#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 1.15 -0.29 0.00 -1.32 -1.16 -5.06 115.64 108.95 1rk7 s THR 2 Ca 0.00 -0.50 0.02 0.00 -1.21 0.00 0.00 61.69 59.99 1rk7 s THR 2 Cb 0.00 -1.04 0.08 0.00 -1.51 0.00 0.00 72.50 70.04 1rk7 s THR 2 CO 0.00 0.35 0.01 -0.75 -2.21 0.00 0.00 174.62 172.03 1rk7 s LYS 3 N 0.53 1.38 0.38 7.08 2.20 -1.26 -2.12 119.74 127.93 1rk7 s LYS 3 Ca -0.12 -1.32 -0.13 0.00 -0.36 0.00 0.00 55.97 54.04 1rk7 s LYS 3 Cb -0.15 -2.66 -0.08 0.00 -1.51 0.00 0.00 37.83 33.43 1rk7 s LYS 3 CO 0.03 -0.80 0.77 0.00 -0.36 0.00 0.00 175.35 174.99 1rk7 s ALA 4 N 1.27 3.32 0.19 3.13 0.00 0.27 -1.21 121.76 128.73 1rk7 s ALA 4 Ca 0.03 -0.08 0.06 0.00 0.00 0.00 0.00 51.96 51.98 1rk7 s ALA 4 Cb -0.19 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.13 1rk7 s ALA 4 CO -0.11 0.12 -0.12 0.08 0.00 0.00 0.00 175.76 175.73 1rk7 s VAL 5 N -2.22 1.48 -0.41 0.00 1.01 -0.97 0.14 120.40 119.42 1rk7 s VAL 5 Ca 0.53 -2.14 0.06 0.00 0.00 0.00 0.00 61.98 60.42 1rk7 s VAL 5 Cb -0.10 -1.99 0.17 0.00 0.00 0.00 0.00 36.38 34.46 1rk7 s VAL 5 CO 0.25 -0.63 0.53 0.00 0.00 0.00 0.00 175.10 175.25 1rk7 s ALA 6 N -3.13 -1.35 -1.28 5.51 0.00 0.45 -0.27 121.76 121.69 1rk7 s ALA 6 Ca 0.21 -0.52 -0.16 0.00 0.00 0.00 0.00 51.96 51.48 1rk7 s ALA 6 Cb 0.01 -2.40 0.11 0.00 0.00 0.00 0.00 23.12 20.83 1rk7 s ALA 6 CO 0.05 -2.18 1.66 1.33 0.00 0.00 0.00 175.76 176.62 1rk7 n VAL 7 N 4.00 4.04 -1.60 0.00 0.24 -1.26 -1.12 118.33 122.64 1rk7 n VAL 7 Ca 0.14 -4.28 -0.59 0.00 -2.04 0.00 0.00 64.34 57.56 1rk7 n VAL 7 Cb 0.52 -2.40 -0.08 0.00 -1.47 0.00 0.00 33.84 30.40 1rk7 n VAL 7 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1rk7 n LEU 8 N 7.16 0.84 0.00 1.34 4.32 0.24 -4.49 117.00 126.42 1rk7 n LEU 8 Ca 0.45 1.15 0.00 0.00 -0.02 0.00 0.00 56.01 57.59 1rk7 n LEU 8 Cb 0.44 -0.99 0.00 0.00 -1.62 0.00 0.00 43.42 41.25 1rk7 n LEU 8 CO 0.73 -1.35 0.11 1.17 -1.22 0.00 0.00 177.39 176.83 1rk7 n LYS 9 N 2.66 0.00 0.00 3.23 0.00 -1.26 -3.32 118.16 119.47 1rk7 n LYS 9 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.54 1rk7 n LYS 9 Cb 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 35.03 34.44 1rk7 n LYS 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1rk7 n GLY 10 N 0.88 2.80 0.38 3.14 0.00 -1.24 -3.56 105.19 107.58 1rk7 n GLY 10 Ca 0.00 -1.16 0.20 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 0.00 1.61 3.58 -1.83 -3.43 116.42 116.34 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 -1.48 0.76 0.14 -0.78 0.00 -1.26 -4.99 105.19 97.59 1rk7 n GLY 12 Ca 0.06 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 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 0.25 -5.94 1.61 0.13 -1.90 -3.46 132.00 122.69 1rk7 h PRO 13 Ca 0.00 -0.25 -0.63 0.00 -0.87 0.00 0.00 66.00 64.25 1rk7 h PRO 13 Cb 0.00 0.06 0.14 0.00 0.13 0.00 0.00 31.00 31.34 1rk7 h PRO 13 CO 0.00 0.94 -0.82 0.28 -0.23 0.00 0.00 178.00 178.17 1rk7 n VAL 14 N -3.73 1.03 0.00 1.56 0.31 -1.22 -4.59 118.33 111.69 1rk7 n VAL 14 Ca -0.04 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1rk7 n VAL 14 Cb 0.76 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.69 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 1.23 0.00 -3.16 5.55 7.27 0.15 -3.73 117.38 124.70 1rk7 n GLN 15 Ca 0.13 0.00 -0.25 0.00 0.07 0.00 0.00 57.00 56.95 1rk7 n GLN 15 Cb 0.35 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 32.99 1rk7 n GLN 15 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1rk7 s GLY 16 N 0.00 1.39 -0.34 1.69 0.00 -1.21 -3.62 107.32 105.23 1rk7 s GLY 16 Ca 0.00 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 43.94 1rk7 s GLY 16 CO 0.00 -0.69 0.12 -0.42 0.00 0.00 0.00 173.10 172.11 1rk7 s ILE 17 N -2.44 1.19 -0.14 0.90 1.01 0.31 0.82 121.20 122.84 1rk7 s ILE 17 Ca 0.42 -1.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.24 1rk7 s ILE 17 Cb -0.10 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 1rk7 s ILE 17 CO 0.39 -0.72 -0.04 -0.51 0.00 0.00 0.00 174.94 174.06 1rk7 s ILE 18 N 1.22 3.92 0.02 2.92 1.10 -0.27 -2.08 121.20 128.03 1rk7 s ILE 18 Ca 0.12 -0.36 0.07 0.00 -0.51 0.00 0.00 60.65 59.97 1rk7 s ILE 18 Cb -0.19 -2.70 -0.02 0.00 0.15 0.00 0.00 42.46 39.70 1rk7 s ILE 18 CO -0.17 0.52 -0.21 0.20 -2.11 0.00 0.00 174.94 173.17 1rk7 s ASN 19 N 0.11 2.44 -0.24 4.50 0.01 -0.26 0.17 114.94 121.67 1rk7 s ASN 19 Ca -0.01 -0.47 -0.04 0.00 -0.71 0.00 0.00 52.86 51.63 1rk7 s ASN 19 Cb -0.14 -0.22 -0.01 0.00 0.41 0.00 0.00 41.25 41.30 1rk7 s ASN 19 CO 0.03 0.19 -0.02 -0.36 -1.51 0.00 0.00 177.10 175.43 1rk7 s PHE 20 N -0.69 3.01 -0.13 2.20 0.40 0.37 -2.67 117.98 120.47 1rk7 s PHE 20 Ca 0.08 -0.93 -0.02 0.00 -0.60 0.00 0.00 56.93 55.45 1rk7 s PHE 20 Cb -0.08 -2.14 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 1rk7 s PHE 20 CO 0.01 -0.54 -0.05 -2.00 0.70 0.00 0.00 175.22 173.34 1rk7 s GLU 21 N 1.48 3.38 -0.27 0.44 -6.30 -0.61 0.97 118.70 117.80 1rk7 s GLU 21 Ca 0.05 -0.53 -0.03 0.00 -2.50 0.00 0.00 54.97 51.97 1rk7 s GLU 21 Cb -0.15 -2.81 0.11 0.00 0.00 0.00 0.00 34.13 31.28 1rk7 s GLU 21 CO -0.02 0.38 0.21 -1.14 0.02 0.00 0.00 175.26 174.71 1rk7 s GLN 22 N -0.03 0.23 -0.32 4.30 0.74 -0.90 0.86 119.66 124.54 1rk7 s GLN 22 Ca 0.01 -0.24 0.01 0.00 0.05 0.00 0.00 55.36 55.19 1rk7 s GLN 22 Cb -0.13 -1.02 0.32 0.00 1.10 0.00 0.00 33.01 33.28 1rk7 s GLN 22 CO 0.03 -0.94 1.78 1.17 -0.55 0.00 0.00 175.29 176.77 1rk7 n LYS 23 N 5.29 1.84 -3.59 1.67 4.81 -1.26 -3.01 118.16 123.90 1rk7 n LYS 23 Ca -0.04 -1.79 -0.16 0.00 -0.87 0.00 0.00 58.31 55.44 1rk7 n LYS 23 Cb 0.45 -1.70 -0.07 0.00 0.02 0.00 0.00 35.03 33.74 1rk7 n LYS 23 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1rk7 s GLU 24 N -2.03 0.96 0.00 1.64 0.41 -1.26 -4.98 118.70 113.43 1rk7 s GLU 24 Ca 0.35 0.05 0.27 0.00 -0.41 0.00 0.00 54.97 55.23 1rk7 s GLU 24 Cb 0.28 0.44 0.90 0.00 -1.78 0.00 0.00 34.13 33.98 1rk7 s GLU 24 CO 0.03 -0.30 1.66 0.43 -0.49 0.00 0.00 175.26 176.58 1rk7 n SER 25 N 0.91 1.04 -1.25 -0.19 7.64 -1.26 -4.21 113.62 116.30 1rk7 n SER 25 Ca -0.20 -0.98 -0.04 0.00 1.01 0.00 0.00 58.87 58.67 1rk7 n SER 25 Cb 0.57 0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.84 1rk7 n SER 25 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1rk7 n ASN 26 N -0.52 -0.80 0.00 6.43 0.23 -1.26 -4.97 115.26 114.37 1rk7 n ASN 26 Ca 0.14 -1.53 0.00 0.00 -0.53 0.00 0.00 54.58 52.66 1rk7 n ASN 26 Cb 0.34 0.29 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 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 -0.30 5.06 3.80 4.83 0.00 -1.26 -5.04 105.19 112.28 1rk7 n GLY 27 Ca -0.18 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 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 2.10 1.87 -0.29 1.61 0.04 -1.26 -4.53 135.00 134.54 1rk7 s PRO 28 Ca 0.00 0.56 -0.01 0.00 0.04 0.00 0.00 61.00 61.59 1rk7 s PRO 28 Cb 0.00 -1.90 0.09 0.00 0.04 0.00 0.00 34.50 32.73 1rk7 s PRO 28 CO 0.00 -1.75 0.07 0.08 0.04 0.00 0.00 177.00 175.44 1rk7 s VAL 29 N -3.18 0.95 -0.68 -0.36 1.01 0.37 -4.37 120.40 114.13 1rk7 s VAL 29 Ca 0.61 -1.30 -0.26 0.00 0.00 0.00 0.00 61.98 61.03 1rk7 s VAL 29 Cb -0.14 -1.63 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 1rk7 s VAL 29 CO 0.54 -0.55 2.19 -0.54 0.00 0.00 0.00 175.10 176.73 1rk7 s LYS 30 N 1.60 2.18 -0.22 2.72 1.02 0.25 -3.30 119.74 123.99 1rk7 s LYS 30 Ca 0.07 0.63 -0.14 0.00 0.02 0.00 0.00 55.97 56.55 1rk7 s LYS 30 Cb -0.17 -4.69 -0.04 0.00 -0.52 0.00 0.00 37.83 32.40 1rk7 s LYS 30 CO -0.20 -3.49 0.30 0.08 -0.92 0.00 0.00 175.35 171.11 1rk7 s VAL 31 N 11.76 5.27 -0.03 3.17 1.01 -0.49 -1.58 120.40 139.51 1rk7 s VAL 31 Ca 0.84 0.48 -0.20 0.00 0.00 0.00 0.00 61.98 63.10 1rk7 s VAL 31 Cb -0.13 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.66 1rk7 s VAL 31 CO 0.14 0.29 0.44 -1.66 0.00 0.00 0.00 175.10 174.32 1rk7 s TRP 32 N 1.20 -0.36 0.08 5.22 -2.14 -1.09 -0.83 118.94 121.02 1rk7 s TRP 32 Ca 0.14 0.61 -0.07 0.00 2.66 0.00 0.00 56.10 59.44 1rk7 s TRP 32 Cb -0.14 0.20 0.02 0.00 -3.10 0.00 0.00 33.47 30.46 1rk7 s TRP 32 CO 0.06 -0.46 0.34 0.41 -2.66 0.00 0.00 176.95 174.64 1rk7 n GLY 33 N 1.24 1.17 3.47 3.67 0.00 -1.06 -1.10 105.19 112.57 1rk7 n GLY 33 Ca -0.20 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 44.78 1rk7 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rk7 s SER 34 N -1.81 -0.91 0.60 1.61 1.04 -0.88 -1.04 113.70 112.31 1rk7 s SER 34 Ca 0.07 1.30 -0.07 0.00 0.48 0.00 0.00 55.95 57.73 1rk7 s SER 34 Cb -0.01 2.02 -0.00 0.00 0.10 0.00 0.00 66.02 68.12 1rk7 s SER 34 CO 0.02 -0.23 0.93 -0.63 0.98 0.00 0.00 173.24 174.32 1rk7 s ILE 35 N 2.81 3.92 -0.26 -1.02 1.01 0.30 -0.53 121.20 127.43 1rk7 s ILE 35 Ca -0.01 0.21 -0.02 0.00 0.00 0.00 0.00 60.65 60.84 1rk7 s ILE 35 Cb -0.13 -3.56 0.13 0.00 0.01 0.00 0.00 42.46 38.91 1rk7 s ILE 35 CO -0.18 -0.62 0.33 -0.54 0.00 0.00 0.00 174.94 173.93 1rk7 s LYS 36 N -5.04 0.32 0.00 2.79 1.02 -1.24 -3.29 119.74 114.30 1rk7 s LYS 36 Ca 0.54 0.20 0.00 0.00 0.02 0.00 0.00 55.97 56.73 1rk7 s LYS 36 Cb -0.11 -0.65 0.00 0.00 -0.52 0.00 0.00 37.83 36.56 1rk7 s LYS 36 CO 0.47 -0.82 0.00 0.41 -0.92 0.00 0.00 175.35 174.49 1rk7 n GLY 37 N 5.34 4.11 0.00 -3.33 0.00 -1.26 -0.67 105.19 109.38 1rk7 n GLY 37 Ca -0.03 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.72 0.99 7.99 -1.26 -4.82 117.00 116.18 1rk7 n LEU 38 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.86 1rk7 n LEU 38 Cb 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.22 1rk7 n LEU 38 CO 0.00 -1.19 0.11 0.42 -1.51 0.00 0.00 177.39 175.22 1rk7 s THR 39 N -0.57 0.02 -0.42 -5.08 -4.23 -1.26 -3.78 115.64 100.33 1rk7 s THR 39 Ca 0.00 -0.20 -0.38 0.00 -1.18 0.00 0.00 61.69 59.93 1rk7 s THR 39 Cb 0.00 -0.65 -0.16 0.00 1.34 0.00 0.00 72.50 73.02 1rk7 s THR 39 CO 0.00 -0.11 1.57 1.21 -0.54 0.00 0.00 174.62 176.75 1rk7 n GLU 40 N 1.96 0.00 0.00 3.99 2.13 -1.26 -4.33 120.64 123.13 1rk7 n GLU 40 Ca -0.17 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.65 1rk7 n GLU 40 Cb 0.57 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 31.01 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 4.82 3.21 3.74 8.31 0.00 -1.26 -4.88 105.19 119.13 1rk7 n GLY 41 Ca 0.36 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 1rk7 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rk7 s LEU 42 N 0.00 3.20 -0.41 0.99 1.02 -1.26 -2.42 118.68 119.80 1rk7 s LEU 42 Ca 0.00 2.07 0.05 0.00 0.02 0.00 0.00 54.13 56.27 1rk7 s LEU 42 Cb 0.00 -4.56 0.19 0.00 0.02 0.00 0.00 46.19 41.84 1rk7 s LEU 42 CO 0.00 -2.12 0.38 1.41 0.02 0.00 0.00 176.35 176.05 1rk7 n HIS 43 N -3.05 -0.84 0.00 0.29 8.25 0.16 -3.19 115.22 116.86 1rk7 n HIS 43 Ca 0.11 -3.35 0.00 0.00 -0.26 0.00 0.00 57.72 54.22 1rk7 n HIS 43 Cb 0.52 0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.76 1rk7 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rk7 n GLY 44 N 2.51 0.80 2.67 -1.41 0.00 -1.16 -3.96 105.19 104.64 1rk7 n GLY 44 Ca 0.28 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.04 1.00 1.61 0.40 -1.26 -3.41 117.98 116.35 1rk7 s PHE 45 Ca 0.00 -0.02 -0.19 0.00 -0.60 0.00 0.00 56.93 56.12 1rk7 s PHE 45 Cb 0.00 -0.55 0.00 0.00 0.51 0.00 0.00 43.02 42.98 1rk7 s PHE 45 CO 0.00 -0.46 -0.49 -2.39 0.70 0.00 0.00 175.22 172.58 1rk7 n HIS 46 N 5.30 -1.54 -1.27 0.36 1.44 -1.23 -4.74 115.22 113.53 1rk7 n HIS 46 Ca -0.06 0.35 0.00 0.00 -2.01 0.00 0.00 57.72 56.00 1rk7 n HIS 46 Cb 0.49 -1.44 0.00 0.00 0.12 0.00 0.00 29.99 29.16 1rk7 n HIS 46 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1rk7 n VAL 47 N -3.97 -4.36 -4.44 0.61 0.31 0.25 -4.85 118.33 101.89 1rk7 n VAL 47 Ca 0.01 1.87 -0.22 0.00 -0.01 0.00 0.00 64.34 65.98 1rk7 n VAL 47 Cb 0.56 -2.64 -0.09 0.00 -0.91 0.00 0.00 33.84 30.76 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 -2.43 1.77 0.38 3.52 -3.43 -1.26 -4.92 115.29 108.91 1rk7 s HIS 48 Ca 0.00 -1.22 0.22 0.00 -0.80 0.00 0.00 55.06 53.27 1rk7 s HIS 48 Cb 0.00 -1.10 1.37 0.00 -1.43 0.00 0.00 32.58 31.42 1rk7 s HIS 48 CO 0.00 -0.28 1.57 -1.91 -2.00 0.00 0.00 174.74 172.13 1rk7 n GLU 49 N -0.75 -0.06 -1.71 -0.38 2.13 -1.26 -4.87 120.64 113.75 1rk7 n GLU 49 Ca -0.03 1.36 0.00 0.00 0.66 0.00 0.00 57.16 59.15 1rk7 n GLU 49 Cb 0.65 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.89 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 -5.19 -4.81 -1.92 5.31 1.02 -1.26 -4.76 120.64 109.03 1rk7 n GLU 50 Ca 0.38 3.51 0.00 0.00 -0.02 0.00 0.00 57.16 61.03 1rk7 n GLU 50 Cb 1.32 -3.89 0.00 0.00 -0.02 0.00 0.00 31.44 28.85 1rk7 n GLU 50 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1rk7 n GLU 51 N 0.03 0.00 -3.13 3.49 1.02 -1.26 -5.08 120.64 115.71 1rk7 n GLU 51 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.70 1rk7 n GLU 51 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 1rk7 n GLU 51 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1rk7 s ASP 52 N -0.95 6.20 0.00 1.62 2.15 -1.26 -4.65 116.67 119.78 1rk7 s ASP 52 Ca 0.00 -1.16 0.00 0.00 0.43 0.00 0.00 52.55 51.82 1rk7 s ASP 52 Cb 0.00 -2.30 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 1rk7 s ASP 52 CO 0.00 -1.01 0.00 0.59 -0.17 0.00 0.00 175.17 174.58 1rk7 n ASN 53 N 6.29 0.00 0.00 -0.34 3.02 -1.26 -5.06 115.26 117.90 1rk7 n ASN 53 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1rk7 n ASN 53 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 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 -4.88 114.28 117.21 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 -0.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.71 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 -2.11 0.00 -0.00 1.79 0.00 -1.26 -3.50 120.51 115.42 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 -0.09 3.00 0.00 0.00 -1.26 -5.08 105.19 101.76 1rk7 n GLY 56 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 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 4.19 0.00 -3.15 0.00 -2.24 -1.26 -5.13 114.28 106.69 1rk7 n THR 58 Ca 0.08 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.90 1rk7 n THR 58 Cb 0.60 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.82 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 -0.46 -1.45 0.00 3.42 0.01 -1.26 -4.97 113.70 108.99 1rk7 s SER 59 Ca 0.00 0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.79 1rk7 s SER 59 Cb 0.00 2.07 0.00 0.00 0.21 0.00 0.00 66.02 68.30 1rk7 s SER 59 CO 0.00 -0.27 0.00 0.00 0.41 0.00 0.00 173.24 173.38 1rk7 n ALA 60 N 5.42 1.25 0.00 1.44 0.00 -1.26 -5.10 120.51 122.25 1rk7 n ALA 60 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1rk7 n ALA 60 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 3.13 -1.42 3.73 0.00 0.00 -1.26 -5.15 105.19 104.23 1rk7 n GLY 61 Ca 0.00 0.80 -0.41 0.00 0.00 0.00 0.00 46.02 46.41 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 4.54 -0.11 1.61 0.04 -1.26 -4.93 135.00 134.90 1rk7 s PRO 62 Ca 0.00 1.74 0.14 0.00 0.04 0.00 0.00 61.00 62.92 1rk7 s PRO 62 Cb 0.00 -3.29 0.28 0.00 0.04 0.00 0.00 34.50 31.53 1rk7 s PRO 62 CO 0.00 -0.02 1.14 0.72 0.04 0.00 0.00 177.00 178.88 1rk7 n HIS 63 N 2.78 0.00 -1.03 0.56 8.25 -1.26 -4.82 115.22 119.70 1rk7 n HIS 63 Ca 0.04 -0.87 0.12 0.00 -0.26 0.00 0.00 57.72 56.75 1rk7 n HIS 63 Cb 0.46 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.83 -2.27 -2.81 4.41 3.72 -1.26 -4.83 117.46 113.59 1rk7 n PHE 64 Ca 0.12 1.18 -0.28 0.00 -0.05 0.00 0.00 57.45 58.43 1rk7 n PHE 64 Cb 0.73 -2.07 -0.01 0.00 -0.94 0.00 0.00 39.48 37.19 1rk7 n PHE 64 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1rk7 s ASN 65 N -5.35 6.32 -1.14 4.37 4.22 -1.26 -4.83 114.94 117.27 1rk7 s ASN 65 Ca 0.00 0.89 -0.22 0.00 -2.14 0.00 0.00 52.86 51.39 1rk7 s ASN 65 Cb 0.00 -2.23 -0.00 0.00 1.28 0.00 0.00 41.25 40.30 1rk7 s ASN 65 CO 0.00 -0.49 1.78 -2.16 -2.04 0.00 0.00 177.10 174.19 1rk7 s PRO 66 N -4.46 3.20 0.00 3.55 0.04 -1.26 -3.37 135.00 132.69 1rk7 s PRO 66 Ca 0.47 -1.28 0.00 0.00 0.04 0.00 0.00 61.00 60.23 1rk7 s PRO 66 Cb -0.10 -5.33 0.00 0.00 0.04 0.00 0.00 34.50 29.11 1rk7 s PRO 66 CO 0.41 -2.98 0.00 -0.11 0.04 0.00 0.00 177.00 174.35 1rk7 n LEU 67 N 11.33 0.00 -0.17 -3.56 -0.00 -1.26 -4.95 117.00 118.39 1rk7 n LEU 67 Ca 0.43 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 56.34 1rk7 n LEU 67 Cb 0.47 0.16 0.00 0.00 -0.00 0.00 0.00 43.42 44.05 1rk7 n LEU 67 CO 0.69 -0.16 0.80 0.77 -0.00 0.00 0.00 177.39 179.50 1rk7 h SER 68 N 0.00 0.83 0.00 1.96 4.64 -1.73 -3.39 113.55 115.86 1rk7 h SER 68 Ca 0.00 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1rk7 h SER 68 Cb 0.00 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1rk7 h SER 68 CO 0.00 0.93 0.00 -1.14 -0.87 0.00 0.00 176.83 175.75 1rk7 n ARG 69 N -4.35 0.00 0.00 4.77 0.63 -1.26 -2.49 116.66 113.95 1rk7 n ARG 69 Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1rk7 n ARG 69 Cb 0.31 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.22 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1rk7 n LYS 70 N 0.00 0.00 -4.06 -0.14 5.02 -1.26 -4.90 118.16 112.82 1rk7 n LYS 70 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 1rk7 n LYS 70 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 1rk7 n LYS 70 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1rk7 n HIS 71 N 0.00 -1.07 -3.38 2.13 1.44 0.13 -4.83 115.22 109.64 1rk7 n HIS 71 Ca 0.00 0.57 0.00 0.00 -2.01 0.00 0.00 57.72 56.28 1rk7 n HIS 71 Cb 0.00 -1.59 0.00 0.00 0.12 0.00 0.00 29.99 28.52 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1rk7 n GLY 72 N -0.96 5.60 0.00 -1.39 0.00 -1.26 -4.90 105.19 102.28 1rk7 n GLY 72 Ca 0.10 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1rk7 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk7 n GLY 73 N 2.47 2.13 0.24 -0.02 0.00 -0.23 -4.68 105.19 105.11 1rk7 n GLY 73 Ca 0.00 -0.76 0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 -0.96 1.61 0.13 -2.01 -3.25 132.00 127.52 1rk7 h PRO 74 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.74 1rk7 h PRO 74 Cb 0.00 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 30.72 1rk7 h PRO 74 CO 0.00 0.00 -1.06 1.63 -0.23 0.00 0.00 178.00 178.34 1rk7 n LYS 75 N -3.05 1.91 0.00 0.86 5.02 -1.26 -5.03 118.16 116.60 1rk7 n LYS 75 Ca 0.02 -3.62 0.00 0.00 -2.02 0.00 0.00 58.31 52.69 1rk7 n LYS 75 Cb 0.41 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 1rk7 n LYS 75 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1rk7 n ASP 76 N -0.31 0.00 -0.56 4.39 2.03 -1.23 -4.85 116.55 116.02 1rk7 n ASP 76 Ca 0.17 0.00 0.09 0.00 0.52 0.00 0.00 54.79 55.57 1rk7 n ASP 76 Cb 0.80 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 41.24 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1rk7 n GLU 77 N 0.00 1.54 0.00 -0.67 2.13 -1.26 -1.07 120.64 121.31 1rk7 n GLU 77 Ca 0.00 -1.23 0.00 0.00 0.66 0.00 0.00 57.16 56.59 1rk7 n GLU 77 Cb 0.00 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 30.39 1rk7 n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1rk7 n GLU 78 N 0.50 0.00 -1.19 5.31 -0.58 -1.26 -4.92 120.64 118.49 1rk7 n GLU 78 Ca 0.09 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.96 1rk7 n GLU 78 Cb 0.40 -0.20 -0.05 0.00 -0.57 0.00 0.00 31.44 31.02 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1rk7 n ARG 79 N 0.00 -2.29 0.00 3.49 5.12 -1.04 -4.94 116.66 117.00 1rk7 n ARG 79 Ca 0.00 1.73 0.00 0.00 -1.93 0.00 0.00 57.85 57.65 1rk7 n ARG 79 Cb 0.00 -2.87 0.00 0.00 -1.16 0.00 0.00 32.46 28.43 1rk7 n ARG 79 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1rk7 n HIS 80 N -3.71 0.00 -0.03 -1.55 8.25 -1.26 -4.23 115.22 112.70 1rk7 n HIS 80 Ca -0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 1rk7 n HIS 80 Cb 0.62 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.62 1rk7 n HIS 80 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1rk7 h VAL 81 N 0.00 1.55 0.00 1.59 3.04 -1.91 -3.43 116.25 117.09 1rk7 h VAL 81 Ca 0.00 -1.94 0.00 0.00 -1.01 0.00 0.00 66.70 63.75 1rk7 h VAL 81 Cb 0.00 2.77 0.00 0.00 -2.01 0.00 0.00 31.29 32.05 1rk7 h VAL 81 CO 0.00 0.53 -0.78 0.61 -1.01 0.00 0.00 177.57 176.92 1rk7 n GLY 82 N 1.04 0.00 3.14 3.17 0.00 -1.26 -4.90 105.19 106.38 1rk7 n GLY 82 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 1rk7 n GLY 82 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 83 N -2.56 -6.05 0.09 1.61 -0.08 -1.26 -4.85 116.55 103.43 1rk7 n ASP 83 Ca 0.00 0.27 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 1rk7 n ASP 83 Cb 0.39 -1.50 0.00 0.00 2.34 0.00 0.00 41.12 42.35 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 0.97 -1.55 0.00 -2.67 -0.00 -1.26 -4.98 117.00 107.50 1rk7 n LEU 84 Ca -0.02 0.43 0.00 0.00 -0.00 0.00 0.00 56.01 56.42 1rk7 n LEU 84 Cb 0.51 1.68 0.00 0.00 -0.00 0.00 0.00 43.42 45.61 1rk7 n LEU 84 CO 0.11 -0.03 0.00 0.61 -0.00 0.00 0.00 177.39 178.08 1rk7 n GLY 85 N -1.32 0.53 3.72 -3.96 0.00 -1.26 -5.02 105.19 97.87 1rk7 n GLY 85 Ca 0.00 -2.30 -0.40 0.00 0.00 0.00 0.00 46.02 43.31 1rk7 n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk7 s ASN 86 N -2.19 7.12 -0.08 1.61 4.22 -1.26 -4.65 114.94 119.71 1rk7 s ASN 86 Ca 0.00 1.35 -0.26 0.00 -2.14 0.00 0.00 52.86 51.82 1rk7 s ASN 86 Cb 0.00 -2.47 -0.03 0.00 1.28 0.00 0.00 41.25 40.04 1rk7 s ASN 86 CO 0.00 -0.15 0.81 0.68 -2.04 0.00 0.00 177.10 176.39 1rk7 s VAL 87 N 0.81 4.96 0.15 3.54 -7.23 -1.22 -4.78 120.40 116.63 1rk7 s VAL 87 Ca 0.42 1.65 0.07 0.00 -1.81 0.00 0.00 61.98 62.31 1rk7 s VAL 87 Cb -0.19 -4.14 -0.04 0.00 0.56 0.00 0.00 36.38 32.57 1rk7 s VAL 87 CO 0.22 0.17 -0.00 -0.89 -0.31 0.00 0.00 175.10 174.28 1rk7 s THR 88 N 1.21 3.79 0.82 5.32 2.01 -1.26 0.41 115.64 127.93 1rk7 s THR 88 Ca 0.41 -1.32 -0.09 0.00 0.31 0.00 0.00 61.69 61.00 1rk7 s THR 88 Cb -0.18 -2.88 0.14 0.00 0.01 0.00 0.00 72.50 69.58 1rk7 s THR 88 CO 0.19 -0.06 1.15 0.00 -0.69 0.00 0.00 174.62 175.21 1rk7 s ALA 89 N -1.62 2.89 0.00 7.40 0.00 -1.02 -4.51 121.76 124.91 1rk7 s ALA 89 Ca 0.27 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1rk7 s ALA 89 Cb -0.10 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.48 1rk7 s ALA 89 CO 0.18 -1.83 0.00 -3.47 0.00 0.00 0.00 175.76 170.65 1rk7 n ASP 90 N -3.27 0.00 0.00 0.00 2.03 -0.07 -4.54 116.55 110.70 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 0.53 -0.78 -0.67 2.85 -1.26 -4.75 118.16 114.08 1rk7 n LYS 91 Ca 0.00 -0.60 -0.02 0.00 -1.05 0.00 0.00 58.31 56.63 1rk7 n LYS 91 Cb 0.00 -0.64 -0.03 0.00 -0.65 0.00 0.00 35.03 33.71 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 -0.31 0.00 -5.58 8.00 -1.26 -4.85 116.55 112.45 1rk7 n ASP 92 Ca 0.00 -1.56 0.00 0.00 0.71 0.00 0.00 54.79 53.94 1rk7 n ASP 92 Cb 0.35 0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 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 2.76 3.50 0.44 0.00 -1.25 -4.67 105.19 106.01 1rk7 n GLY 93 Ca -0.10 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.82 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 -3.30 1.61 0.31 -1.26 -3.84 118.33 111.85 1rk7 n VAL 94 Ca 0.00 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.81 1rk7 n VAL 94 Cb 0.00 -0.50 -0.08 0.00 -0.91 0.00 0.00 33.84 32.34 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 7.91 3.43 0.16 3.52 0.00 -1.21 -0.89 121.76 134.68 1rk7 s ALA 95 Ca 1.34 -1.38 0.02 0.00 0.00 0.00 0.00 51.96 51.95 1rk7 s ALA 95 Cb -1.17 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 18.87 1rk7 s ALA 95 CO 0.49 -1.49 0.30 0.34 0.00 0.00 0.00 175.76 175.40 1rk7 s ASP 96 N 1.82 6.34 0.10 0.00 2.15 -1.26 0.11 116.67 125.92 1rk7 s ASP 96 Ca 0.14 0.19 0.05 0.00 0.43 0.00 0.00 52.55 53.36 1rk7 s ASP 96 Cb -0.16 -1.92 -0.03 0.00 -0.30 0.00 0.00 42.92 40.50 1rk7 s ASP 96 CO 0.14 0.03 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.36 1rk7 s VAL 97 N -1.77 1.11 -0.34 1.11 1.01 -0.20 -4.88 120.40 116.44 1rk7 s VAL 97 Ca 0.35 -1.57 -0.07 0.00 0.00 0.00 0.00 61.98 60.69 1rk7 s VAL 97 Cb -0.11 -1.32 0.19 0.00 0.00 0.00 0.00 36.38 35.14 1rk7 s VAL 97 CO 0.29 -0.42 1.02 -0.94 0.00 0.00 0.00 175.10 175.05 1rk7 s SER 98 N -2.24 -0.42 0.18 3.32 1.04 -1.13 -2.57 113.70 111.88 1rk7 s SER 98 Ca 0.04 -0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.22 1rk7 s SER 98 Cb -0.06 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.56 1rk7 s SER 98 CO 0.02 -0.04 0.03 -0.63 0.98 0.00 0.00 173.24 173.59 1rk7 s ILE 99 N 1.77 0.55 -0.41 -1.02 1.09 -0.01 -5.00 121.20 118.18 1rk7 s ILE 99 Ca 0.16 -1.97 0.02 0.00 -1.10 0.00 0.00 60.65 57.77 1rk7 s ILE 99 Cb 0.04 -2.19 0.12 0.00 -1.06 0.00 0.00 42.46 39.37 1rk7 s ILE 99 CO -0.13 -0.40 0.17 -0.70 -0.10 0.00 0.00 174.94 173.78 1rk7 s GLU 100 N -3.96 1.37 -0.11 2.79 2.12 -1.26 -1.40 118.70 118.25 1rk7 s GLU 100 Ca 0.26 -1.92 -0.15 0.00 0.36 0.00 0.00 54.97 53.52 1rk7 s GLU 100 Cb 0.07 -2.71 -0.05 0.00 0.26 0.00 0.00 34.13 31.70 1rk7 s GLU 100 CO 0.05 -1.06 0.36 -0.51 -0.54 0.00 0.00 175.26 173.57 1rk7 s ASP 101 N 0.61 6.59 0.00 -1.70 1.11 -1.21 -4.79 116.67 117.28 1rk7 s ASP 101 Ca 0.14 0.70 0.00 0.00 0.18 0.00 0.00 52.55 53.57 1rk7 s ASP 101 Cb -0.22 -2.22 0.00 0.00 1.07 0.00 0.00 42.92 41.55 1rk7 s ASP 101 CO -0.07 0.14 0.00 -1.54 1.18 0.00 0.00 175.17 174.88 1rk7 n SER 102 N 3.09 1.38 -0.31 0.27 3.41 -1.26 0.14 113.62 120.34 1rk7 n SER 102 Ca -0.11 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.64 1rk7 n SER 102 Cb 0.52 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.79 1rk7 n SER 102 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1rk7 h VAL 103 N 0.00 0.32 -3.57 -3.33 2.07 -1.92 -3.40 116.25 106.42 1rk7 h VAL 103 Ca 0.00 -0.08 -0.42 0.00 0.82 0.00 0.00 66.70 67.02 1rk7 h VAL 103 Cb 0.84 0.06 0.19 0.00 -1.52 0.00 0.00 31.29 30.86 1rk7 h VAL 103 CO 0.00 0.04 0.18 0.27 0.02 0.00 0.00 177.57 178.08 1rk7 s ILE 104 N -5.89 1.65 -0.08 4.57 -5.25 -1.26 -4.88 121.20 110.05 1rk7 s ILE 104 Ca -0.12 0.00 -0.22 0.00 -0.99 0.00 0.00 60.65 59.33 1rk7 s ILE 104 Cb 0.27 -2.57 0.05 0.00 2.95 0.00 0.00 42.46 43.16 1rk7 s ILE 104 CO 0.77 0.00 0.51 -0.44 -1.79 0.00 0.00 174.94 173.99 1rk7 s SER 105 N -4.06 -0.47 0.09 4.36 0.01 -1.26 -4.93 113.70 107.44 1rk7 s SER 105 Ca 0.72 0.61 -0.08 0.00 1.31 0.00 0.00 55.95 58.51 1rk7 s SER 105 Cb -0.08 0.63 -0.20 0.00 0.21 0.00 0.00 66.02 66.58 1rk7 s SER 105 CO 0.56 -0.43 1.21 -0.07 0.41 0.00 0.00 173.24 174.92 1rk7 h LEU 106 N 3.99 0.63 -5.40 2.44 4.07 -1.94 0.73 115.31 119.83 1rk7 h LEU 106 Ca -0.28 -0.56 -0.35 0.00 0.08 0.00 0.00 57.88 56.77 1rk7 h LEU 106 Cb 1.16 -0.20 -0.24 0.00 1.08 0.00 0.00 40.66 42.47 1rk7 h LEU 106 CO 0.33 1.38 -0.74 -0.24 -1.08 0.00 0.00 178.44 178.08 1rk7 n SER 107 N -3.72 -1.60 0.00 -0.43 2.88 -1.26 -3.31 113.62 106.18 1rk7 n SER 107 Ca -0.09 -3.10 0.00 0.00 -1.33 0.00 0.00 58.87 54.34 1rk7 n SER 107 Cb 0.92 0.85 0.00 0.00 -0.75 0.00 0.00 64.21 65.23 1rk7 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rk7 n GLY 108 N 1.41 3.79 0.13 0.46 0.00 -1.26 -4.94 105.19 104.78 1rk7 n GLY 108 Ca 0.14 -0.49 0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 1.20 -0.10 1.61 -0.08 -1.26 -4.50 116.55 113.41 1rk7 n ASP 109 Ca 0.00 -1.10 -0.21 0.00 -1.51 0.00 0.00 54.79 51.97 1rk7 n ASP 109 Cb 0.00 0.85 -0.07 0.00 2.34 0.00 0.00 41.12 44.24 1rk7 n ASP 109 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1rk7 n HIS 110 N -1.05 0.00 -2.84 -0.67 8.25 -1.26 -5.03 115.22 112.63 1rk7 n HIS 110 Ca 0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.50 1rk7 n HIS 110 Cb 0.34 -0.70 -0.01 0.00 1.12 0.00 0.00 29.99 30.74 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 -3.93 -6.54 -0.16 0.41 2.88 0.00 -4.85 113.62 101.43 1rk7 n SER 111 Ca -0.38 1.16 0.09 0.00 -1.33 0.00 0.00 58.87 58.41 1rk7 n SER 111 Cb 0.75 -4.23 -0.07 0.00 -0.75 0.00 0.00 64.21 59.92 1rk7 n SER 111 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1rk7 n ILE 112 N 1.11 0.00 -1.60 2.46 -6.64 0.24 -4.95 119.36 109.97 1rk7 n ILE 112 Ca -0.06 -0.16 -0.55 0.00 -1.77 0.00 0.00 62.75 60.21 1rk7 n ILE 112 Cb 0.22 1.08 -0.07 0.00 -1.44 0.00 0.00 39.64 39.43 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.77 0.00 0.00 176.55 174.40 1rk7 n ILE 113 N -0.92 0.29 0.00 7.28 2.08 -1.21 -2.14 119.36 124.74 1rk7 n ILE 113 Ca 0.05 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.24 1rk7 n ILE 113 Cb 0.33 -1.38 0.00 0.00 -0.75 0.00 0.00 39.64 37.83 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 5.14 0.90 3.52 7.39 0.00 -1.23 -5.01 105.19 115.90 1rk7 n GLY 114 Ca 0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 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 0.20 3.89 -0.96 1.61 0.52 -0.91 -4.71 118.95 118.60 1rk7 s ARG 115 Ca 0.00 -1.97 -0.21 0.00 -0.52 0.00 0.00 55.73 53.04 1rk7 s ARG 115 Cb 0.00 -5.27 -0.26 0.00 0.52 0.00 0.00 34.95 29.94 1rk7 s ARG 115 CO 0.00 -2.03 2.42 2.41 0.02 0.00 0.00 175.30 178.12 1rk7 n THR 116 N 5.83 -0.01 -1.82 0.02 -1.04 -1.26 -4.04 114.28 111.96 1rk7 n THR 116 Ca 0.39 -0.30 -0.42 0.00 -2.04 0.00 0.00 64.05 61.68 1rk7 n THR 116 Cb 0.46 -0.50 -0.00 0.00 -1.82 0.00 0.00 70.33 68.48 1rk7 n THR 116 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1rk7 n LEU 117 N 9.06 6.93 -5.01 -4.42 7.99 -1.26 0.85 117.00 131.14 1rk7 n LEU 117 Ca 0.64 -4.25 -0.20 0.00 -0.01 0.00 0.00 56.01 52.20 1rk7 n LEU 117 Cb 0.13 -1.62 0.04 0.00 -0.11 0.00 0.00 43.42 41.86 1rk7 n LEU 117 CO 0.98 1.21 0.25 0.68 -1.51 0.00 0.00 177.39 179.00 1rk7 s VAL 118 N 2.61 2.34 0.01 4.08 -7.23 -1.26 -4.29 120.40 116.66 1rk7 s VAL 118 Ca 0.47 -1.06 -0.04 0.00 -1.81 0.00 0.00 61.98 59.53 1rk7 s VAL 118 Cb 0.13 -2.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.67 1rk7 s VAL 118 CO -0.07 0.00 0.07 0.68 -0.31 0.00 0.00 175.10 175.47 1rk7 s VAL 119 N -2.59 0.09 0.67 1.32 -7.23 -1.26 -3.58 120.40 107.82 1rk7 s VAL 119 Ca 0.57 -0.74 -0.06 0.00 -1.81 0.00 0.00 61.98 59.94 1rk7 s VAL 119 Cb -0.06 -0.35 0.05 0.00 0.56 0.00 0.00 36.38 36.57 1rk7 s VAL 119 CO 0.35 -0.41 0.97 -1.00 -0.31 0.00 0.00 175.10 174.71 1rk7 s HIS 120 N -1.34 3.00 -0.57 2.82 3.76 -1.25 -2.48 115.29 119.22 1rk7 s HIS 120 Ca -0.14 0.47 0.07 0.00 -0.15 0.00 0.00 55.06 55.30 1rk7 s HIS 120 Cb -0.08 -3.05 0.44 0.00 1.11 0.00 0.00 32.58 31.00 1rk7 s HIS 120 CO 0.00 -1.22 1.19 -1.91 -0.85 0.00 0.00 174.74 171.95 1rk7 n GLU 121 N -2.80 3.03 -3.63 1.40 2.13 -1.20 -4.75 120.64 114.81 1rk7 n GLU 121 Ca 0.07 -1.69 -0.03 0.00 0.66 0.00 0.00 57.16 56.17 1rk7 n GLU 121 Cb 0.60 -1.90 -0.03 0.00 0.27 0.00 0.00 31.44 30.38 1rk7 n GLU 121 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1rk7 s LYS 122 N -1.94 0.13 0.67 5.31 2.36 -1.26 -5.01 119.74 120.00 1rk7 s LYS 122 Ca 0.29 -0.02 -0.15 0.00 -2.55 0.00 0.00 55.97 53.55 1rk7 s LYS 122 Cb 0.23 0.06 0.01 0.00 -1.05 0.00 0.00 37.83 37.07 1rk7 s LYS 122 CO 0.08 -0.05 1.11 0.00 1.55 0.00 0.00 175.35 178.05 1rk7 s ALA 123 N -1.67 2.44 0.00 3.13 0.00 -1.19 -2.97 121.76 121.49 1rk7 s ALA 123 Ca 0.09 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.60 1rk7 s ALA 123 Cb -0.01 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1rk7 s ALA 123 CO -0.05 -1.34 0.00 -0.40 0.00 0.00 0.00 175.76 173.97 1rk7 n ASP 124 N -2.49 0.00 0.00 0.00 5.68 -1.26 -4.72 116.55 113.75 1rk7 n ASP 124 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 1rk7 n ASP 124 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1rk7 n ASP 125 N 0.00 0.00 -1.57 -1.12 9.92 -1.26 -4.18 116.55 118.33 1rk7 n ASP 125 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 1rk7 n ASP 125 Cb 0.00 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.43 1rk7 n ASP 125 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1rk7 n LEU 126 N 0.00 -0.99 -4.20 0.64 4.77 -1.26 -4.84 117.00 111.12 1rk7 n LEU 126 Ca 0.00 0.29 -0.44 0.00 -0.03 0.00 0.00 56.01 55.83 1rk7 n LEU 126 Cb 0.00 -2.01 0.00 0.00 -2.33 0.00 0.00 43.42 39.08 1rk7 n LEU 126 CO 0.00 -0.58 0.97 0.61 -1.33 0.00 0.00 177.39 177.06 1rk7 n GLY 127 N -0.35 4.59 0.38 -0.72 0.00 -1.26 -4.81 105.19 103.01 1rk7 n GLY 127 Ca -0.13 -2.59 0.19 0.00 0.00 0.00 0.00 46.02 43.49 1rk7 n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rk7 h LYS 128 N 6.16 0.00 -0.95 1.61 1.79 -1.88 -1.63 116.57 121.67 1rk7 h LYS 128 Ca 0.20 0.00 0.22 0.00 -2.18 0.00 0.00 60.65 58.89 1rk7 h LYS 128 Cb 0.76 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.24 1rk7 h LYS 128 CO 1.17 0.00 -0.11 0.78 -1.08 0.00 0.00 179.45 180.20 1rk7 h GLY 129 N 0.00 0.92 -0.24 3.86 0.00 -1.95 -3.40 103.07 102.25 1rk7 h GLY 129 Ca 0.16 0.23 -0.07 0.00 0.00 0.00 0.00 47.33 47.66 1rk7 h GLY 129 CO -0.00 -0.41 -0.04 0.61 0.00 0.00 0.00 176.54 176.70 1rk7 n GLY 130 N -1.55 -3.01 3.39 4.60 0.00 -0.61 -5.04 105.19 102.97 1rk7 n GLY 130 Ca 0.18 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.01 -0.52 -0.10 1.61 0.01 -1.26 -4.63 114.94 108.05 1rk7 s ASN 131 Ca 0.13 1.00 -0.01 0.00 -0.71 0.00 0.00 52.86 53.27 1rk7 s ASN 131 Cb -0.02 1.01 0.01 0.00 0.41 0.00 0.00 41.25 42.66 1rk7 s ASN 131 CO 0.11 -0.17 0.03 -0.62 -1.51 0.00 0.00 177.10 174.94 1rk7 n GLU 132 N 2.86 -2.70 0.00 -0.60 4.71 -1.26 -4.41 120.64 119.24 1rk7 n GLU 132 Ca -0.14 0.01 0.00 0.00 -0.01 0.00 0.00 57.16 57.02 1rk7 n GLU 132 Cb 0.57 -4.10 0.00 0.00 -1.01 0.00 0.00 31.44 26.90 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1rk7 n GLN 133 N -2.35 0.00 0.01 3.49 -0.06 -1.26 -4.91 117.38 112.30 1rk7 n GLN 133 Ca 0.01 0.00 0.11 0.00 -2.00 0.00 0.00 57.00 55.12 1rk7 n GLN 133 Cb 0.45 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 26.64 1rk7 n GLN 133 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1rk7 n SER 134 N -2.06 0.67 0.00 1.69 3.41 -1.26 -2.30 113.62 113.78 1rk7 n SER 134 Ca 0.00 -0.45 0.14 0.00 -0.26 0.00 0.00 58.87 58.30 1rk7 n SER 134 Cb 0.00 0.82 0.63 0.00 -0.26 0.00 0.00 64.21 65.41 1rk7 n SER 134 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1rk7 n THR 135 N -1.75 0.00 -0.02 6.66 -2.24 -1.26 -3.59 114.28 112.08 1rk7 n THR 135 Ca 0.03 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.79 1rk7 n THR 135 Cb 0.39 -0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 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 -1.48 0.90 0.00 -0.78 2.85 -1.25 -0.69 118.16 117.71 1rk7 n LYS 136 Ca 0.08 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 1rk7 n LYS 136 Cb 0.33 -1.07 0.00 0.00 -0.65 0.00 0.00 35.03 33.64 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 -2.48 0.00 0.00 0.58 -2.24 -1.06 -4.67 114.28 104.41 1rk7 n THR 137 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1rk7 n THR 137 Cb 0.57 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 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 2.94 0.00 2.72 3.38 0.00 -0.97 -4.48 105.19 108.77 1rk7 n GLY 138 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.15 -2.70 1.61 2.85 -1.07 -4.56 115.26 110.24 1rk7 n ASN 139 Ca 0.00 0.31 -0.07 0.00 -0.11 0.00 0.00 54.58 54.71 1rk7 n ASN 139 Cb 0.00 -1.11 0.10 0.00 1.24 0.00 0.00 39.78 40.00 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 -2.66 0.16 -3.40 5.20 0.00 -1.26 -5.02 120.51 113.53 1rk7 n ALA 140 Ca 0.01 -1.17 -0.45 0.00 0.00 0.00 0.00 53.44 51.83 1rk7 n ALA 140 Cb 0.50 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 141 N -1.04 2.72 -0.61 0.00 0.00 -1.26 -4.17 107.32 102.97 1rk7 s GLY 141 Ca 0.19 -3.40 0.05 0.00 0.00 0.00 0.00 44.72 41.57 1rk7 s GLY 141 CO -0.08 1.24 0.52 -1.26 0.00 0.00 0.00 173.10 173.53 1rk7 n SER 142 N 3.69 2.25 -3.68 1.64 2.88 -1.26 -5.00 113.62 114.14 1rk7 n SER 142 Ca 0.14 -3.05 -0.33 0.00 -1.33 0.00 0.00 58.87 54.30 1rk7 n SER 142 Cb 0.44 -0.69 0.02 0.00 -0.75 0.00 0.00 64.21 63.24 1rk7 n SER 142 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1rk7 n ARG 143 N 1.83 0.00 0.00 -1.46 1.74 -1.26 -3.25 116.66 114.25 1rk7 n ARG 143 Ca 0.24 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1rk7 n ARG 143 Cb 0.41 -0.89 0.00 0.00 -1.02 0.00 0.00 32.46 30.95 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 2.70 0.00 -4.85 0.55 4.77 -1.03 -4.85 117.00 114.29 1rk7 n LEU 144 Ca 0.02 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.72 1rk7 n LEU 144 Cb 0.46 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.66 1rk7 n LEU 144 CO 0.48 0.00 0.76 0.00 -1.33 0.00 0.00 177.39 177.30 1rk7 s ALA 145 N -2.00 2.30 -0.48 -1.18 0.00 -1.26 -4.03 121.76 115.10 1rk7 s ALA 145 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 51.96 51.44 1rk7 s ALA 145 Cb 0.00 -2.99 0.24 0.00 0.00 0.00 0.00 23.12 20.37 1rk7 s ALA 145 CO 0.00 -1.91 0.83 0.00 0.00 0.00 0.00 175.76 174.68 1rk7 h GLY 147 N 4.04 -0.67 -2.20 0.00 0.00 -1.79 -3.41 103.07 99.05 1rk7 h GLY 147 Ca -0.11 0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.51 1rk7 h GLY 147 CO 0.34 -0.24 -0.61 -0.62 0.00 0.00 0.00 176.54 175.41 1rk7 n VAL 148 N -5.21 -1.52 -3.17 4.60 0.31 -1.26 -4.49 118.33 107.59 1rk7 n VAL 148 Ca -0.09 0.81 -0.39 0.00 -0.01 0.00 0.00 64.34 64.66 1rk7 n VAL 148 Cb 0.29 -1.34 -0.06 0.00 -0.91 0.00 0.00 33.84 31.82 1rk7 n VAL 148 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1rk7 s ILE 149 N -4.65 4.75 -0.21 2.52 1.09 -1.25 -3.82 121.20 119.63 1rk7 s ILE 149 Ca 0.00 1.35 -0.04 0.00 -1.10 0.00 0.00 60.65 60.86 1rk7 s ILE 149 Cb 0.00 -3.97 0.10 0.00 -1.06 0.00 0.00 42.46 37.53 1rk7 s ILE 149 CO 0.00 0.48 0.28 -0.83 -0.10 0.00 0.00 174.94 174.77 1rk7 s GLY 150 N -0.65 -0.15 0.22 6.18 0.00 0.63 -3.54 107.32 110.00 1rk7 s GLY 150 Ca 0.32 0.57 -0.25 0.00 0.00 0.00 0.00 44.72 45.36 1rk7 s GLY 150 CO 0.20 2.31 0.40 1.39 0.00 0.00 0.00 173.10 177.39 1rk7 n ILE 151 N 5.34 1.59 -3.99 0.90 2.08 -1.26 -2.30 119.36 121.72 1rk7 n ILE 151 Ca -0.05 -0.46 -0.09 0.00 0.56 0.00 0.00 62.75 62.71 1rk7 n ILE 151 Cb 0.50 0.00 -0.08 0.00 -0.75 0.00 0.00 39.64 39.30 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 -1.05 0.20 -2.08 -1.39 0.00 -0.35 -4.80 121.76 112.29 1rk7 s ALA 152 Ca 0.58 -0.98 0.31 0.00 0.00 0.00 0.00 51.96 51.88 1rk7 s ALA 152 Cb -0.80 0.58 1.77 0.00 0.00 0.00 0.00 23.12 24.67 1rk7 s ALA 152 CO 0.53 -0.50 2.15 0.00 0.00 0.00 0.00 175.76 177.94