIS 110 Cb 0.00 -0.37 -0.01 0.00 1.12 0.00 0.00 29.99 30.73 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 -2.93 -6.45 0.16 0.41 2.88 0.41 -4.84 113.62 103.25 1rk7 n SER 111 Ca -0.18 0.84 0.12 0.00 -1.33 0.00 0.00 58.87 58.32 1rk7 n SER 111 Cb 0.67 -2.68 0.09 0.00 -0.75 0.00 0.00 64.21 61.55 1rk7 n SER 111 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1rk7 h ILE 112 N 3.92 0.00 -2.22 2.46 3.07 -1.78 -3.46 117.51 119.50 1rk7 h ILE 112 Ca -0.06 -0.98 -0.59 0.00 1.55 0.00 0.00 64.86 64.78 1rk7 h ILE 112 Cb 0.59 1.74 0.06 0.00 -0.27 0.00 0.00 36.82 38.94 1rk7 h ILE 112 CO 0.02 0.00 0.78 -0.38 -1.05 0.00 0.00 178.15 177.52 1rk7 n ILE 113 N -2.87 0.02 0.00 0.16 2.08 -1.26 -2.93 119.36 114.55 1rk7 n ILE 113 Ca 0.02 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.33 1rk7 n ILE 113 Cb 0.54 -1.49 0.00 0.00 -0.75 0.00 0.00 39.64 37.93 1rk7 n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1rk7 n GLY 114 N 3.38 0.99 3.79 7.39 0.00 -1.25 -5.08 105.19 114.41 1rk7 n GLY 114 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 4.07 -0.05 1.61 3.00 -1.15 -4.87 118.95 121.56 1rk7 s ARG 115 Ca 0.00 0.38 0.02 0.00 0.00 0.00 0.00 55.73 56.13 1rk7 s ARG 115 Cb 0.00 -3.30 0.01 0.00 0.00 0.00 0.00 34.95 31.66 1rk7 s ARG 115 CO 0.00 0.49 -0.11 -0.08 0.00 0.00 0.00 175.30 175.60 1rk7 s THR 116 N -0.42 1.02 -1.29 0.02 -1.32 -1.26 -0.25 115.64 112.14 1rk7 s THR 116 Ca 0.23 -0.44 -0.15 0.00 -1.21 0.00 0.00 61.69 60.12 1rk7 s THR 116 Cb -0.16 -0.93 0.11 0.00 -1.51 0.00 0.00 72.50 70.01 1rk7 s THR 116 CO 0.11 0.32 1.72 -0.11 -2.21 0.00 0.00 174.62 174.45 1rk7 n LEU 117 N 3.65 5.40 -4.68 9.08 -0.00 -1.24 -2.53 117.00 126.68 1rk7 n LEU 117 Ca -0.22 -4.17 -0.36 0.00 -0.00 0.00 0.00 56.01 51.26 1rk7 n LEU 117 Cb 0.52 -1.68 -0.09 0.00 -0.00 0.00 0.00 43.42 42.17 1rk7 n LEU 117 CO 0.25 0.54 -0.17 0.54 -0.00 0.00 0.00 177.39 178.56 1rk7 s VAL 118 N 2.97 5.36 0.10 1.96 0.11 -1.26 -4.34 120.40 125.31 1rk7 s VAL 118 Ca 0.49 0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.76 1rk7 s VAL 118 Cb 0.04 -3.50 -0.04 0.00 -1.53 0.00 0.00 36.38 31.34 1rk7 s VAL 118 CO 0.03 0.36 0.17 0.68 -3.33 0.00 0.00 175.10 173.02 1rk7 s VAL 119 N 0.92 4.98 0.70 2.04 -7.23 -1.26 -3.27 120.40 117.27 1rk7 s VAL 119 Ca 0.08 -0.67 -0.06 0.00 -1.81 0.00 0.00 61.98 59.52 1rk7 s VAL 119 Cb -0.13 -3.47 0.07 0.00 0.56 0.00 0.00 36.38 33.41 1rk7 s VAL 119 CO 0.03 0.05 1.00 -1.00 -0.31 0.00 0.00 175.10 174.87 1rk7 s HIS 120 N -1.56 2.80 -0.33 2.82 3.76 -1.26 -3.13 115.29 118.39 1rk7 s HIS 120 Ca 0.33 0.35 0.26 0.00 -0.15 0.00 0.00 55.06 55.85 1rk7 s HIS 120 Cb -0.12 -3.17 1.09 0.00 1.11 0.00 0.00 32.58 31.49 1rk7 s HIS 120 CO 0.26 -1.40 1.78 1.49 -0.85 0.00 0.00 174.74 176.01 1rk7 h GLU 121 N -0.55 0.00 0.00 1.40 4.22 -1.69 -3.39 114.58 114.56 1rk7 h GLU 121 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.00 1rk7 h GLU 121 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1rk7 h GLU 121 CO 0.58 0.00 0.00 1.17 -2.18 0.00 0.00 179.01 178.58 1rk7 n LYS 122 N -2.44 0.26 0.00 1.92 4.81 -1.26 -5.06 118.16 116.39 1rk7 n LYS 122 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1rk7 n LYS 122 Cb 0.24 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.29 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rk7 n ALA 123 N -3.00 0.00 -3.15 3.14 0.00 -1.23 -1.94 120.51 114.34 1rk7 n ALA 123 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1rk7 n ALA 123 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.00 -1.42 -0.30 0.00 1.11 -1.26 -4.03 116.67 109.76 1rk7 s ASP 124 Ca 0.00 -0.04 -0.00 0.00 0.18 0.00 0.00 52.55 52.69 1rk7 s ASP 124 Cb 0.00 1.87 0.10 0.00 1.07 0.00 0.00 42.92 45.96 1rk7 s ASP 124 CO 0.00 -0.24 0.08 -0.62 1.18 0.00 0.00 175.17 175.57 1rk7 s ASP 125 N 2.61 4.03 -0.30 0.27 -1.08 -1.26 -4.93 116.67 116.01 1rk7 s ASP 125 Ca 0.14 -1.62 -0.03 0.00 -0.52 0.00 0.00 52.55 50.52 1rk7 s ASP 125 Cb -0.07 -0.94 -0.09 0.00 -1.46 0.00 0.00 42.92 40.36 1rk7 s ASP 125 CO -0.21 -0.40 1.89 0.18 0.52 0.00 0.00 175.17 177.15 1rk7 n LEU 126 N 4.79 2.99 0.00 -1.34 4.32 -1.24 -3.53 117.00 122.99 1rk7 n LEU 126 Ca -0.02 -2.03 0.00 0.00 -0.02 0.00 0.00 56.01 53.94 1rk7 n LEU 126 Cb 0.42 -0.77 0.00 0.00 -1.62 0.00 0.00 43.42 41.45 1rk7 n LEU 126 CO 0.13 0.38 0.00 0.61 -1.22 0.00 0.00 177.39 177.29 1rk7 n GLY 127 N 3.20 -1.90 0.04 -0.72 0.00 -1.26 -4.92 105.19 99.64 1rk7 n GLY 127 Ca 0.26 0.87 -0.04 0.00 0.00 0.00 0.00 46.02 47.10 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 2.53 0.00 1.61 2.85 -1.23 -5.02 118.16 118.90 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 -1.21 0.00 0.00 -0.65 0.00 0.00 35.03 33.17 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 2.51 2.41 3.48 2.58 0.00 -1.26 -5.11 105.19 109.80 1rk7 n GLY 129 Ca -0.14 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 1rk7 n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk7 s GLY 130 N 0.00 1.81 -0.44 -0.02 0.00 -1.26 -5.06 107.32 102.36 1rk7 s GLY 130 Ca 0.00 -1.14 -0.14 0.00 0.00 0.00 0.00 44.72 43.44 1rk7 s GLY 130 CO 0.00 0.58 0.33 0.54 0.00 0.00 0.00 173.10 174.55 1rk7 s ASN 131 N 1.65 6.06 0.00 1.64 2.20 -1.26 -3.96 114.94 121.27 1rk7 s ASN 131 Ca 0.06 -1.14 0.00 0.00 -0.94 0.00 0.00 52.86 50.84 1rk7 s ASN 131 Cb -0.15 -2.15 0.00 0.00 -2.00 0.00 0.00 41.25 36.95 1rk7 s ASN 131 CO 0.06 -0.54 0.00 1.21 -2.94 0.00 0.00 177.10 174.89 1rk7 n GLU 132 N 5.15 0.00 -0.02 3.55 2.13 -1.26 -4.94 120.64 125.25 1rk7 n GLU 132 Ca -0.12 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.68 1rk7 n GLU 132 Cb 0.45 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.13 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 0.00 1.91 0.00 5.31 10.64 -1.26 -4.54 117.38 129.44 1rk7 n GLN 133 Ca 0.00 0.01 0.12 0.00 -1.83 0.00 0.00 57.00 55.30 1rk7 n GLN 133 Cb 0.00 -1.10 0.16 0.00 -0.86 0.00 0.00 30.24 28.44 1rk7 n GLN 133 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1rk7 n SER 134 N -2.37 1.84 0.06 2.61 3.41 -1.25 -2.03 113.62 115.88 1rk7 n SER 134 Ca -0.08 -1.41 0.01 0.00 -0.26 0.00 0.00 58.87 57.14 1rk7 n SER 134 Cb 0.62 0.28 -0.05 0.00 -0.26 0.00 0.00 64.21 64.79 1rk7 n SER 134 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1rk7 h THR 135 N 2.41 0.53 0.00 6.66 1.35 -1.81 -3.30 112.91 118.75 1rk7 h THR 135 Ca 0.00 -1.96 -0.32 0.00 -0.55 0.00 0.00 66.41 63.59 1rk7 h THR 135 Cb 0.70 2.06 -0.06 0.00 -1.73 0.00 0.00 68.15 69.13 1rk7 h THR 135 CO 0.00 0.30 -2.20 2.29 -0.25 0.00 0.00 175.52 175.66 1rk7 n LYS 136 N -2.94 0.96 0.00 4.72 2.85 -1.25 -0.89 118.16 121.61 1rk7 n LYS 136 Ca -0.07 0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1rk7 n LYS 136 Cb 0.80 -1.44 0.00 0.00 -0.65 0.00 0.00 35.03 33.74 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 -2.82 0.00 0.00 0.58 -2.24 -1.06 -4.77 114.28 103.97 1rk7 n THR 137 Ca -0.32 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1rk7 n THR 137 Cb 1.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 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 0.00 2.12 3.38 0.00 -0.86 -4.64 105.19 107.81 1rk7 n GLY 138 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.64 -2.70 1.61 5.15 -0.92 -4.65 115.26 110.11 1rk7 n ASN 139 Ca 0.00 0.29 -0.06 0.00 -0.60 0.00 0.00 54.58 54.21 1rk7 n ASN 139 Cb 0.00 -3.32 0.07 0.00 -0.53 0.00 0.00 39.78 36.00 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 -0.16 -2.61 -3.16 5.20 0.00 -1.26 -5.02 120.51 113.49 1rk7 n ALA 140 Ca -0.14 -0.77 -0.46 0.00 0.00 0.00 0.00 53.44 52.07 1rk7 n ALA 140 Cb 0.48 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.48 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 141 N -0.83 2.42 -0.44 0.00 0.00 -1.26 -4.14 107.32 103.06 1rk7 s GLY 141 Ca 0.28 -3.16 0.03 0.00 0.00 0.00 0.00 44.72 41.86 1rk7 s GLY 141 CO -0.15 1.59 0.30 -0.56 0.00 0.00 0.00 173.10 174.28 1rk7 s SER 142 N 2.68 2.78 0.67 1.64 0.01 -1.26 -4.93 113.70 115.29 1rk7 s SER 142 Ca 0.26 -2.84 -0.16 0.00 1.31 0.00 0.00 55.95 54.52 1rk7 s SER 142 Cb -0.08 -0.72 -0.14 0.00 0.21 0.00 0.00 66.02 65.30 1rk7 s SER 142 CO -0.09 -0.22 -0.41 -1.14 0.41 0.00 0.00 173.24 171.80 1rk7 n ARG 143 N 3.20 0.00 0.00 12.44 0.00 -1.26 -2.98 116.66 128.06 1rk7 n ARG 143 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.04 1rk7 n ARG 143 Cb 0.40 -0.91 0.00 0.00 0.00 0.00 0.00 32.46 31.96 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 2.70 0.00 -4.96 6.15 4.77 -1.18 -4.81 117.00 119.66 1rk7 n LEU 144 Ca 0.03 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.75 1rk7 n LEU 144 Cb 0.46 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.67 1rk7 n LEU 144 CO 0.48 0.00 0.63 0.00 -1.33 0.00 0.00 177.39 177.18 1rk7 s ALA 145 N -2.00 3.23 -0.43 -1.18 0.00 -1.26 -3.64 121.76 116.47 1rk7 s ALA 145 Ca 0.00 -1.37 0.07 0.00 0.00 0.00 0.00 51.96 50.67 1rk7 s ALA 145 Cb 0.00 -2.35 0.24 0.00 0.00 0.00 0.00 23.12 21.02 1rk7 s ALA 145 CO 0.00 -1.60 0.67 0.00 0.00 0.00 0.00 175.76 174.83 1rk7 n GLY 147 N 1.55 2.86 3.63 0.00 0.00 -1.26 -4.78 105.19 107.18 1rk7 n GLY 147 Ca 0.16 -0.98 -0.44 0.00 0.00 0.00 0.00 46.02 44.76 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 4.92 0.55 -1.68 1.61 0.31 -1.26 -3.64 118.33 119.14 1rk7 n VAL 148 Ca 0.45 -0.28 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 1rk7 n VAL 148 Cb 0.23 -2.34 -0.03 0.00 -0.91 0.00 0.00 33.84 30.79 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 6.16 3.07 -0.06 2.52 1.09 0.66 -4.50 121.20 130.14 1rk7 s ILE 149 Ca 0.95 0.08 0.03 0.00 -1.10 0.00 0.00 60.65 60.61 1rk7 s ILE 149 Cb -0.44 -3.07 0.01 0.00 -1.06 0.00 0.00 42.46 37.90 1rk7 s ILE 149 CO 0.41 -0.03 -0.14 -0.83 -0.10 0.00 0.00 174.94 174.25 1rk7 s GLY 150 N 6.07 0.85 0.45 6.18 0.00 -0.70 -3.91 107.32 116.26 1rk7 s GLY 150 Ca 0.92 -0.52 -0.20 0.00 0.00 0.00 0.00 44.72 44.92 1rk7 s GLY 150 CO 0.38 -0.05 0.04 1.39 0.00 0.00 0.00 173.10 174.86 1rk7 n ILE 151 N 3.59 0.50 -3.37 0.90 2.08 -1.26 -0.85 119.36 120.95 1rk7 n ILE 151 Ca -0.21 -0.50 -0.21 0.00 0.56 0.00 0.00 62.75 62.39 1rk7 n ILE 151 Cb 0.52 -0.06 0.01 0.00 -0.75 0.00 0.00 39.64 39.37 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 -1.80 4.45 -1.94 -1.39 0.00 0.20 -4.63 121.76 116.64 1rk7 s ALA 152 Ca 0.59 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1rk7 s ALA 152 Cb -0.57 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1rk7 s ALA 152 CO 0.63 -0.50 0.48 0.94 0.00 0.00 0.00 175.76 177.32