#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rk7 s THR 2 N 0.00 4.06 -0.65 0.00 2.01 -1.26 -4.82 115.64 114.98 1rk7 s THR 2 Ca 0.00 -0.24 -0.26 0.00 0.31 0.00 0.00 61.69 61.50 1rk7 s THR 2 Cb 0.00 -4.85 0.04 0.00 0.01 0.00 0.00 72.50 67.70 1rk7 s THR 2 CO 0.00 -1.70 1.13 -0.75 -0.69 0.00 0.00 174.62 172.61 1rk7 s LYS 3 N 4.73 3.27 0.40 4.92 2.20 -1.26 -3.75 119.74 130.25 1rk7 s LYS 3 Ca 0.32 -0.27 -0.10 0.00 -0.36 0.00 0.00 55.97 55.56 1rk7 s LYS 3 Cb -0.09 -4.13 -0.06 0.00 -1.51 0.00 0.00 37.83 32.03 1rk7 s LYS 3 CO 0.07 -1.85 0.76 0.00 -0.36 0.00 0.00 175.35 173.97 1rk7 s ALA 4 N 4.85 3.37 0.06 3.13 0.00 0.32 -2.26 121.76 131.23 1rk7 s ALA 4 Ca 0.33 -0.23 0.06 0.00 0.00 0.00 0.00 51.96 52.12 1rk7 s ALA 4 Cb -0.11 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 1rk7 s ALA 4 CO 0.17 -0.00 -0.17 0.08 0.00 0.00 0.00 175.76 175.84 1rk7 s VAL 5 N -2.36 1.35 -0.38 0.00 1.01 -0.95 0.12 120.40 119.19 1rk7 s VAL 5 Ca 0.51 -1.20 0.05 0.00 0.00 0.00 0.00 61.98 61.33 1rk7 s VAL 5 Cb -0.10 -1.23 0.16 0.00 0.00 0.00 0.00 36.38 35.22 1rk7 s VAL 5 CO 0.31 -0.00 0.46 0.00 0.00 0.00 0.00 175.10 175.87 1rk7 s ALA 6 N -0.97 -1.05 -0.60 5.51 0.00 0.44 -0.31 121.76 124.78 1rk7 s ALA 6 Ca 0.03 -0.59 -0.27 0.00 0.00 0.00 0.00 51.96 51.13 1rk7 s ALA 6 Cb -0.09 -2.27 0.03 0.00 0.00 0.00 0.00 23.12 20.80 1rk7 s ALA 6 CO 0.02 -2.16 1.15 0.54 0.00 0.00 0.00 175.76 175.31 1rk7 s VAL 7 N 1.57 4.06 -0.22 0.00 0.11 -1.26 -0.71 120.40 123.95 1rk7 s VAL 7 Ca 0.17 0.65 -0.41 0.00 -2.93 0.00 0.00 61.98 59.45 1rk7 s VAL 7 Cb -0.12 -4.72 -0.17 0.00 -1.53 0.00 0.00 36.38 29.84 1rk7 s VAL 7 CO -0.05 -1.38 1.58 0.18 -3.33 0.00 0.00 175.10 172.10 1rk7 n LEU 8 N 8.36 1.84 -0.06 2.54 4.77 -0.44 -4.39 117.00 129.62 1rk7 n LEU 8 Ca 0.06 1.11 -0.12 0.00 -0.03 0.00 0.00 56.01 57.02 1rk7 n LEU 8 Cb 0.49 -1.09 -0.06 0.00 -2.33 0.00 0.00 43.42 40.43 1rk7 n LEU 8 CO 0.70 -0.75 0.66 0.50 -1.33 0.00 0.00 177.39 177.17 1rk7 h LYS 9 N 5.94 0.39 -2.19 3.23 3.11 -1.87 -3.34 116.57 121.83 1rk7 h LYS 9 Ca -0.47 -0.17 0.00 0.00 -2.81 0.00 0.00 60.65 57.20 1rk7 h LYS 9 Cb 1.34 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.56 1rk7 h LYS 9 CO 0.90 0.69 -0.34 0.41 -2.81 0.00 0.00 179.45 178.30 1rk7 n GLY 10 N 0.00 -4.28 0.36 5.01 0.00 -1.25 -4.62 105.19 100.41 1rk7 n GLY 10 Ca -0.05 -0.58 0.16 0.00 0.00 0.00 0.00 46.02 45.55 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 1.55 0.00 0.00 1.61 3.58 -0.59 -3.43 116.42 119.14 1rk7 h ASP 11 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1rk7 h ASP 11 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1rk7 h ASP 11 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 1rk7 n GLY 12 N -1.35 -1.80 0.16 -0.78 0.00 -1.26 -5.01 105.19 95.15 1rk7 n GLY 12 Ca 0.02 0.61 -0.06 0.00 0.00 0.00 0.00 46.02 46.59 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 -0.31 -6.30 1.61 0.13 -1.91 -3.46 132.00 121.76 1rk7 h PRO 13 Ca 0.00 0.02 -0.59 0.00 -0.87 0.00 0.00 66.00 64.56 1rk7 h PRO 13 Cb 0.00 0.07 0.17 0.00 0.13 0.00 0.00 31.00 31.37 1rk7 h PRO 13 CO 0.00 -0.15 -0.69 0.28 -0.23 0.00 0.00 178.00 177.21 1rk7 n VAL 14 N -4.99 1.36 0.00 1.56 0.31 -1.23 -4.49 118.33 110.86 1rk7 n VAL 14 Ca -0.05 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 1rk7 n VAL 14 Cb 0.15 -0.41 0.00 0.00 -0.91 0.00 0.00 33.84 32.67 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 0.57 0.00 -0.78 5.55 0.00 0.16 -3.94 117.38 118.93 1rk7 n GLN 15 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.10 1rk7 n GLN 15 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.71 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 0.00 1.34 2.74 1.69 0.00 -1.25 -4.50 105.19 105.20 1rk7 n GLY 16 Ca 0.00 -2.04 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 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 0.64 -0.14 -0.09 -0.61 1.01 0.14 -1.33 121.20 120.82 1rk7 s ILE 17 Ca 0.00 0.37 0.02 0.00 0.00 0.00 0.00 60.65 61.03 1rk7 s ILE 17 Cb 0.00 -0.18 0.02 0.00 0.01 0.00 0.00 42.46 42.30 1rk7 s ILE 17 CO 0.00 0.15 -0.13 -0.51 0.00 0.00 0.00 174.94 174.45 1rk7 s ILE 18 N 1.98 1.32 0.26 2.92 -1.16 0.11 0.14 121.20 126.77 1rk7 s ILE 18 Ca 0.02 -0.54 0.10 0.00 -0.51 0.00 0.00 60.65 59.71 1rk7 s ILE 18 Cb -0.12 -1.22 -0.04 0.00 0.61 0.00 0.00 42.46 41.68 1rk7 s ILE 18 CO -0.04 0.40 -0.03 0.20 -2.81 0.00 0.00 174.94 172.67 1rk7 s ASN 19 N 0.97 4.43 -0.31 4.50 -0.87 0.62 0.17 114.94 124.46 1rk7 s ASN 19 Ca -0.08 -0.67 0.00 0.00 -1.57 0.00 0.00 52.86 50.54 1rk7 s ASN 19 Cb -0.15 -0.79 0.10 0.00 -0.02 0.00 0.00 41.25 40.39 1rk7 s ASN 19 CO -0.01 0.02 0.08 -0.36 -2.57 0.00 0.00 177.10 174.25 1rk7 s PHE 20 N -2.28 2.14 0.13 2.20 0.40 0.33 -2.31 117.98 118.59 1rk7 s PHE 20 Ca 0.31 -1.96 0.02 0.00 -0.60 0.00 0.00 56.93 54.70 1rk7 s PHE 20 Cb -0.07 -1.92 -0.04 0.00 0.51 0.00 0.00 43.02 41.50 1rk7 s PHE 20 CO 0.19 -0.87 0.24 -2.00 0.70 0.00 0.00 175.22 173.48 1rk7 s GLU 21 N 1.47 3.34 -0.41 0.44 2.12 -0.88 0.12 118.70 124.90 1rk7 s GLU 21 Ca 0.09 -0.61 0.09 0.00 0.36 0.00 0.00 54.97 54.90 1rk7 s GLU 21 Cb -0.18 -2.93 0.31 0.00 0.26 0.00 0.00 34.13 31.60 1rk7 s GLU 21 CO -0.20 0.53 0.83 0.94 -0.54 0.00 0.00 175.26 176.83 1rk7 n GLN 22 N -0.32 0.93 -0.96 4.30 7.27 -1.25 0.19 117.38 127.54 1rk7 n GLN 22 Ca -0.07 -2.75 -0.32 0.00 0.07 0.00 0.00 57.00 53.93 1rk7 n GLN 22 Cb 0.53 -1.40 -0.03 0.00 2.41 0.00 0.00 30.24 31.75 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 0.62 1.91 -3.87 3.69 5.02 -1.26 0.23 118.16 124.50 1rk7 n LYS 23 Ca 0.17 -1.68 -0.09 0.00 -2.02 0.00 0.00 58.31 54.69 1rk7 n LYS 23 Cb 0.65 -2.69 -0.05 0.00 -0.02 0.00 0.00 35.03 32.92 1rk7 n LYS 23 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1rk7 s GLU 24 N 4.03 1.36 -0.61 1.97 0.41 -1.26 -4.82 118.70 119.79 1rk7 s GLU 24 Ca 0.48 -1.05 -0.04 0.00 -0.41 0.00 0.00 54.97 53.94 1rk7 s GLU 24 Cb 0.12 0.47 -0.07 0.00 -1.78 0.00 0.00 34.13 32.87 1rk7 s GLU 24 CO 0.03 -0.56 1.99 0.43 -0.49 0.00 0.00 175.26 176.65 1rk7 n SER 25 N -0.32 3.90 -2.54 -0.19 7.64 -1.26 -4.14 113.62 116.71 1rk7 n SER 25 Ca -0.07 -2.21 -0.20 0.00 1.01 0.00 0.00 58.87 57.40 1rk7 n SER 25 Cb 0.62 -0.94 0.01 0.00 -1.01 0.00 0.00 64.21 62.89 1rk7 n SER 25 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1rk7 n ASN 26 N 3.92 -5.79 0.00 6.43 4.13 -1.26 -4.96 115.26 117.73 1rk7 n ASN 26 Ca 0.35 -0.14 0.00 0.00 1.68 0.00 0.00 54.58 56.47 1rk7 n ASN 26 Cb 0.20 -4.72 0.00 0.00 -1.54 0.00 0.00 39.78 33.71 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rk7 n GLY 27 N -1.24 0.44 3.81 7.41 0.00 -1.26 -4.80 105.19 109.55 1rk7 n GLY 27 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 2.06 2.31 -0.08 1.61 0.04 -1.26 -4.34 135.00 135.35 1rk7 s PRO 28 Ca 0.00 0.72 0.03 0.00 0.04 0.00 0.00 61.00 61.79 1rk7 s PRO 28 Cb 0.00 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.61 1rk7 s PRO 28 CO 0.00 -1.48 -0.17 0.08 0.04 0.00 0.00 177.00 175.47 1rk7 s VAL 29 N -3.13 1.48 -0.92 -0.36 1.01 -0.98 -4.60 120.40 112.89 1rk7 s VAL 29 Ca 0.60 -0.68 -0.20 0.00 0.00 0.00 0.00 61.98 61.71 1rk7 s VAL 29 Cb -0.14 -1.32 0.11 0.00 0.00 0.00 0.00 36.38 35.04 1rk7 s VAL 29 CO 0.54 0.43 1.16 -0.54 0.00 0.00 0.00 175.10 176.70 1rk7 s LYS 30 N 0.57 3.56 0.05 2.72 1.02 0.51 -2.55 119.74 125.61 1rk7 s LYS 30 Ca -0.16 -1.59 -0.25 0.00 0.02 0.00 0.00 55.97 54.00 1rk7 s LYS 30 Cb -0.17 -4.92 -0.06 0.00 -0.52 0.00 0.00 37.83 32.16 1rk7 s LYS 30 CO 0.05 -1.84 0.75 0.08 -0.92 0.00 0.00 175.35 173.47 1rk7 s VAL 31 N 3.15 4.71 0.08 3.17 1.01 -0.04 -2.06 120.40 130.41 1rk7 s VAL 31 Ca 0.34 1.60 -0.26 0.00 0.00 0.00 0.00 61.98 63.66 1rk7 s VAL 31 Cb -0.05 -4.10 0.07 0.00 0.00 0.00 0.00 36.38 32.30 1rk7 s VAL 31 CO -0.08 0.38 0.64 -1.66 0.00 0.00 0.00 175.10 174.39 1rk7 s TRP 32 N -0.17 -0.58 -0.01 5.22 -2.14 -0.98 -1.04 118.94 119.25 1rk7 s TRP 32 Ca 0.38 0.62 -0.06 0.00 2.66 0.00 0.00 56.10 59.70 1rk7 s TRP 32 Cb -0.21 0.50 0.02 0.00 -3.10 0.00 0.00 33.47 30.69 1rk7 s TRP 32 CO 0.23 -0.75 0.25 0.41 -2.66 0.00 0.00 176.95 174.43 1rk7 n GLY 33 N 0.10 0.54 3.34 3.67 0.00 -1.07 -0.27 105.19 111.50 1rk7 n GLY 33 Ca -0.17 -0.87 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.56 -0.81 0.58 1.61 0.01 0.12 -1.59 113.70 112.06 1rk7 s SER 34 Ca 0.06 1.10 -0.08 0.00 1.31 0.00 0.00 55.95 58.34 1rk7 s SER 34 Cb -0.00 1.89 -0.02 0.00 0.21 0.00 0.00 66.02 68.10 1rk7 s SER 34 CO -0.00 -0.24 0.94 -0.63 0.41 0.00 0.00 173.24 173.71 1rk7 s ILE 35 N 2.78 4.36 -0.36 1.44 1.01 0.38 0.23 121.20 131.03 1rk7 s ILE 35 Ca 0.04 0.42 0.04 0.00 0.00 0.00 0.00 60.65 61.15 1rk7 s ILE 35 Cb -0.13 -3.72 0.16 0.00 0.01 0.00 0.00 42.46 38.78 1rk7 s ILE 35 CO -0.18 -0.83 0.44 -0.54 0.00 0.00 0.00 174.94 173.83 1rk7 s LYS 36 N -5.04 0.61 0.00 2.79 1.02 -1.26 -3.37 119.74 114.50 1rk7 s LYS 36 Ca 0.53 -0.47 0.00 0.00 0.02 0.00 0.00 55.97 56.05 1rk7 s LYS 36 Cb -0.11 -0.44 0.00 0.00 -0.52 0.00 0.00 37.83 36.76 1rk7 s LYS 36 CO 0.49 -1.15 0.00 0.41 -0.92 0.00 0.00 175.35 174.18 1rk7 n GLY 37 N 4.59 1.19 0.00 -3.33 0.00 -1.26 -0.67 105.19 105.71 1rk7 n GLY 37 Ca 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.73 0.99 4.77 -1.26 -4.71 117.00 113.06 1rk7 n LEU 38 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 1rk7 n LEU 38 Cb 0.00 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1rk7 n LEU 38 CO 0.00 -1.16 -0.33 0.42 -1.33 0.00 0.00 177.39 175.00 1rk7 s THR 39 N -0.56 -0.09 -0.74 -5.08 -4.23 -1.26 -3.87 115.64 99.82 1rk7 s THR 39 Ca 0.00 0.29 -0.31 0.00 -1.18 0.00 0.00 61.69 60.48 1rk7 s THR 39 Cb 0.00 -0.13 -0.19 0.00 1.34 0.00 0.00 72.50 73.52 1rk7 s THR 39 CO 0.00 0.12 2.23 -1.84 -0.54 0.00 0.00 174.62 174.59 1rk7 n GLU 40 N 4.60 0.00 0.00 3.99 0.28 -1.26 -4.50 120.64 123.75 1rk7 n GLU 40 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.81 1rk7 n GLU 40 Cb 0.50 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 32.04 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 6.07 1.97 3.56 -1.84 0.00 -1.26 -4.91 105.19 108.78 1rk7 n GLY 41 Ca 0.55 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rk7 n LEU 42 N 0.00 1.69 -3.97 0.99 4.32 -1.26 -2.33 117.00 116.44 1rk7 n LEU 42 Ca 0.00 0.34 -0.10 0.00 -0.02 0.00 0.00 56.01 56.23 1rk7 n LEU 42 Cb 0.00 -1.36 -0.06 0.00 -1.62 0.00 0.00 43.42 40.38 1rk7 n LEU 42 CO 0.00 -2.75 0.08 -1.00 -1.22 0.00 0.00 177.39 172.50 1rk7 s HIS 43 N -2.53 0.38 0.78 -1.77 3.76 0.26 -4.74 115.29 111.43 1rk7 s HIS 43 Ca 0.63 -0.73 -0.03 0.00 -0.15 0.00 0.00 55.06 54.78 1rk7 s HIS 43 Cb -0.22 0.06 0.15 0.00 1.11 0.00 0.00 32.58 33.68 1rk7 s HIS 43 CO 0.62 -0.85 1.07 0.20 -0.85 0.00 0.00 174.74 174.92 1rk7 s GLY 44 N -2.99 1.76 1.22 -2.22 0.00 0.38 -3.16 107.32 102.30 1rk7 s GLY 44 Ca 0.20 -1.73 -0.18 0.00 0.00 0.00 0.00 44.72 43.02 1rk7 s GLY 44 CO 0.04 -1.09 0.55 0.69 0.00 0.00 0.00 173.10 173.29 1rk7 n PHE 45 N -3.02 -2.47 -3.07 1.90 3.72 -1.26 -3.89 117.46 109.37 1rk7 n PHE 45 Ca 0.16 -0.27 -0.16 0.00 -0.05 0.00 0.00 57.45 57.13 1rk7 n PHE 45 Cb 0.60 -1.46 0.00 0.00 -0.94 0.00 0.00 39.48 37.69 1rk7 n PHE 45 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 1rk7 n HIS 46 N -4.99 -0.62 -3.81 1.38 1.44 -1.26 -1.38 115.22 105.98 1rk7 n HIS 46 Ca 0.07 -3.38 -0.12 0.00 -2.01 0.00 0.00 57.72 52.28 1rk7 n HIS 46 Cb 0.52 0.11 -0.09 0.00 0.12 0.00 0.00 29.99 30.66 1rk7 n HIS 46 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1rk7 s VAL 47 N -1.71 0.08 -0.25 0.61 1.01 -1.13 -1.88 120.40 117.13 1rk7 s VAL 47 Ca 0.35 -0.68 -0.35 0.00 0.00 0.00 0.00 61.98 61.31 1rk7 s VAL 47 Cb 0.33 -0.70 0.16 0.00 0.00 0.00 0.00 36.38 36.17 1rk7 s VAL 47 CO -0.07 -0.37 1.30 -2.28 0.00 0.00 0.00 175.10 173.67 1rk7 s HIS 48 N -1.86 -0.07 0.00 5.22 5.04 -1.26 -4.89 115.29 117.47 1rk7 s HIS 48 Ca -0.10 0.07 0.00 0.00 -1.54 0.00 0.00 55.06 53.49 1rk7 s HIS 48 Cb -0.04 0.50 0.00 0.00 0.04 0.00 0.00 32.58 33.08 1rk7 s HIS 48 CO 0.00 -0.10 0.00 -1.91 -2.34 0.00 0.00 174.74 170.39 1rk7 n GLU 49 N 0.11 0.00 0.00 2.88 4.07 -1.26 -4.69 120.64 121.74 1rk7 n GLU 49 Ca 0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 1rk7 n GLU 49 Cb 0.58 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.96 1rk7 n GLU 49 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1rk7 n GLU 50 N -0.68 0.00 -1.18 5.31 2.13 -1.26 -4.64 120.64 120.32 1rk7 n GLU 50 Ca 0.00 0.11 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1rk7 n GLU 50 Cb 0.00 -0.81 0.00 0.00 0.27 0.00 0.00 31.44 30.90 1rk7 n GLU 50 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1rk7 n GLU 51 N -0.43 2.71 -1.51 5.31 1.02 -1.26 -4.98 120.64 121.51 1rk7 n GLU 51 Ca 0.00 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.69 1rk7 n GLU 51 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1rk7 n ASP 52 N -0.69 2.33 0.00 1.62 8.00 -1.26 -4.66 116.55 121.89 1rk7 n ASP 52 Ca 0.00 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.66 1rk7 n ASP 52 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 39.72 1rk7 n ASP 52 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1rk7 n ASN 53 N 11.57 0.00 0.00 -2.24 3.02 -1.26 -5.04 115.26 121.31 1rk7 n ASN 53 Ca 0.39 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.94 1rk7 n ASN 53 Cb 0.33 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 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 0.00 0.00 0.00 3.41 5.66 -1.26 -4.96 114.28 117.13 1rk7 n THR 54 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1rk7 n THR 54 Cb 0.00 -0.20 0.00 0.00 -1.55 0.00 0.00 70.33 68.58 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 -2.50 0.00 -2.67 1.79 0.00 -1.26 -3.14 120.51 112.73 1rk7 n ALA 55 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1rk7 n ALA 55 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.73 1.34 0.00 0.00 -1.26 -4.87 105.19 99.67 1rk7 n GLY 56 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.21 0.00 -3.28 0.00 -2.24 -1.26 -5.08 114.28 102.21 1rk7 n THR 58 Ca 0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 1rk7 n THR 58 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1rk7 n THR 58 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1rk7 s SER 59 N 1.00 0.12 0.08 3.42 0.01 -1.26 -5.00 113.70 112.07 1rk7 s SER 59 Ca 0.00 -1.40 0.00 0.00 1.31 0.00 0.00 55.95 55.86 1rk7 s SER 59 Cb 0.00 1.07 0.00 0.00 0.21 0.00 0.00 66.02 67.30 1rk7 s SER 59 CO 0.00 -0.21 0.00 0.00 0.41 0.00 0.00 173.24 173.44 1rk7 n ALA 60 N 4.15 2.33 0.00 1.44 0.00 -1.26 -5.11 120.51 122.06 1rk7 n ALA 60 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1rk7 n ALA 60 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1rk7 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk7 n GLY 61 N 0.83 -1.74 3.72 0.00 0.00 -1.26 -5.14 105.19 101.60 1rk7 n GLY 61 Ca 0.00 0.79 -0.42 0.00 0.00 0.00 0.00 46.02 46.39 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 4.46 -0.29 1.61 0.04 -1.26 -4.94 135.00 134.63 1rk7 s PRO 62 Ca 0.00 1.72 0.19 0.00 0.04 0.00 0.00 61.00 62.95 1rk7 s PRO 62 Cb 0.00 -3.35 0.48 0.00 0.04 0.00 0.00 34.50 31.67 1rk7 s PRO 62 CO 0.00 -0.20 1.07 1.58 0.04 0.00 0.00 177.00 179.49 1rk7 n HIS 63 N 3.77 1.48 -2.44 0.56 -0.00 -1.26 -5.07 115.22 112.26 1rk7 n HIS 63 Ca 0.08 -2.40 0.03 0.00 0.46 0.00 0.00 57.72 55.89 1rk7 n HIS 63 Cb 0.47 -0.28 -0.01 0.00 -0.12 0.00 0.00 29.99 30.05 1rk7 n HIS 63 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1rk7 n PHE 64 N -0.43 -1.98 -2.98 1.57 3.01 -1.26 -4.60 117.46 110.79 1rk7 n PHE 64 Ca 0.13 0.29 -0.40 0.00 1.01 0.00 0.00 57.45 58.48 1rk7 n PHE 64 Cb 0.81 -0.41 -0.05 0.00 -0.01 0.00 0.00 39.48 39.83 1rk7 n PHE 64 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1rk7 s ASN 65 N -4.20 7.12 -1.15 4.37 0.01 -1.26 -4.47 114.94 115.35 1rk7 s ASN 65 Ca 0.00 1.34 -0.19 0.00 -0.71 0.00 0.00 52.86 53.30 1rk7 s ASN 65 Cb 0.00 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 1rk7 s ASN 65 CO 0.00 -0.09 1.98 -0.81 -1.51 0.00 0.00 177.10 176.67 1rk7 n PRO 66 N 3.47 2.24 0.00 -0.60 -0.04 -1.26 -3.16 135.00 135.65 1rk7 n PRO 66 Ca -0.01 -2.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.00 1rk7 n PRO 66 Cb 0.51 -3.29 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 1rk7 n PRO 66 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1rk7 n LEU 67 N 8.52 0.00 -0.03 1.53 4.77 -1.26 -4.95 117.00 125.59 1rk7 n LEU 67 Ca 0.49 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.36 1rk7 n LEU 67 Cb 0.42 0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.64 1rk7 n LEU 67 CO 0.88 -0.19 0.81 -1.28 -1.33 0.00 0.00 177.39 176.29 1rk7 h SER 68 N 0.00 0.17 0.00 -1.43 0.87 -1.90 -3.40 113.55 107.86 1rk7 h SER 68 Ca 0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1rk7 h SER 68 Cb 0.00 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1rk7 h SER 68 CO 0.00 0.31 0.00 0.54 -0.53 0.00 0.00 176.83 177.15 1rk7 n ARG 69 N -4.89 0.00 0.00 2.24 1.74 -1.26 -1.38 116.66 113.12 1rk7 n ARG 69 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1rk7 n ARG 69 Cb 0.13 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.57 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1rk7 n LYS 70 N 0.00 0.00 -1.40 5.56 0.00 -1.26 -4.22 118.16 116.83 1rk7 n LYS 70 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 58.31 57.97 1rk7 n LYS 70 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 35.03 34.87 1rk7 n LYS 70 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1rk7 n HIS 71 N 0.00 0.40 0.00 5.64 -0.00 0.49 -3.91 115.22 117.85 1rk7 n HIS 71 Ca 0.00 0.27 0.00 0.00 0.46 0.00 0.00 57.72 58.45 1rk7 n HIS 71 Cb 0.00 -1.81 0.00 0.00 -0.12 0.00 0.00 29.99 28.06 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1rk7 n GLY 72 N 5.85 0.42 3.80 1.57 0.00 -1.26 -4.94 105.19 110.62 1rk7 n GLY 72 Ca 0.62 -1.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 1rk7 n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk7 s GLY 73 N 0.00 2.49 0.00 -0.02 0.00 -1.25 -4.95 107.32 103.58 1rk7 s GLY 73 Ca 0.00 -0.17 0.22 0.00 0.00 0.00 0.00 44.72 44.77 1rk7 s GLY 73 CO 0.00 0.36 1.70 -1.55 0.00 0.00 0.00 173.10 173.62 1rk7 n PRO 74 N 2.31 0.75 0.00 2.90 -0.04 -1.26 -3.10 135.00 136.55 1rk7 n PRO 74 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1rk7 n PRO 74 Cb 0.52 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.96 0.00 0.01 0.54 2.85 -0.90 -4.62 118.16 115.09 1rk7 n LYS 75 Ca 0.16 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.42 1rk7 n LYS 75 Cb 0.07 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.45 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 0.00 -0.02 -0.99 -5.58 8.00 -1.25 -4.88 116.55 111.83 1rk7 n ASP 76 Ca 0.00 0.04 0.11 0.00 0.71 0.00 0.00 54.79 55.66 1rk7 n ASP 76 Cb 0.00 0.04 0.25 0.00 -0.02 0.00 0.00 41.12 41.39 1rk7 n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rk7 n GLU 77 N -2.59 2.29 -3.57 -1.24 -0.58 -1.26 -4.97 120.64 108.73 1rk7 n GLU 77 Ca 0.00 -1.95 0.00 0.00 -0.42 0.00 0.00 57.16 54.79 1rk7 n GLU 77 Cb 0.00 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 1rk7 n GLU 77 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1rk7 n GLU 78 N 1.17 -0.23 -2.62 3.49 1.02 -1.18 -4.72 120.64 117.58 1rk7 n GLU 78 Ca 0.18 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.26 1rk7 n GLU 78 Cb 0.53 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.96 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rk7 n ARG 79 N 0.00 -2.12 -1.38 3.49 1.74 -0.48 -2.12 116.66 115.79 1rk7 n ARG 79 Ca 0.00 1.93 0.02 0.00 -0.77 0.00 0.00 57.85 59.04 1rk7 n ARG 79 Cb 0.00 -4.97 0.01 0.00 -1.02 0.00 0.00 32.46 26.48 1rk7 n ARG 79 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1rk7 n HIS 80 N -0.22 0.00 0.00 -1.55 1.44 -1.26 -3.84 115.22 109.78 1rk7 n HIS 80 Ca 0.09 -0.47 0.00 0.00 -2.01 0.00 0.00 57.72 55.33 1rk7 n HIS 80 Cb 0.34 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.38 1rk7 n HIS 80 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1rk7 n VAL 81 N 0.41 0.00 0.14 0.61 0.31 -1.26 -4.92 118.33 113.62 1rk7 n VAL 81 Ca 0.02 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1rk7 n VAL 81 Cb 1.07 -0.02 0.15 0.00 -0.91 0.00 0.00 33.84 34.13 1rk7 n VAL 81 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1rk7 h GLY 82 N 0.00 0.00 -3.89 2.92 0.00 -1.94 -3.45 103.07 96.71 1rk7 h GLY 82 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 1rk7 h GLY 82 CO 0.00 0.00 0.03 1.34 0.00 0.00 0.00 176.54 177.91 1rk7 n ASP 83 N -3.62 0.76 0.22 0.19 -0.08 -1.26 -4.80 116.55 107.95 1rk7 n ASP 83 Ca -0.01 1.02 0.00 0.00 -1.51 0.00 0.00 54.79 54.30 1rk7 n ASP 83 Cb 0.65 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.82 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 0.76 -3.91 0.00 -2.67 -0.00 -1.26 -4.87 117.00 105.05 1rk7 n LEU 84 Ca 0.10 0.89 0.00 0.00 -0.00 0.00 0.00 56.01 57.00 1rk7 n LEU 84 Cb 0.38 3.67 0.00 0.00 -0.00 0.00 0.00 43.42 47.47 1rk7 n LEU 84 CO 0.57 0.29 0.00 0.61 -0.00 0.00 0.00 177.39 178.86 1rk7 n GLY 85 N -1.45 -0.66 2.87 -3.96 0.00 -1.26 -5.14 105.19 95.58 1rk7 n GLY 85 Ca 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 1rk7 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rk7 s ASN 86 N -4.00 0.23 0.13 1.61 0.01 -1.26 -4.42 114.94 107.24 1rk7 s ASN 86 Ca 0.00 -0.02 0.04 0.00 -0.71 0.00 0.00 52.86 52.17 1rk7 s ASN 86 Cb 0.00 -0.07 -0.04 0.00 0.41 0.00 0.00 41.25 41.56 1rk7 s ASN 86 CO 0.00 -0.02 0.15 0.68 -1.51 0.00 0.00 177.10 176.40 1rk7 s VAL 87 N 0.30 4.69 0.07 1.60 -7.23 -1.19 -4.90 120.40 113.74 1rk7 s VAL 87 Ca -0.03 -0.90 0.05 0.00 -1.81 0.00 0.00 61.98 59.29 1rk7 s VAL 87 Cb -0.05 -3.36 -0.03 0.00 0.56 0.00 0.00 36.38 33.50 1rk7 s VAL 87 CO -0.01 -0.03 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.72 1rk7 s THR 88 N -1.65 1.05 0.64 5.32 2.01 -1.26 0.93 115.64 122.68 1rk7 s THR 88 Ca 0.31 -1.28 -0.06 0.00 0.31 0.00 0.00 61.69 60.97 1rk7 s THR 88 Cb -0.11 -1.02 0.03 0.00 0.01 0.00 0.00 72.50 71.41 1rk7 s THR 88 CO 0.24 -0.24 0.95 0.00 -0.69 0.00 0.00 174.62 174.89 1rk7 s ALA 89 N -1.28 3.23 0.00 7.40 0.00 -0.99 -4.59 121.76 125.53 1rk7 s ALA 89 Ca -0.03 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1rk7 s ALA 89 Cb -0.10 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1rk7 s ALA 89 CO 0.02 -1.00 0.00 -3.47 0.00 0.00 0.00 175.76 171.31 1rk7 n ASP 90 N -2.73 0.00 -0.20 0.00 2.03 0.18 -4.30 116.55 111.52 1rk7 n ASP 90 Ca 0.06 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.37 1rk7 n ASP 90 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1rk7 n ASP 90 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1rk7 n LYS 91 N 0.00 0.00 -0.80 -0.67 4.81 -1.26 -4.75 118.16 115.49 1rk7 n LYS 91 Ca 0.00 -0.66 -0.04 0.00 -0.87 0.00 0.00 58.31 56.74 1rk7 n LYS 91 Cb 0.00 -0.47 -0.04 0.00 0.02 0.00 0.00 35.03 34.54 1rk7 n LYS 91 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1rk7 n ASP 92 N 0.00 -0.51 0.00 3.14 2.03 -1.26 -4.75 116.55 115.20 1rk7 n ASP 92 Ca 0.00 -1.59 0.00 0.00 0.52 0.00 0.00 54.79 53.72 1rk7 n ASP 92 Cb 0.58 0.15 0.00 0.00 -0.72 0.00 0.00 41.12 41.12 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rk7 n GLY 93 N 0.01 2.55 3.46 0.27 0.00 -1.25 -4.60 105.19 105.64 1rk7 n GLY 93 Ca -0.15 -0.54 -0.45 0.00 0.00 0.00 0.00 46.02 44.89 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 0.02 -3.63 1.61 0.31 -1.26 -4.15 118.33 111.22 1rk7 n VAL 94 Ca 0.00 -0.21 -0.39 0.00 -0.01 0.00 0.00 64.34 63.73 1rk7 n VAL 94 Cb 0.00 -1.18 -0.11 0.00 -0.91 0.00 0.00 33.84 31.63 1rk7 n VAL 94 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rk7 s ALA 95 N 8.86 3.30 0.10 3.52 0.00 -1.22 0.49 121.76 136.81 1rk7 s ALA 95 Ca 1.21 -1.44 0.05 0.00 0.00 0.00 0.00 51.96 51.77 1rk7 s ALA 95 Cb -1.00 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1rk7 s ALA 95 CO 0.47 -0.99 0.03 0.16 0.00 0.00 0.00 175.76 175.43 1rk7 s ASP 96 N 1.61 5.14 0.23 0.00 1.47 -1.26 0.14 116.67 124.01 1rk7 s ASP 96 Ca 0.04 -0.16 0.10 0.00 1.18 0.00 0.00 52.55 53.71 1rk7 s ASP 96 Cb -0.17 -1.25 -0.05 0.00 -0.34 0.00 0.00 42.92 41.10 1rk7 s ASP 96 CO 0.07 0.16 -0.17 -0.69 0.68 0.00 0.00 175.17 175.21 1rk7 s VAL 97 N -1.41 2.05 -0.31 2.11 1.01 -0.62 -4.88 120.40 118.34 1rk7 s VAL 97 Ca 0.27 -2.28 -0.09 0.00 0.00 0.00 0.00 61.98 59.89 1rk7 s VAL 97 Cb -0.11 -2.14 0.22 0.00 0.00 0.00 0.00 36.38 34.35 1rk7 s VAL 97 CO 0.19 -0.50 1.17 -1.54 0.00 0.00 0.00 175.10 174.42 1rk7 n SER 98 N -0.44 -1.15 -4.20 3.32 3.41 -1.10 -2.60 113.62 110.86 1rk7 n SER 98 Ca -0.07 -0.71 -0.12 0.00 -0.26 0.00 0.00 58.87 57.71 1rk7 n SER 98 Cb 0.60 0.58 -0.10 0.00 -0.26 0.00 0.00 64.21 65.03 1rk7 n SER 98 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1rk7 s ILE 99 N 0.93 0.39 -0.26 -1.33 1.09 -0.21 -4.99 121.20 116.82 1rk7 s ILE 99 Ca 0.23 -1.95 0.00 0.00 -1.10 0.00 0.00 60.65 57.83 1rk7 s ILE 99 Cb 0.15 -2.12 0.08 0.00 -1.06 0.00 0.00 42.46 39.51 1rk7 s ILE 99 CO -0.11 -0.44 0.01 -0.70 -0.10 0.00 0.00 174.94 173.60 1rk7 s GLU 100 N -3.99 1.27 -0.37 2.79 2.12 -1.26 -0.86 118.70 118.41 1rk7 s GLU 100 Ca 0.25 -1.07 -0.26 0.00 0.36 0.00 0.00 54.97 54.25 1rk7 s GLU 100 Cb 0.07 -2.48 0.01 0.00 0.26 0.00 0.00 34.13 31.99 1rk7 s GLU 100 CO 0.03 -0.75 0.92 -0.51 -0.54 0.00 0.00 175.26 174.42 1rk7 s ASP 101 N 1.43 6.68 -0.78 -1.70 1.01 -1.06 -4.84 116.67 117.41 1rk7 s ASP 101 Ca 0.01 0.58 -0.02 0.00 0.71 0.00 0.00 52.55 53.82 1rk7 s ASP 101 Cb -0.18 -2.46 0.30 0.00 1.01 0.00 0.00 42.92 41.59 1rk7 s ASP 101 CO -0.11 -0.84 2.16 -1.54 0.21 0.00 0.00 175.17 175.04 1rk7 n SER 102 N 6.74 7.35 0.00 0.27 3.41 -1.26 -2.33 113.62 127.80 1rk7 n SER 102 Ca 0.07 -3.73 0.00 0.00 -0.26 0.00 0.00 58.87 54.95 1rk7 n SER 102 Cb 0.48 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 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 -0.28 0.00 -2.61 -3.33 0.31 -1.26 -4.92 118.33 106.23 1rk7 n VAL 103 Ca 0.53 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.65 1rk7 n VAL 103 Cb 0.29 -0.24 0.11 0.00 -0.91 0.00 0.00 33.84 33.08 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 -2.11 0.00 -3.99 2.52 -6.64 -1.26 -5.01 119.36 102.86 1rk7 n ILE 104 Ca 0.00 -1.49 0.02 0.00 -1.77 0.00 0.00 62.75 59.51 1rk7 n ILE 104 Cb 0.00 -0.91 0.01 0.00 -1.44 0.00 0.00 39.64 37.30 1rk7 n ILE 104 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 1rk7 n SER 105 N -2.89 -0.58 -1.36 7.28 3.41 -1.26 -4.45 113.62 113.77 1rk7 n SER 105 Ca 0.15 -1.06 -0.05 0.00 -0.26 0.00 0.00 58.87 57.65 1rk7 n SER 105 Cb 0.55 0.89 0.21 0.00 -0.26 0.00 0.00 64.21 65.61 1rk7 n SER 105 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1rk7 n LEU 106 N 0.00 4.68 -5.00 1.04 4.77 -1.26 -1.13 117.00 120.10 1rk7 n LEU 106 Ca 0.03 -3.58 -0.24 0.00 -0.03 0.00 0.00 56.01 52.19 1rk7 n LEU 106 Cb 0.31 -0.66 0.13 0.00 -2.33 0.00 0.00 43.42 40.87 1rk7 n LEU 106 CO 0.08 1.09 0.61 -0.55 -1.33 0.00 0.00 177.39 177.29 1rk7 s SER 107 N -2.12 4.02 -1.31 -1.43 0.15 -1.26 -4.69 113.70 107.06 1rk7 s SER 107 Ca 0.47 -0.45 -0.17 0.00 0.70 0.00 0.00 55.95 56.50 1rk7 s SER 107 Cb 0.41 0.22 0.03 0.00 -1.71 0.00 0.00 66.02 64.98 1rk7 s SER 107 CO 0.04 -2.11 1.93 0.61 1.20 0.00 0.00 173.24 174.92 1rk7 n GLY 108 N -3.01 3.07 0.00 9.45 0.00 -1.26 -2.36 105.19 111.08 1rk7 n GLY 108 Ca 0.17 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1rk7 n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 109 N 8.09 0.00 -0.09 1.61 2.03 -1.26 -4.99 116.55 121.95 1rk7 n ASP 109 Ca 0.50 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.69 1rk7 n ASP 109 Cb 0.43 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.78 1rk7 n ASP 109 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1rk7 n HIS 110 N 0.00 0.96 -3.19 -0.67 8.25 -1.22 -5.04 115.22 114.31 1rk7 n HIS 110 Ca 0.00 0.41 -0.04 0.00 -0.26 0.00 0.00 57.72 57.83 1rk7 n HIS 110 Cb 0.00 -0.91 0.00 0.00 1.12 0.00 0.00 29.99 30.20 1rk7 n HIS 110 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1rk7 n SER 111 N -4.54 -6.57 -0.82 0.41 3.41 -0.28 -4.85 113.62 100.38 1rk7 n SER 111 Ca -0.18 0.42 0.12 0.00 -0.26 0.00 0.00 58.87 58.97 1rk7 n SER 111 Cb 0.45 -1.89 0.26 0.00 -0.26 0.00 0.00 64.21 62.77 1rk7 n SER 111 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1rk7 n ILE 112 N 1.09 0.11 -1.16 -1.33 -5.35 -0.52 -4.72 119.36 107.47 1rk7 n ILE 112 Ca -0.01 -0.46 -0.40 0.00 -0.27 0.00 0.00 62.75 61.62 1rk7 n ILE 112 Cb 0.48 1.02 -0.08 0.00 -1.74 0.00 0.00 39.64 39.33 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1rk7 n ILE 113 N 0.95 1.31 0.00 7.28 2.08 -1.26 -3.03 119.36 126.69 1rk7 n ILE 113 Ca 0.16 -1.19 0.00 0.00 0.56 0.00 0.00 62.75 62.28 1rk7 n ILE 113 Cb 0.51 -2.21 0.00 0.00 -0.75 0.00 0.00 39.64 37.19 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 4.91 0.00 3.51 7.39 0.00 -1.26 -4.88 105.19 114.87 1rk7 n GLY 114 Ca 0.48 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.07 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 3.30 -1.29 1.61 1.81 -1.17 -4.78 118.95 118.43 1rk7 s ARG 115 Ca 0.00 -0.33 -0.18 0.00 -1.72 0.00 0.00 55.73 53.50 1rk7 s ARG 115 Cb 0.00 -4.08 0.05 0.00 -0.45 0.00 0.00 34.95 30.46 1rk7 s ARG 115 CO 0.00 -1.57 1.79 2.41 -0.68 0.00 0.00 175.30 177.25 1rk7 n THR 116 N 6.18 3.67 -1.65 0.02 -1.04 -1.26 -2.93 114.28 117.27 1rk7 n THR 116 Ca 0.01 -3.78 -0.18 0.00 -2.04 0.00 0.00 64.05 58.05 1rk7 n THR 116 Cb 0.47 -2.34 -0.06 0.00 -1.82 0.00 0.00 70.33 66.58 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1rk7 s LEU 117 N 4.89 2.98 -0.61 -4.42 2.01 -1.16 -2.82 118.68 119.55 1rk7 s LEU 117 Ca 0.55 0.07 0.05 0.00 0.01 0.00 0.00 54.13 54.81 1rk7 s LEU 117 Cb 0.04 -2.55 0.18 0.00 0.01 0.00 0.00 46.19 43.88 1rk7 s LEU 117 CO 0.08 -3.58 0.49 1.33 1.01 0.00 0.00 176.35 175.68 1rk7 n VAL 118 N 8.54 0.91 -1.45 -1.59 0.24 -0.79 -2.17 118.33 122.02 1rk7 n VAL 118 Ca 0.44 -4.52 -0.50 0.00 -2.04 0.00 0.00 64.34 57.73 1rk7 n VAL 118 Cb 0.45 -2.03 -0.04 0.00 -1.47 0.00 0.00 33.84 30.75 1rk7 n VAL 118 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1rk7 n VAL 119 N 2.00 1.56 -2.21 3.34 0.24 -1.26 -4.11 118.33 117.88 1rk7 n VAL 119 Ca 0.24 -0.39 -0.27 0.00 -2.04 0.00 0.00 64.34 61.88 1rk7 n VAL 119 Cb 0.40 -0.16 0.15 0.00 -1.47 0.00 0.00 33.84 32.76 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 -0.77 1.59 -0.61 6.34 3.76 -0.48 -1.94 115.29 123.18 1rk7 s HIS 120 Ca 0.69 0.06 0.05 0.00 -0.15 0.00 0.00 55.06 55.71 1rk7 s HIS 120 Cb -0.96 -3.63 0.32 0.00 1.11 0.00 0.00 32.58 29.42 1rk7 s HIS 120 CO 0.56 -2.25 0.95 -1.91 -0.85 0.00 0.00 174.74 171.24 1rk7 n GLU 121 N -3.37 3.20 0.00 1.40 0.00 -0.79 -4.50 120.64 116.59 1rk7 n GLU 121 Ca 0.15 -4.82 0.00 0.00 0.00 0.00 0.00 57.16 52.49 1rk7 n GLU 121 Cb 0.60 -2.25 0.00 0.00 0.00 0.00 0.00 31.44 29.78 1rk7 n GLU 121 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1rk7 n LYS 122 N -0.02 0.00 0.00 5.31 4.81 -1.26 -4.80 118.16 122.20 1rk7 n LYS 122 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 1rk7 n LYS 122 Cb 0.39 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.44 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 -0.33 0.00 -3.22 3.14 0.00 -1.25 -0.47 120.51 118.38 1rk7 n ALA 123 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rk7 n ALA 123 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1rk7 n ALA 123 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1rk7 s ASP 124 N -1.29 -1.28 0.65 0.00 2.15 -1.26 -3.78 116.67 111.86 1rk7 s ASP 124 Ca 0.00 -0.75 0.40 0.00 0.43 0.00 0.00 52.55 52.63 1rk7 s ASP 124 Cb 0.00 1.84 2.20 0.00 -0.30 0.00 0.00 42.92 46.66 1rk7 s ASP 124 CO 0.00 -0.19 2.30 -0.78 -0.17 0.00 0.00 175.17 176.33 1rk7 h ASP 125 N 7.13 0.00 -0.89 -0.34 1.82 -1.74 -3.44 116.42 118.95 1rk7 h ASP 125 Ca 0.04 0.00 -0.31 0.00 -0.39 0.00 0.00 57.03 56.38 1rk7 h ASP 125 Cb 1.17 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.06 1rk7 h ASP 125 CO 0.12 0.00 -0.28 0.18 -1.61 0.00 0.00 179.24 177.65 1rk7 n LEU 126 N -3.28 -0.91 0.00 2.28 4.77 -1.25 -4.77 117.00 113.84 1rk7 n LEU 126 Ca -0.03 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1rk7 n LEU 126 Cb 0.11 -2.55 0.00 0.00 -2.33 0.00 0.00 43.42 38.65 1rk7 n LEU 126 CO 0.22 -0.96 0.00 0.61 -1.33 0.00 0.00 177.39 175.92 1rk7 n GLY 127 N -0.10 4.76 2.66 -0.72 0.00 -1.26 -4.89 105.19 105.64 1rk7 n GLY 127 Ca -0.15 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 1rk7 n GLY 127 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rk7 s LYS 128 N 3.97 1.15 -0.05 1.61 2.20 -1.26 -4.60 119.74 122.76 1rk7 s LYS 128 Ca 0.00 -1.88 0.05 0.00 -0.36 0.00 0.00 55.97 53.78 1rk7 s LYS 128 Cb 0.00 -2.14 0.22 0.00 -1.51 0.00 0.00 37.83 34.41 1rk7 s LYS 128 CO 0.00 -1.17 0.97 0.41 -0.36 0.00 0.00 175.35 175.20 1rk7 n GLY 129 N 3.63 1.26 0.00 5.54 0.00 -1.26 -4.91 105.19 109.44 1rk7 n GLY 129 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.42 -0.78 3.05 -0.02 0.00 -1.26 -4.90 105.19 101.70 1rk7 n GLY 130 Ca 0.08 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 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 -4.00 -0.17 -1.10 1.61 0.01 -1.26 -4.62 114.94 105.40 1rk7 s ASN 131 Ca 0.00 0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.48 1rk7 s ASN 131 Cb 0.00 0.34 0.00 0.00 0.41 0.00 0.00 41.25 42.00 1rk7 s ASN 131 CO 0.00 -0.07 0.00 1.21 -1.51 0.00 0.00 177.10 176.73 1rk7 n GLU 132 N 2.95 -1.43 0.00 -0.60 2.13 -1.26 -4.59 120.64 117.85 1rk7 n GLU 132 Ca -0.13 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1rk7 n GLU 132 Cb 0.59 -4.88 0.00 0.00 0.27 0.00 0.00 31.44 27.41 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1rk7 n GLN 133 N -1.90 0.00 0.15 5.31 -0.06 -1.26 -4.86 117.38 114.76 1rk7 n GLN 133 Ca -0.11 0.00 0.10 0.00 -2.00 0.00 0.00 57.00 54.99 1rk7 n GLN 133 Cb 0.40 0.00 0.06 0.00 -4.06 0.00 0.00 30.24 26.64 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 1rk7 h SER 134 N 0.00 0.00 0.22 1.69 0.02 -1.86 -2.92 113.55 110.70 1rk7 h SER 134 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rk7 h SER 134 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1rk7 h SER 134 CO 0.00 0.09 0.00 0.35 -1.14 0.00 0.00 176.83 176.13 1rk7 n THR 135 N -2.92 0.25 -0.03 -2.27 -2.24 -1.26 0.19 114.28 106.00 1rk7 n THR 135 Ca 0.01 0.06 -0.05 0.00 -2.27 0.00 0.00 64.05 61.80 1rk7 n THR 135 Cb 0.58 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 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 -1.17 0.17 -0.14 -0.78 2.85 -1.21 0.19 118.16 118.06 1rk7 n LYS 136 Ca 0.12 0.04 -0.28 0.00 -1.05 0.00 0.00 58.31 57.14 1rk7 n LYS 136 Cb 0.12 -1.10 -0.10 0.00 -0.65 0.00 0.00 35.03 33.30 1rk7 n LYS 136 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1rk7 n THR 137 N -2.75 1.52 0.00 0.58 5.66 -1.10 -4.29 114.28 113.90 1rk7 n THR 137 Ca -0.12 -0.42 0.00 0.00 -3.05 0.00 0.00 64.05 60.46 1rk7 n THR 137 Cb 0.62 -1.81 0.00 0.00 -1.55 0.00 0.00 70.33 67.60 1rk7 n THR 137 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rk7 n GLY 138 N 1.42 1.77 1.36 1.09 0.00 0.52 -4.73 105.19 106.62 1rk7 n GLY 138 Ca -0.53 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.12 0.00 1.61 2.85 -1.23 -2.79 115.26 113.57 1rk7 n ASN 139 Ca 0.00 -0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 1rk7 n ASN 139 Cb 0.00 -0.74 0.00 0.00 1.24 0.00 0.00 39.78 40.28 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rk7 n ALA 140 N -1.38 0.00 -3.17 5.20 0.00 -1.26 -3.75 120.51 116.15 1rk7 n ALA 140 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.03 1rk7 n ALA 140 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.94 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 0.00 4.93 2.45 0.00 0.00 -1.26 -4.43 105.19 106.88 1rk7 n GLY 141 Ca 0.00 -2.68 -0.25 0.00 0.00 0.00 0.00 46.02 43.10 1rk7 n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 s SER 142 N -1.46 1.36 0.42 1.61 0.01 -1.26 -4.93 113.70 109.44 1rk7 s SER 142 Ca 0.32 -2.78 -0.24 0.00 1.31 0.00 0.00 55.95 54.56 1rk7 s SER 142 Cb 0.04 -0.19 -0.11 0.00 0.21 0.00 0.00 66.02 65.98 1rk7 s SER 142 CO 0.05 -0.18 1.02 0.54 0.41 0.00 0.00 173.24 175.07 1rk7 n ARG 143 N 3.07 1.37 0.03 12.44 1.74 -1.26 -1.89 116.66 132.16 1rk7 n ARG 143 Ca 0.26 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 1rk7 n ARG 143 Cb 0.47 -2.05 0.00 0.00 -1.02 0.00 0.00 32.46 29.86 1rk7 n ARG 143 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1rk7 n LEU 144 N 0.51 0.16 -4.96 0.55 4.77 -0.82 -4.90 117.00 112.31 1rk7 n LEU 144 Ca 0.09 0.11 -0.25 0.00 -0.03 0.00 0.00 56.01 55.93 1rk7 n LEU 144 Cb 0.39 0.02 0.10 0.00 -2.33 0.00 0.00 43.42 41.59 1rk7 n LEU 144 CO 0.57 -0.59 0.61 0.00 -1.33 0.00 0.00 177.39 176.64 1rk7 s ALA 145 N -2.00 3.27 -0.47 -1.18 0.00 -1.26 0.10 121.76 120.22 1rk7 s ALA 145 Ca 0.00 -1.27 0.06 0.00 0.00 0.00 0.00 51.96 50.75 1rk7 s ALA 145 Cb 0.00 -2.38 0.25 0.00 0.00 0.00 0.00 23.12 21.00 1rk7 s ALA 145 CO 0.00 -1.47 0.85 0.00 0.00 0.00 0.00 175.76 175.14 1rk7 s GLY 147 N -1.59 3.12 0.76 0.00 0.00 -0.92 -3.75 107.32 104.94 1rk7 s GLY 147 Ca 0.32 -3.85 -0.11 0.00 0.00 0.00 0.00 44.72 41.08 1rk7 s GLY 147 CO -0.20 1.23 1.09 0.14 0.00 0.00 0.00 173.10 175.35 1rk7 s VAL 148 N -1.34 3.37 0.44 1.40 1.01 -1.25 -3.00 120.40 121.01 1rk7 s VAL 148 Ca 0.28 0.45 -0.22 0.00 0.00 0.00 0.00 61.98 62.49 1rk7 s VAL 148 Cb -0.08 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.26 1rk7 s VAL 148 CO -0.11 -0.57 1.05 -0.63 0.00 0.00 0.00 175.10 174.83 1rk7 s ILE 149 N -2.89 3.72 -0.29 2.22 -1.09 -1.15 -4.19 121.20 117.54 1rk7 s ILE 149 Ca 0.61 1.22 0.04 0.00 -2.23 0.00 0.00 60.65 60.29 1rk7 s ILE 149 Cb -0.17 -3.58 0.18 0.00 -1.58 0.00 0.00 42.46 37.31 1rk7 s ILE 149 CO 0.55 -0.09 0.52 -0.83 -1.23 0.00 0.00 174.94 173.86 1rk7 s GLY 150 N -1.72 -0.99 0.26 6.18 0.00 0.58 -4.58 107.32 107.05 1rk7 s GLY 150 Ca 0.62 0.81 -0.22 0.00 0.00 0.00 0.00 44.72 45.93 1rk7 s GLY 150 CO 0.25 3.42 0.28 1.39 0.00 0.00 0.00 173.10 178.44 1rk7 n ILE 151 N 5.40 1.22 -4.32 0.90 2.08 -1.26 -2.24 119.36 121.12 1rk7 n ILE 151 Ca 0.03 -0.44 -0.18 0.00 0.56 0.00 0.00 62.75 62.72 1rk7 n ILE 151 Cb 0.52 0.00 -0.09 0.00 -0.75 0.00 0.00 39.64 39.32 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 -1.15 1.87 -1.11 -1.39 0.00 -0.96 -4.76 121.76 114.25 1rk7 s ALA 152 Ca 0.54 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.73 1rk7 s ALA 152 Cb -0.70 1.16 0.00 0.00 0.00 0.00 0.00 23.12 23.57 1rk7 s ALA 152 CO 0.52 -0.51 0.28 0.94 0.00 0.00 0.00 175.76 176.99