#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rk7 n THR 2 N 0.00 3.80 -2.75 0.00 -1.04 -1.22 -4.87 114.28 108.20 1rk7 n THR 2 Ca 0.00 -3.59 -0.42 0.00 -2.04 0.00 0.00 64.05 58.00 1rk7 n THR 2 Cb 0.00 -2.51 -0.03 0.00 -1.82 0.00 0.00 70.33 65.97 1rk7 n THR 2 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1rk7 s LYS 3 N 2.25 3.25 0.41 -2.82 2.36 -1.22 -3.48 119.74 120.49 1rk7 s LYS 3 Ca 0.45 -0.83 -0.13 0.00 -2.55 0.00 0.00 55.97 52.91 1rk7 s LYS 3 Cb 0.12 -4.44 -0.07 0.00 -1.05 0.00 0.00 37.83 32.39 1rk7 s LYS 3 CO -0.05 -1.95 0.81 0.00 1.55 0.00 0.00 175.35 175.71 1rk7 s ALA 4 N 4.45 3.29 0.11 3.13 0.00 0.42 -1.70 121.76 131.45 1rk7 s ALA 4 Ca 0.30 -0.08 0.08 0.00 0.00 0.00 0.00 51.96 52.26 1rk7 s ALA 4 Cb -0.11 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 1rk7 s ALA 4 CO 0.07 0.01 -0.19 0.08 0.00 0.00 0.00 175.76 175.72 1rk7 s VAL 5 N -2.35 1.63 -0.41 0.00 1.01 0.24 0.19 120.40 120.71 1rk7 s VAL 5 Ca 0.53 -1.57 0.06 0.00 0.00 0.00 0.00 61.98 61.01 1rk7 s VAL 5 Cb -0.10 -1.53 0.17 0.00 0.00 0.00 0.00 36.38 34.92 1rk7 s VAL 5 CO 0.29 -0.13 0.57 0.00 0.00 0.00 0.00 175.10 175.82 1rk7 s ALA 6 N -1.34 -1.73 -0.73 5.51 0.00 0.28 -0.27 121.76 123.49 1rk7 s ALA 6 Ca 0.07 -0.25 -0.26 0.00 0.00 0.00 0.00 51.96 51.52 1rk7 s ALA 6 Cb -0.09 -2.52 0.04 0.00 0.00 0.00 0.00 23.12 20.54 1rk7 s ALA 6 CO 0.04 -2.20 1.21 0.54 0.00 0.00 0.00 175.76 175.36 1rk7 s VAL 7 N 1.58 3.86 0.24 0.00 0.11 -1.26 -1.23 120.40 123.69 1rk7 s VAL 7 Ca 0.18 0.21 -0.29 0.00 -2.93 0.00 0.00 61.98 59.15 1rk7 s VAL 7 Cb -0.06 -4.87 -0.15 0.00 -1.53 0.00 0.00 36.38 29.76 1rk7 s VAL 7 CO -0.06 -1.77 0.90 0.18 -3.33 0.00 0.00 175.10 171.02 1rk7 n LEU 8 N 8.99 0.85 -3.22 2.54 7.99 0.14 -4.64 117.00 129.65 1rk7 n LEU 8 Ca 0.02 1.16 0.04 0.00 -0.01 0.00 0.00 56.01 57.22 1rk7 n LEU 8 Cb 0.48 -1.17 -0.02 0.00 -0.11 0.00 0.00 43.42 42.60 1rk7 n LEU 8 CO 0.69 -1.84 0.51 -0.75 -1.51 0.00 0.00 177.39 174.49 1rk7 s LYS 9 N -1.17 0.29 0.00 3.23 2.20 -1.26 -3.84 119.74 119.20 1rk7 s LYS 9 Ca 0.63 0.58 0.00 0.00 -0.36 0.00 0.00 55.97 56.83 1rk7 s LYS 9 Cb -0.80 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 35.85 1rk7 s LYS 9 CO 0.57 -0.26 0.00 0.41 -0.36 0.00 0.00 175.35 175.72 1rk7 n GLY 10 N 5.33 0.53 0.15 5.54 0.00 -1.26 -2.80 105.19 112.68 1rk7 n GLY 10 Ca -0.06 0.31 -0.04 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.76 0.00 1.61 3.58 -1.89 -3.46 116.42 115.50 1rk7 h ASP 11 Ca 0.00 0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.57 1rk7 h ASP 11 Cb 0.00 0.34 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1rk7 h ASP 11 CO 0.00 -0.08 0.00 0.61 -2.88 0.00 0.00 179.24 176.89 1rk7 n GLY 12 N -1.09 -0.03 2.29 -0.78 0.00 -1.26 -5.00 105.19 99.32 1rk7 n GLY 12 Ca 0.01 0.24 -0.18 0.00 0.00 0.00 0.00 46.02 46.08 1rk7 n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 13 N 0.00 2.10 -3.15 1.61 -0.04 -1.26 -4.50 135.00 129.76 1rk7 n PRO 13 Ca 0.00 -1.23 0.05 0.00 -0.04 0.00 0.00 63.50 62.29 1rk7 n PRO 13 Cb 0.00 -2.21 -0.02 0.00 -0.04 0.00 0.00 33.50 31.23 1rk7 n PRO 13 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1rk7 s VAL 14 N 2.14 -0.33 -0.35 0.52 0.11 -1.25 -3.56 120.40 117.69 1rk7 s VAL 14 Ca 0.51 0.00 0.14 0.00 -2.93 0.00 0.00 61.98 59.70 1rk7 s VAL 14 Cb 0.19 -0.94 0.45 0.00 -1.53 0.00 0.00 36.38 34.55 1rk7 s VAL 14 CO -0.02 0.00 1.04 1.67 -3.33 0.00 0.00 175.10 174.46 1rk7 n GLN 15 N 5.45 2.12 -0.70 1.54 7.27 -0.94 -4.01 117.38 128.11 1rk7 n GLN 15 Ca -0.06 -3.75 -0.33 0.00 0.07 0.00 0.00 57.00 52.94 1rk7 n GLN 15 Cb 0.54 -1.68 0.16 0.00 2.41 0.00 0.00 30.24 31.67 1rk7 n GLN 15 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1rk7 n GLY 16 N -0.30 -2.50 2.60 1.69 0.00 -1.25 -4.50 105.19 100.92 1rk7 n GLY 16 Ca 0.21 -0.75 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.23 -0.15 -0.12 -0.61 1.01 0.29 0.25 121.20 119.64 1rk7 s ILE 17 Ca 0.55 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1rk7 s ILE 17 Cb -0.11 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.35 1rk7 s ILE 17 CO 0.66 -0.68 -0.04 -0.51 0.00 0.00 0.00 174.94 174.37 1rk7 s ILE 18 N 2.06 3.88 0.02 2.92 1.10 -0.37 -1.91 121.20 128.91 1rk7 s ILE 18 Ca 0.10 -0.38 0.04 0.00 -0.51 0.00 0.00 60.65 59.90 1rk7 s ILE 18 Cb -0.16 -2.66 -0.02 0.00 0.15 0.00 0.00 42.46 39.77 1rk7 s ILE 18 CO -0.32 0.54 -0.13 0.20 -2.11 0.00 0.00 174.94 173.12 1rk7 s ASN 19 N -0.09 1.47 -0.32 4.50 0.01 -0.03 0.10 114.94 120.58 1rk7 s ASN 19 Ca 0.02 -0.38 -0.02 0.00 -0.71 0.00 0.00 52.86 51.77 1rk7 s ASN 19 Cb -0.13 -0.11 0.06 0.00 0.41 0.00 0.00 41.25 41.49 1rk7 s ASN 19 CO 0.03 0.04 0.04 -0.36 -1.51 0.00 0.00 177.10 175.34 1rk7 s PHE 20 N -0.71 3.34 0.08 2.20 0.40 0.13 -2.22 117.98 121.20 1rk7 s PHE 20 Ca 0.01 -1.98 0.00 0.00 -0.60 0.00 0.00 56.93 54.37 1rk7 s PHE 20 Cb -0.07 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 41.08 1rk7 s PHE 20 CO 0.01 -0.83 0.22 -2.00 0.70 0.00 0.00 175.22 173.32 1rk7 s GLU 21 N 1.23 3.44 -0.44 0.44 2.12 -0.40 0.16 118.70 125.25 1rk7 s GLU 21 Ca -0.02 -0.47 0.05 0.00 0.36 0.00 0.00 54.97 54.89 1rk7 s GLU 21 Cb -0.20 -3.03 0.17 0.00 0.26 0.00 0.00 34.13 31.34 1rk7 s GLU 21 CO -0.02 0.59 0.51 -1.14 -0.54 0.00 0.00 175.26 174.67 1rk7 s GLN 22 N -2.65 0.89 -1.02 4.30 0.74 -1.23 0.15 119.66 120.84 1rk7 s GLN 22 Ca 0.35 -1.27 -0.07 0.00 0.05 0.00 0.00 55.36 54.42 1rk7 s GLN 22 Cb -0.13 -0.62 -0.10 0.00 1.10 0.00 0.00 33.01 33.27 1rk7 s GLN 22 CO 0.28 -1.30 2.63 1.63 -0.55 0.00 0.00 175.29 177.98 1rk7 n LYS 23 N 3.36 2.65 0.00 1.67 5.02 -1.26 0.20 118.16 129.80 1rk7 n LYS 23 Ca 0.19 -1.63 0.00 0.00 -2.02 0.00 0.00 58.31 54.86 1rk7 n LYS 23 Cb 0.51 -2.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.04 1rk7 n LYS 23 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1rk7 n GLU 24 N 3.63 0.00 0.00 1.97 4.71 -1.26 -4.81 120.64 124.87 1rk7 n GLU 24 Ca 0.56 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.71 1rk7 n GLU 24 Cb 0.29 -0.03 0.00 0.00 -1.01 0.00 0.00 31.44 30.69 1rk7 n GLU 24 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1rk7 n SER 25 N -2.21 0.00 -0.80 1.62 2.88 -1.15 -4.54 113.62 109.42 1rk7 n SER 25 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 1rk7 n SER 25 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1rk7 n SER 25 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1rk7 n ASN 26 N 0.00 -0.40 0.00 -3.46 2.85 -1.26 -4.94 115.26 108.05 1rk7 n ASN 26 Ca 0.00 -1.59 0.00 0.00 -0.11 0.00 0.00 54.58 52.88 1rk7 n ASN 26 Cb 0.00 0.11 0.00 0.00 1.24 0.00 0.00 39.78 41.13 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rk7 n GLY 27 N 0.03 5.26 3.80 8.20 0.00 -1.26 -5.13 105.19 116.09 1rk7 n GLY 27 Ca -0.13 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 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 3.72 3.56 -0.30 1.61 0.04 -1.26 -4.76 135.00 137.62 1rk7 s PRO 28 Ca 0.00 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 1rk7 s PRO 28 Cb 0.00 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.53 1rk7 s PRO 28 CO 0.00 -0.62 -0.01 0.08 0.04 0.00 0.00 177.00 176.49 1rk7 s VAL 29 N -2.28 2.92 -0.74 -0.36 1.01 0.17 -4.44 120.40 116.68 1rk7 s VAL 29 Ca 0.65 -1.41 -0.26 0.00 0.00 0.00 0.00 61.98 60.95 1rk7 s VAL 29 Cb -0.16 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1rk7 s VAL 29 CO 0.30 -0.10 1.63 -0.54 0.00 0.00 0.00 175.10 176.39 1rk7 s LYS 30 N 1.24 2.91 -0.15 2.72 1.02 0.39 -3.83 119.74 124.04 1rk7 s LYS 30 Ca -0.05 0.02 -0.14 0.00 0.02 0.00 0.00 55.97 55.81 1rk7 s LYS 30 Cb -0.20 -4.51 -0.05 0.00 -0.52 0.00 0.00 37.83 32.55 1rk7 s LYS 30 CO -0.01 -2.57 0.32 0.08 -0.92 0.00 0.00 175.35 172.25 1rk7 s VAL 31 N 7.65 5.29 -0.03 3.17 1.01 0.36 -1.27 120.40 136.58 1rk7 s VAL 31 Ca 0.54 0.61 -0.28 0.00 0.00 0.00 0.00 61.98 62.85 1rk7 s VAL 31 Cb -0.09 -3.66 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1rk7 s VAL 31 CO 0.13 0.38 0.61 -1.66 0.00 0.00 0.00 175.10 174.56 1rk7 s TRP 32 N 0.46 -0.57 0.26 5.22 -2.14 -0.94 -0.15 118.94 121.07 1rk7 s TRP 32 Ca 0.18 0.94 -0.10 0.00 2.66 0.00 0.00 56.10 59.78 1rk7 s TRP 32 Cb -0.13 0.36 0.04 0.00 -3.10 0.00 0.00 33.47 30.64 1rk7 s TRP 32 CO 0.05 -0.58 0.51 0.41 -2.66 0.00 0.00 176.95 174.67 1rk7 n GLY 33 N 0.90 1.35 3.43 3.67 0.00 -0.94 -0.85 105.19 112.75 1rk7 n GLY 33 Ca -0.19 -1.17 -0.04 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.34 -0.72 0.60 1.61 1.04 -0.80 -1.67 113.70 111.41 1rk7 s SER 34 Ca 0.10 1.23 -0.05 0.00 0.48 0.00 0.00 55.95 57.71 1rk7 s SER 34 Cb -0.03 1.84 0.02 0.00 0.10 0.00 0.00 66.02 67.95 1rk7 s SER 34 CO 0.08 -0.23 0.90 -0.63 0.98 0.00 0.00 173.24 174.34 1rk7 s ILE 35 N 2.76 3.29 -0.30 -1.02 1.01 0.20 -0.55 121.20 126.59 1rk7 s ILE 35 Ca -0.02 -0.15 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 1rk7 s ILE 35 Cb -0.12 -3.32 0.18 0.00 0.01 0.00 0.00 42.46 39.21 1rk7 s ILE 35 CO -0.16 -0.31 0.68 -1.59 0.00 0.00 0.00 174.94 173.55 1rk7 s LYS 36 N -5.00 0.52 0.00 2.79 -2.85 -1.26 -3.26 119.74 110.67 1rk7 s LYS 36 Ca 0.55 1.00 0.00 0.00 -1.00 0.00 0.00 55.97 56.52 1rk7 s LYS 36 Cb -0.11 0.57 0.00 0.00 -2.06 0.00 0.00 37.83 36.23 1rk7 s LYS 36 CO 0.44 -0.48 0.00 0.41 0.10 0.00 0.00 175.35 175.82 1rk7 n GLY 37 N 5.42 3.22 0.00 0.59 0.00 -1.25 -2.21 105.19 110.97 1rk7 n GLY 37 Ca -0.04 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1rk7 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rk7 n LEU 38 N 0.00 0.00 -4.21 0.99 4.77 -1.23 -4.81 117.00 112.51 1rk7 n LEU 38 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 1rk7 n LEU 38 Cb 0.00 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 40.92 1rk7 n LEU 38 CO 0.00 -1.32 -0.55 0.42 -1.33 0.00 0.00 177.39 174.61 1rk7 s THR 39 N -0.68 1.91 0.11 -5.08 -4.23 -1.26 -3.43 115.64 102.97 1rk7 s THR 39 Ca 0.00 -0.95 -0.35 0.00 -1.18 0.00 0.00 61.69 59.20 1rk7 s THR 39 Cb 0.00 -1.64 -0.17 0.00 1.34 0.00 0.00 72.50 72.03 1rk7 s THR 39 CO 0.00 0.53 1.20 -1.84 -0.54 0.00 0.00 174.62 173.97 1rk7 n GLU 40 N 3.31 0.93 0.00 3.99 0.28 -1.26 -4.45 120.64 123.43 1rk7 n GLU 40 Ca -0.19 0.33 0.00 0.00 -0.16 0.00 0.00 57.16 57.15 1rk7 n GLU 40 Cb 0.53 -1.87 0.00 0.00 1.43 0.00 0.00 31.44 31.52 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 2.15 0.54 3.91 -1.84 0.00 -1.26 -4.91 105.19 103.77 1rk7 n GLY 41 Ca 0.17 -1.57 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 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 4.26 0.22 0.99 2.01 -1.26 -1.18 118.68 123.72 1rk7 s LEU 42 Ca 0.00 0.51 -0.17 0.00 0.01 0.00 0.00 54.13 54.48 1rk7 s LEU 42 Cb 0.00 -3.24 0.02 0.00 0.01 0.00 0.00 46.19 42.97 1rk7 s LEU 42 CO 0.00 0.03 0.54 -1.00 1.01 0.00 0.00 176.35 176.93 1rk7 s HIS 43 N -1.71 0.00 0.05 0.29 3.76 -1.23 -3.76 115.29 112.69 1rk7 s HIS 43 Ca 0.40 -0.37 0.09 0.00 -0.15 0.00 0.00 55.06 55.03 1rk7 s HIS 43 Cb -0.12 0.39 -0.03 0.00 1.11 0.00 0.00 32.58 33.93 1rk7 s HIS 43 CO 0.26 -0.99 -0.24 0.20 -0.85 0.00 0.00 174.74 173.12 1rk7 s GLY 44 N -2.92 1.46 -0.22 -2.22 0.00 -0.39 -2.93 107.32 100.10 1rk7 s GLY 44 Ca 0.13 -1.27 -0.17 0.00 0.00 0.00 0.00 44.72 43.41 1rk7 s GLY 44 CO 0.02 -1.16 0.57 -1.36 0.00 0.00 0.00 173.10 171.16 1rk7 s PHE 45 N -0.85 -0.70 -0.06 1.90 0.40 -1.26 0.06 117.98 117.47 1rk7 s PHE 45 Ca 0.13 1.60 -0.30 0.00 -0.60 0.00 0.00 56.93 57.75 1rk7 s PHE 45 Cb -0.10 0.30 0.11 0.00 0.51 0.00 0.00 43.02 43.84 1rk7 s PHE 45 CO 0.03 -0.35 1.35 -3.38 0.70 0.00 0.00 175.22 173.57 1rk7 s HIS 46 N 0.71 0.00 1.06 0.36 -3.43 -1.01 -4.60 115.29 108.39 1rk7 s HIS 46 Ca -0.03 -0.06 -0.13 0.00 -0.80 0.00 0.00 55.06 54.04 1rk7 s HIS 46 Cb -0.05 0.53 0.17 0.00 -1.43 0.00 0.00 32.58 31.80 1rk7 s HIS 46 CO -0.05 -0.13 0.75 0.28 -2.00 0.00 0.00 174.74 173.59 1rk7 n VAL 47 N -0.79 0.00 -3.52 -5.38 0.31 -1.19 -0.91 118.33 106.86 1rk7 n VAL 47 Ca -0.00 -0.26 -0.09 0.00 -0.01 0.00 0.00 64.34 63.98 1rk7 n VAL 47 Cb 0.60 -0.86 -0.03 0.00 -0.91 0.00 0.00 33.84 32.65 1rk7 n VAL 47 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1rk7 s HIS 48 N -2.43 -0.37 0.14 3.52 5.04 -1.19 -4.77 115.29 115.23 1rk7 s HIS 48 Ca 0.64 0.35 -0.15 0.00 -1.54 0.00 0.00 55.06 54.36 1rk7 s HIS 48 Cb -0.21 0.51 0.03 0.00 0.04 0.00 0.00 32.58 32.94 1rk7 s HIS 48 CO 0.64 -0.50 0.40 -1.21 -2.34 0.00 0.00 174.74 171.72 1rk7 s GLU 49 N -2.58 1.12 0.02 2.88 2.02 -1.26 -4.68 118.70 116.21 1rk7 s GLU 49 Ca 0.03 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.22 1rk7 s GLU 49 Cb -0.01 0.46 0.00 0.00 0.10 0.00 0.00 34.13 34.68 1rk7 s GLU 49 CO -0.06 -0.44 0.00 -1.91 0.02 0.00 0.00 175.26 172.88 1rk7 n GLU 50 N -0.23 0.00 0.00 1.61 2.13 -1.26 -4.89 120.64 118.00 1rk7 n GLU 50 Ca -0.14 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.68 1rk7 n GLU 50 Cb 0.63 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.34 1rk7 n GLU 50 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1rk7 n GLU 51 N -0.80 0.00 -3.37 5.31 4.07 -1.26 -4.79 120.64 119.79 1rk7 n GLU 51 Ca 0.00 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.88 1rk7 n GLU 51 Cb 0.00 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.40 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1rk7 n ASP 52 N 3.14 -5.96 0.00 4.31 9.92 -1.26 -4.95 116.55 121.76 1rk7 n ASP 52 Ca 0.00 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1rk7 n ASP 52 Cb 0.00 -1.60 0.00 0.00 -0.64 0.00 0.00 41.12 38.88 1rk7 n ASP 52 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1rk7 n ASN 53 N 0.47 0.00 0.00 -2.24 3.02 -1.26 -5.05 115.26 110.20 1rk7 n ASN 53 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 1rk7 n ASN 53 Cb 0.60 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.77 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 -5.03 114.28 117.06 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 -0.16 0.00 0.00 -1.55 0.00 0.00 70.33 68.62 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 -2.35 0.00 -2.87 1.79 0.00 -1.26 -4.79 120.51 111.03 1rk7 n ALA 55 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1rk7 n ALA 55 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 5.73 2.79 0.00 0.00 -1.26 -4.94 105.19 107.52 1rk7 n GLY 56 Ca 0.00 -2.72 -0.17 0.00 0.00 0.00 0.00 46.02 43.13 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 5.33 0.00 0.05 0.00 -2.24 -1.26 -4.36 114.28 111.79 1rk7 n THR 58 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1rk7 n THR 58 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1rk7 n THR 58 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1rk7 n SER 59 N 0.00 0.16 0.00 3.42 2.88 -1.26 -4.08 113.62 114.74 1rk7 n SER 59 Ca 0.00 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1rk7 n SER 59 Cb 0.00 0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1rk7 n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rk7 n ALA 60 N -2.95 0.00 -3.33 -1.46 0.00 -1.26 -4.41 120.51 107.10 1rk7 n ALA 60 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1rk7 n ALA 60 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1rk7 n ALA 60 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 61 N 0.00 -0.47 -0.98 0.00 0.00 -1.26 -5.04 107.32 99.58 1rk7 s GLY 61 Ca 0.00 0.95 -0.07 0.00 0.00 0.00 0.00 44.72 45.60 1rk7 s GLY 61 CO 0.00 2.74 2.55 -1.55 0.00 0.00 0.00 173.10 176.84 1rk7 n PRO 62 N 5.37 2.52 -3.73 2.90 -0.04 -1.26 -4.63 135.00 136.13 1rk7 n PRO 62 Ca -0.03 -1.57 -0.28 0.00 -0.04 0.00 0.00 63.50 61.58 1rk7 n PRO 62 Cb 0.50 -2.45 -0.11 0.00 -0.04 0.00 0.00 33.50 31.40 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 3.67 2.86 0.00 0.54 1.44 -1.26 -4.98 115.22 117.49 1rk7 n HIS 63 Ca 0.54 -4.17 0.00 0.00 -2.01 0.00 0.00 57.72 52.08 1rk7 n HIS 63 Cb 0.28 -0.52 0.00 0.00 0.12 0.00 0.00 29.99 29.86 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 1.77 0.00 -3.27 -1.40 3.72 -1.26 -4.70 117.46 112.32 1rk7 n PHE 64 Ca 0.23 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.57 1rk7 n PHE 64 Cb 0.38 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.88 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 -2.93 -0.42 -1.11 4.37 4.22 -1.26 -4.92 114.94 112.89 1rk7 s ASN 65 Ca 0.00 -1.01 -0.22 0.00 -2.14 0.00 0.00 52.86 49.49 1rk7 s ASN 65 Cb 0.00 1.39 -0.00 0.00 1.28 0.00 0.00 41.25 43.92 1rk7 s ASN 65 CO 0.00 -0.22 1.77 -2.16 -2.04 0.00 0.00 177.10 174.45 1rk7 s PRO 66 N 1.78 3.17 0.01 3.55 0.04 -1.26 -3.34 135.00 138.94 1rk7 s PRO 66 Ca 0.16 -1.18 0.00 0.00 0.04 0.00 0.00 61.00 60.02 1rk7 s PRO 66 Cb -0.09 -5.31 0.00 0.00 0.04 0.00 0.00 34.50 29.14 1rk7 s PRO 66 CO -0.08 -2.95 0.00 -0.11 0.04 0.00 0.00 177.00 173.90 1rk7 n LEU 67 N 11.36 -0.05 -0.68 -3.56 -0.00 -1.26 -4.97 117.00 117.84 1rk7 n LEU 67 Ca 0.42 0.01 -0.01 0.00 -0.00 0.00 0.00 56.01 56.43 1rk7 n LEU 67 Cb 0.48 0.44 -0.01 0.00 -0.00 0.00 0.00 43.42 44.32 1rk7 n LEU 67 CO 0.68 -0.49 0.25 -0.24 -0.00 0.00 0.00 177.39 177.59 1rk7 n SER 68 N -2.51 -0.08 -3.17 1.96 2.88 -1.25 -4.99 113.62 106.46 1rk7 n SER 68 Ca 0.00 -1.52 -0.24 0.00 -1.33 0.00 0.00 58.87 55.78 1rk7 n SER 68 Cb 0.00 -0.03 -0.02 0.00 -0.75 0.00 0.00 64.21 63.41 1rk7 n SER 68 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1rk7 n ARG 69 N 0.05 2.29 -3.62 -1.46 1.85 -1.21 0.82 116.66 115.36 1rk7 n ARG 69 Ca -0.04 -1.54 -0.01 0.00 -1.00 0.00 0.00 57.85 55.26 1rk7 n ARG 69 Cb 0.64 -2.48 -0.02 0.00 -1.05 0.00 0.00 32.46 29.56 1rk7 n ARG 69 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1rk7 s LYS 70 N 3.21 0.05 -0.57 2.89 1.02 -1.26 -4.69 119.74 120.38 1rk7 s LYS 70 Ca 0.44 -0.02 -0.25 0.00 0.02 0.00 0.00 55.97 56.16 1rk7 s LYS 70 Cb 0.11 0.02 -0.15 0.00 -0.52 0.00 0.00 37.83 37.30 1rk7 s LYS 70 CO -0.04 -0.02 1.74 -2.39 -0.92 0.00 0.00 175.35 173.72 1rk7 n HIS 71 N -0.12 0.54 0.00 3.18 1.44 0.15 -3.49 115.22 116.92 1rk7 n HIS 71 Ca 0.02 0.36 0.00 0.00 -2.01 0.00 0.00 57.72 56.09 1rk7 n HIS 71 Cb 0.58 -1.63 0.00 0.00 0.12 0.00 0.00 29.99 29.06 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 4.77 1.66 0.00 -1.39 0.00 -1.26 -4.84 105.19 104.13 1rk7 n GLY 72 Ca 0.43 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.55 0.47 3.31 -0.02 0.00 -1.26 0.12 105.19 107.26 1rk7 n GLY 73 Ca 0.00 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 1rk7 n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 74 N 0.00 2.32 -1.05 1.61 -0.04 -1.26 -3.20 135.00 133.37 1rk7 n PRO 74 Ca 0.00 -2.61 0.00 0.00 -0.04 0.00 0.00 63.50 60.85 1rk7 n PRO 74 Cb 0.00 -3.40 0.00 0.00 -0.04 0.00 0.00 33.50 30.06 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 7.61 0.00 -2.15 0.54 2.85 -1.26 -4.49 118.16 121.26 1rk7 n LYS 75 Ca 0.49 0.18 -0.02 0.00 -1.05 0.00 0.00 58.31 57.91 1rk7 n LYS 75 Cb 0.44 -2.65 0.00 0.00 -0.65 0.00 0.00 35.03 32.17 1rk7 n LYS 75 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1rk7 n ASP 76 N 1.41 -5.05 -0.00 -5.58 8.00 -1.19 -4.08 116.55 110.06 1rk7 n ASP 76 Ca 0.00 0.53 0.02 0.00 0.71 0.00 0.00 54.79 56.05 1rk7 n ASP 76 Cb 0.17 -3.22 -0.03 0.00 -0.02 0.00 0.00 41.12 38.03 1rk7 n ASP 76 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1rk7 n GLU 77 N 0.02 3.33 -1.58 -1.24 2.13 0.11 -3.60 120.64 119.82 1rk7 n GLU 77 Ca 0.03 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1rk7 n GLU 77 Cb 0.10 -0.86 0.00 0.00 0.27 0.00 0.00 31.44 30.96 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 -1.32 -4.32 -2.62 5.31 2.13 0.12 -4.64 120.64 115.29 1rk7 n GLU 78 Ca 0.00 3.29 -0.04 0.00 0.66 0.00 0.00 57.16 61.07 1rk7 n GLU 78 Cb 0.08 -3.93 0.01 0.00 0.27 0.00 0.00 31.44 27.87 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1rk7 n ARG 79 N -1.85 -1.59 0.00 5.31 1.74 0.24 -4.78 116.66 115.72 1rk7 n ARG 79 Ca 0.00 1.61 0.10 0.00 -0.77 0.00 0.00 57.85 58.80 1rk7 n ARG 79 Cb 0.27 -4.83 -0.00 0.00 -1.02 0.00 0.00 32.46 26.88 1rk7 n ARG 79 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1rk7 n HIS 80 N -0.78 0.00 0.00 -1.55 -0.00 -1.24 -3.88 115.22 107.77 1rk7 n HIS 80 Ca 0.06 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.24 1rk7 n HIS 80 Cb 0.41 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.28 1rk7 n HIS 80 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 1rk7 n VAL 81 N -0.00 0.00 -0.20 3.57 0.31 -1.26 -4.72 118.33 116.03 1rk7 n VAL 81 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1rk7 n VAL 81 Cb 0.44 -0.94 0.09 0.00 -0.91 0.00 0.00 33.84 32.53 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 0.61 -5.98 2.92 0.00 -1.89 -3.37 103.07 95.35 1rk7 h GLY 82 Ca 0.00 0.09 -0.59 0.00 0.00 0.00 0.00 47.33 46.83 1rk7 h GLY 82 CO 0.00 -0.20 0.02 -0.35 0.00 0.00 0.00 176.54 176.01 1rk7 s ASP 83 N -5.24 6.65 0.07 0.19 2.15 -1.25 -4.39 116.67 114.85 1rk7 s ASP 83 Ca -0.14 0.78 0.16 0.00 0.43 0.00 0.00 52.55 53.79 1rk7 s ASP 83 Cb 0.18 -2.32 -0.13 0.00 -0.30 0.00 0.00 42.92 40.36 1rk7 s ASP 83 CO 0.73 -0.19 0.87 0.25 -0.17 0.00 0.00 175.17 176.66 1rk7 h LEU 84 N 7.84 0.00 0.00 -1.34 6.46 -1.81 -3.36 115.31 123.10 1rk7 h LEU 84 Ca -0.34 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.42 1rk7 h LEU 84 Cb 1.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 1rk7 h LEU 84 CO 0.76 0.61 0.00 0.61 -0.62 0.00 0.00 178.44 179.80 1rk7 n GLY 85 N 1.39 -1.22 3.93 3.75 0.00 -1.26 -5.08 105.19 106.70 1rk7 n GLY 85 Ca -0.09 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.40 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 6.37 0.27 1.61 -0.87 -1.26 -4.62 114.94 112.45 1rk7 s ASN 86 Ca 0.00 0.52 0.00 0.00 -1.57 0.00 0.00 52.86 51.81 1rk7 s ASN 86 Cb 0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 41.25 39.17 1rk7 s ASN 86 CO 0.00 -0.18 0.02 1.33 -2.57 0.00 0.00 177.10 175.70 1rk7 n VAL 87 N -1.16 0.00 -4.04 1.60 0.24 -1.15 -4.97 118.33 108.85 1rk7 n VAL 87 Ca -0.04 -1.26 -0.19 0.00 -2.04 0.00 0.00 64.34 60.81 1rk7 n VAL 87 Cb 0.55 0.20 -0.16 0.00 -1.47 0.00 0.00 33.84 32.96 1rk7 n VAL 87 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1rk7 s THR 88 N -1.92 0.37 0.80 3.34 2.01 -1.26 -3.50 115.64 115.47 1rk7 s THR 88 Ca 0.02 -0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.91 1rk7 s THR 88 Cb -0.00 -0.43 0.12 0.00 0.01 0.00 0.00 72.50 72.19 1rk7 s THR 88 CO 0.01 0.19 1.12 0.00 -0.69 0.00 0.00 174.62 175.25 1rk7 s ALA 89 N 1.02 2.94 0.00 7.40 0.00 -0.32 -4.61 121.76 128.19 1rk7 s ALA 89 Ca -0.10 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.73 1rk7 s ALA 89 Cb -0.14 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.41 1rk7 s ALA 89 CO -0.01 -1.71 0.00 -3.47 0.00 0.00 0.00 175.76 170.57 1rk7 n ASP 90 N -3.20 0.00 0.00 0.00 2.03 -0.52 -4.39 116.55 110.47 1rk7 n ASP 90 Ca 0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.43 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 0.29 -1.92 0.00 0.00 177.20 175.57 1rk7 n LYS 91 N 0.00 0.39 -0.28 -0.67 5.02 -1.26 -4.69 118.16 116.67 1rk7 n LYS 91 Ca 0.00 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.76 1rk7 n LYS 91 Cb 0.00 -0.61 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 1rk7 n LYS 91 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1rk7 n ASP 92 N -0.08 0.00 0.00 4.39 2.03 -1.26 -4.72 116.55 116.92 1rk7 n ASP 92 Ca 0.00 -1.49 0.00 0.00 0.52 0.00 0.00 54.79 53.82 1rk7 n ASP 92 Cb 0.36 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 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 0.00 2.83 3.35 0.27 0.00 -1.22 -3.78 105.19 106.63 1rk7 n GLY 93 Ca 0.00 -0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.48 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 0.04 -4.34 1.61 0.31 -1.25 -4.32 118.33 110.38 1rk7 n VAL 94 Ca 0.00 -0.08 -0.34 0.00 -0.01 0.00 0.00 64.34 63.91 1rk7 n VAL 94 Cb 0.00 -0.81 -0.15 0.00 -0.91 0.00 0.00 33.84 31.97 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 7.02 2.61 0.11 3.52 0.00 -1.20 -1.44 121.76 132.37 1rk7 s ALA 95 Ca 1.20 -1.07 0.06 0.00 0.00 0.00 0.00 51.96 52.15 1rk7 s ALA 95 Cb -1.28 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 1rk7 s ALA 95 CO 0.58 -0.13 -0.05 0.34 0.00 0.00 0.00 175.76 176.51 1rk7 s ASP 96 N 0.97 4.71 0.16 0.00 -1.08 -1.26 0.63 116.67 120.79 1rk7 s ASP 96 Ca -0.02 -0.30 0.05 0.00 -0.52 0.00 0.00 52.55 51.76 1rk7 s ASP 96 Cb -0.15 -1.01 -0.04 0.00 -1.46 0.00 0.00 42.92 40.26 1rk7 s ASP 96 CO -0.01 0.16 -0.11 -0.69 0.52 0.00 0.00 175.17 175.04 1rk7 s VAL 97 N -1.33 1.28 -0.31 1.11 1.01 -0.67 -4.92 120.40 116.57 1rk7 s VAL 97 Ca 0.24 -2.09 0.01 0.00 0.00 0.00 0.00 61.98 60.15 1rk7 s VAL 97 Cb -0.11 -1.88 0.19 0.00 0.00 0.00 0.00 36.38 34.58 1rk7 s VAL 97 CO 0.16 -0.71 0.73 -0.55 0.00 0.00 0.00 175.10 174.73 1rk7 s SER 98 N -3.19 -1.26 0.04 3.32 0.15 -1.24 -2.20 113.70 109.32 1rk7 s SER 98 Ca 0.18 0.03 0.05 0.00 0.70 0.00 0.00 55.95 56.90 1rk7 s SER 98 Cb 0.02 1.76 -0.02 0.00 -1.71 0.00 0.00 66.02 66.07 1rk7 s SER 98 CO 0.02 -0.22 -0.14 -0.63 1.20 0.00 0.00 173.24 173.47 1rk7 s ILE 99 N 2.71 1.09 -0.36 6.45 1.01 0.79 -5.00 121.20 127.89 1rk7 s ILE 99 Ca 0.15 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.81 1rk7 s ILE 99 Cb -0.07 -0.99 0.11 0.00 0.01 0.00 0.00 42.46 41.53 1rk7 s ILE 99 CO -0.23 -0.01 0.15 -0.70 0.00 0.00 0.00 174.94 174.15 1rk7 s GLU 100 N -1.16 0.94 0.30 2.79 2.12 -1.26 -0.49 118.70 121.94 1rk7 s GLU 100 Ca 0.01 -1.45 0.09 0.00 0.36 0.00 0.00 54.97 53.98 1rk7 s GLU 100 Cb -0.08 -2.12 -0.04 0.00 0.26 0.00 0.00 34.13 32.15 1rk7 s GLU 100 CO 0.01 -1.06 0.09 -0.51 -0.54 0.00 0.00 175.26 173.25 1rk7 s ASP 101 N 1.12 4.75 -0.01 -1.70 1.11 -1.25 -4.90 116.67 115.79 1rk7 s ASP 101 Ca 0.13 -0.64 0.01 0.00 0.18 0.00 0.00 52.55 52.23 1rk7 s ASP 101 Cb -0.20 -0.88 0.01 0.00 1.07 0.00 0.00 42.92 42.92 1rk7 s ASP 101 CO -0.14 -0.13 0.74 -1.54 1.18 0.00 0.00 175.17 175.28 1rk7 n SER 102 N -1.05 0.85 0.06 0.27 3.41 -1.26 -0.65 113.62 115.25 1rk7 n SER 102 Ca -0.05 -1.52 -0.18 0.00 -0.26 0.00 0.00 58.87 56.86 1rk7 n SER 102 Cb 0.60 -0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.38 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 1.97 1.12 -2.62 -3.33 2.07 -1.96 -3.45 116.25 110.06 1rk7 h VAL 103 Ca 0.00 -2.75 -0.46 0.00 0.82 0.00 0.00 66.70 64.30 1rk7 h VAL 103 Cb 0.83 2.76 0.10 0.00 -1.52 0.00 0.00 31.29 33.46 1rk7 h VAL 103 CO 0.00 0.82 0.17 0.27 0.02 0.00 0.00 177.57 178.85 1rk7 s ILE 104 N -2.61 2.12 -0.28 4.57 -0.00 -1.26 -4.94 121.20 118.80 1rk7 s ILE 104 Ca -0.10 -0.46 -0.25 0.00 -0.00 0.00 0.00 60.65 59.85 1rk7 s ILE 104 Cb 0.07 -2.67 0.12 0.00 -0.00 0.00 0.00 42.46 39.98 1rk7 s ILE 104 CO 0.85 0.00 1.00 -0.55 -0.00 0.00 0.00 174.94 176.25 1rk7 s SER 105 N -4.75 -0.48 0.36 4.36 0.15 -1.00 -4.86 113.70 107.47 1rk7 s SER 105 Ca 0.67 0.92 0.17 0.00 0.70 0.00 0.00 55.95 58.41 1rk7 s SER 105 Cb -0.05 0.94 0.64 0.00 -1.71 0.00 0.00 66.02 65.85 1rk7 s SER 105 CO 0.46 -0.16 1.73 -0.07 1.20 0.00 0.00 173.24 176.40 1rk7 h LEU 106 N 4.36 0.00 -7.79 3.45 4.07 -1.93 -2.21 115.31 115.26 1rk7 h LEU 106 Ca -0.28 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.31 1rk7 h LEU 106 Cb 1.18 0.00 -0.32 0.00 1.08 0.00 0.00 40.66 42.60 1rk7 h LEU 106 CO 0.11 0.41 -0.76 -0.55 -1.08 0.00 0.00 178.44 176.57 1rk7 s SER 107 N -6.54 0.73 0.00 -0.43 0.15 -1.26 -4.40 113.70 101.94 1rk7 s SER 107 Ca -0.01 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1rk7 s SER 107 Cb 0.12 -0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 1rk7 s SER 107 CO 0.70 -0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.74 1rk7 n GLY 108 N 3.60 1.02 1.36 9.45 0.00 -1.26 -4.87 105.19 114.50 1rk7 n GLY 108 Ca -0.21 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1rk7 n GLY 108 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rk7 n ASP 109 N 0.00 0.00 -2.64 1.61 8.00 -1.26 -4.90 116.55 117.36 1rk7 n ASP 109 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.24 1rk7 n ASP 109 Cb 0.00 0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.18 1.37 -1.61 1.24 8.25 -1.26 -4.94 115.22 116.09 1rk7 n HIS 110 Ca 0.00 -2.14 -0.49 0.00 -0.26 0.00 0.00 57.72 54.83 1rk7 n HIS 110 Cb 0.00 -1.72 -0.05 0.00 1.12 0.00 0.00 29.99 29.33 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 2.03 3.02 0.08 0.41 3.41 -1.03 -2.37 113.62 119.17 1rk7 n SER 111 Ca 0.54 0.71 0.01 0.00 -0.26 0.00 0.00 58.87 59.87 1rk7 n SER 111 Cb 0.57 -1.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.13 1rk7 n SER 111 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1rk7 h ILE 112 N 6.15 0.68 -2.62 -1.33 3.07 -1.61 -3.46 117.51 118.39 1rk7 h ILE 112 Ca -0.42 -2.11 -0.52 0.00 1.55 0.00 0.00 64.86 63.36 1rk7 h ILE 112 Cb 1.28 2.22 0.05 0.00 -0.27 0.00 0.00 36.82 40.10 1rk7 h ILE 112 CO 0.97 0.39 1.04 -0.63 -1.05 0.00 0.00 178.15 178.87 1rk7 s ILE 113 N -2.95 2.29 0.00 0.16 1.01 -1.26 -2.72 121.20 117.74 1rk7 s ILE 113 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1rk7 s ILE 113 Cb 0.08 -3.05 0.00 0.00 0.01 0.00 0.00 42.46 39.51 1rk7 s ILE 113 CO 0.78 0.00 0.00 0.61 0.00 0.00 0.00 174.94 176.33 1rk7 n GLY 114 N 4.07 1.14 3.62 6.18 0.00 -1.26 -5.03 105.19 113.90 1rk7 n GLY 114 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.16 3.97 -1.22 1.61 0.52 -1.10 -4.90 118.95 117.67 1rk7 s ARG 115 Ca 0.00 0.71 -0.10 0.00 -0.52 0.00 0.00 55.73 55.82 1rk7 s ARG 115 Cb 0.00 -3.74 0.20 0.00 0.52 0.00 0.00 34.95 31.93 1rk7 s ARG 115 CO 0.00 -0.77 1.66 2.41 0.02 0.00 0.00 175.30 178.62 1rk7 n THR 116 N 5.68 4.49 -1.47 0.02 -1.04 -1.26 -3.02 114.28 117.67 1rk7 n THR 116 Ca 0.06 -4.77 -0.25 0.00 -2.04 0.00 0.00 64.05 57.05 1rk7 n THR 116 Cb 0.48 -2.36 -0.10 0.00 -1.82 0.00 0.00 70.33 66.53 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1rk7 n LEU 117 N 3.86 1.92 -4.91 -4.42 -0.00 -1.25 -3.15 117.00 109.05 1rk7 n LEU 117 Ca 0.36 -2.52 -0.29 0.00 -0.00 0.00 0.00 56.01 53.56 1rk7 n LEU 117 Cb 0.38 -1.47 0.12 0.00 -0.00 0.00 0.00 43.42 42.44 1rk7 n LEU 117 CO 0.73 -2.67 0.81 0.68 -0.00 0.00 0.00 177.39 176.94 1rk7 s VAL 118 N 13.07 2.01 -0.04 1.96 -7.23 -0.08 -3.77 120.40 126.33 1rk7 s VAL 118 Ca 0.74 -0.01 0.06 0.00 -1.81 0.00 0.00 61.98 60.96 1rk7 s VAL 118 Cb 0.01 -3.00 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 1rk7 s VAL 118 CO 0.20 0.00 -0.21 0.68 -0.31 0.00 0.00 175.10 175.46 1rk7 s VAL 119 N -3.66 2.50 -0.00 1.32 -7.23 -1.25 -2.40 120.40 109.68 1rk7 s VAL 119 Ca 0.65 -0.94 -0.00 0.00 -1.81 0.00 0.00 61.98 59.89 1rk7 s VAL 119 Cb -0.09 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 1rk7 s VAL 119 CO 0.50 0.58 0.06 -1.00 -0.31 0.00 0.00 175.10 174.94 1rk7 s HIS 120 N -0.63 3.24 0.24 2.82 3.76 0.11 -0.07 115.29 124.76 1rk7 s HIS 120 Ca 0.10 0.18 -0.12 0.00 -0.15 0.00 0.00 55.06 55.07 1rk7 s HIS 120 Cb -0.10 -1.72 0.34 0.00 1.11 0.00 0.00 32.58 32.20 1rk7 s HIS 120 CO -0.00 0.53 1.49 0.39 -0.85 0.00 0.00 174.74 176.30 1rk7 n GLU 121 N 1.24 -0.15 -1.57 1.40 1.02 -1.16 -4.16 120.64 117.25 1rk7 n GLU 121 Ca -0.13 1.48 0.00 0.00 -0.02 0.00 0.00 57.16 58.49 1rk7 n GLU 121 Cb 0.53 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 1rk7 n GLU 121 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1rk7 n LYS 122 N -5.48 1.62 -2.67 3.49 5.02 0.09 -4.91 118.16 115.32 1rk7 n LYS 122 Ca 0.13 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.18 1rk7 n LYS 122 Cb 0.43 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.56 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rk7 s ALA 123 N -2.00 3.88 -1.22 7.82 0.00 -1.25 -1.26 121.76 127.74 1rk7 s ALA 123 Ca 0.00 -1.93 0.16 0.00 0.00 0.00 0.00 51.96 50.18 1rk7 s ALA 123 Cb 0.00 -1.86 0.74 0.00 0.00 0.00 0.00 23.12 22.00 1rk7 s ALA 123 CO 0.00 -1.51 1.48 -0.25 0.00 0.00 0.00 175.76 175.48 1rk7 n ASP 124 N -2.83 0.00 -1.80 0.00 9.92 -1.23 -2.40 116.55 118.21 1rk7 n ASP 124 Ca 0.17 0.27 -0.18 0.00 -0.53 0.00 0.00 54.79 54.52 1rk7 n ASP 124 Cb 0.61 -0.39 -0.04 0.00 -0.64 0.00 0.00 41.12 40.66 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1rk7 n ASP 125 N -1.39 -5.30 -1.27 -2.24 9.92 -1.19 -0.88 116.55 114.19 1rk7 n ASP 125 Ca 0.06 0.20 -0.15 0.00 -0.53 0.00 0.00 54.79 54.37 1rk7 n ASP 125 Cb 0.15 -4.40 -0.06 0.00 -0.64 0.00 0.00 41.12 36.17 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 -2.41 -0.95 0.00 0.64 4.77 -1.26 0.64 117.00 118.43 1rk7 n LEU 126 Ca -0.20 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1rk7 n LEU 126 Cb 0.64 -2.46 0.00 0.00 -2.33 0.00 0.00 43.42 39.27 1rk7 n LEU 126 CO 0.27 -0.92 0.00 0.61 -1.33 0.00 0.00 177.39 176.02 1rk7 n GLY 127 N -0.14 2.66 2.70 -0.72 0.00 -0.06 -4.28 105.19 105.35 1rk7 n GLY 127 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1rk7 n GLY 127 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1rk7 n LYS 128 N -2.00 -2.63 -2.20 1.61 4.81 0.21 0.20 118.16 118.16 1rk7 n LYS 128 Ca 0.00 0.41 -0.07 0.00 -0.87 0.00 0.00 58.31 57.78 1rk7 n LYS 128 Cb 0.00 -5.01 -0.00 0.00 0.02 0.00 0.00 35.03 30.04 1rk7 n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1rk7 n GLY 129 N -0.81 0.12 2.12 3.14 0.00 -1.26 -4.62 105.19 103.88 1rk7 n GLY 129 Ca -0.08 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.01 -5.13 3.08 -0.02 0.00 0.54 -5.02 105.19 97.63 1rk7 n GLY 130 Ca -0.08 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1rk7 n GLY 130 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rk7 s ASN 131 N -0.51 0.28 0.46 1.61 3.84 -1.25 -4.79 114.94 114.58 1rk7 s ASN 131 Ca 0.00 -0.65 0.41 0.00 0.21 0.00 0.00 52.86 52.83 1rk7 s ASN 131 Cb 0.00 0.19 1.46 0.00 -0.55 0.00 0.00 41.25 42.35 1rk7 s ASN 131 CO 0.00 -0.49 1.33 -0.62 -2.79 0.00 0.00 177.10 174.53 1rk7 n GLU 132 N 0.78 -0.00 -0.09 0.43 1.02 -1.26 0.27 120.64 121.79 1rk7 n GLU 132 Ca -0.19 0.94 -0.19 0.00 -0.02 0.00 0.00 57.16 57.70 1rk7 n GLU 132 Cb 0.58 -2.13 -0.12 0.00 -0.02 0.00 0.00 31.44 29.76 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1rk7 h GLN 133 N 0.00 0.00 0.24 3.49 4.15 -1.98 -3.31 115.11 117.70 1rk7 h GLN 133 Ca 0.80 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 60.21 1rk7 h GLN 133 Cb 3.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 30.83 1rk7 h GLN 133 CO -0.05 1.00 -0.12 0.77 -1.93 0.00 0.00 178.83 178.50 1rk7 h SER 134 N -1.00 -0.27 -0.47 -0.69 0.02 0.13 0.98 113.55 112.25 1rk7 h SER 134 Ca -0.24 -0.23 0.14 0.00 -0.84 0.00 0.00 61.79 60.62 1rk7 h SER 134 Cb 1.21 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.80 1rk7 h SER 134 CO -0.14 0.11 0.78 0.71 -1.14 0.00 0.00 176.83 177.15 1rk7 h THR 135 N -0.71 0.11 0.00 -2.27 1.35 0.37 0.73 112.91 112.50 1rk7 h THR 135 Ca -0.03 0.00 -0.36 0.00 -0.55 0.00 0.00 66.41 65.47 1rk7 h THR 135 Cb 0.48 0.32 -0.07 0.00 -1.73 0.00 0.00 68.15 67.16 1rk7 h THR 135 CO 0.05 0.00 -2.37 1.17 -0.25 0.00 0.00 175.52 174.13 1rk7 n LYS 136 N -3.18 0.71 0.00 4.72 4.81 -1.03 -0.67 118.16 123.52 1rk7 n LYS 136 Ca 0.10 0.08 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 1rk7 n LYS 136 Cb 0.94 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.50 1rk7 n LYS 136 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1rk7 n THR 137 N -3.02 0.00 0.00 3.15 -2.24 0.34 -4.83 114.28 107.68 1rk7 n THR 137 Ca -0.39 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1rk7 n THR 137 Cb 1.02 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 1rk7 n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rk7 n GLY 138 N 1.31 0.00 2.66 3.38 0.00 -1.18 -4.62 105.19 106.75 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 -1.36 -0.06 1.61 2.85 -1.26 -3.17 115.26 113.87 1rk7 n ASN 139 Ca 0.00 0.33 -0.04 0.00 -0.11 0.00 0.00 54.58 54.76 1rk7 n ASN 139 Cb 0.00 -1.28 -0.01 0.00 1.24 0.00 0.00 39.78 39.73 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rk7 h ALA 140 N 0.99 0.00 0.00 5.20 0.00 -1.74 -3.43 119.26 120.28 1rk7 h ALA 140 Ca -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1rk7 h ALA 140 Cb 1.05 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1rk7 h ALA 140 CO 0.11 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.19 1rk7 n GLY 141 N 1.64 -0.31 3.63 0.00 0.00 -1.26 -0.73 105.19 108.16 1rk7 n GLY 141 Ca -0.06 0.14 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 1rk7 n GLY 141 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rk7 s SER 142 N -4.00 -0.12 1.09 1.61 0.15 -1.26 -4.92 113.70 106.25 1rk7 s SER 142 Ca 0.00 0.17 -0.15 0.00 0.70 0.00 0.00 55.95 56.67 1rk7 s SER 142 Cb 0.00 0.15 0.16 0.00 -1.71 0.00 0.00 66.02 64.62 1rk7 s SER 142 CO 0.00 -0.08 0.51 -2.11 1.20 0.00 0.00 173.24 172.76 1rk7 n ARG 143 N 0.96 -1.56 0.00 5.44 0.00 -1.26 -2.99 116.66 117.24 1rk7 n ARG 143 Ca -0.05 -0.43 0.00 0.00 -0.00 0.00 0.00 57.85 57.37 1rk7 n ARG 143 Cb 0.58 -1.94 0.00 0.00 -0.00 0.00 0.00 32.46 31.09 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 -2.94 0.00 -4.10 2.89 4.77 0.90 -4.86 117.00 113.67 1rk7 n LEU 144 Ca 0.04 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.66 1rk7 n LEU 144 Cb 0.57 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.72 1rk7 n LEU 144 CO 0.53 0.00 -1.25 0.00 -1.33 0.00 0.00 177.39 175.34 1rk7 n ALA 145 N -3.00 -4.98 -3.23 -1.18 0.00 -1.26 -4.53 120.51 102.33 1rk7 n ALA 145 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 53.44 52.29 1rk7 n ALA 145 Cb 0.00 -1.20 -0.07 0.00 0.00 0.00 0.00 19.45 18.18 1rk7 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk7 n GLY 147 N 1.35 3.36 3.74 0.00 0.00 -1.25 -4.68 105.19 107.71 1rk7 n GLY 147 Ca 0.23 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 1rk7 n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rk7 s VAL 148 N 3.43 2.66 0.03 1.61 1.01 -1.25 -3.90 120.40 123.98 1rk7 s VAL 148 Ca 0.50 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.70 1rk7 s VAL 148 Cb 0.13 -3.33 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 1rk7 s VAL 148 CO -0.02 0.07 1.75 -0.63 0.00 0.00 0.00 175.10 176.27 1rk7 s ILE 149 N 0.34 3.13 -0.12 2.22 1.09 -1.17 -4.27 121.20 122.42 1rk7 s ILE 149 Ca 0.62 0.38 -0.02 0.00 -1.10 0.00 0.00 60.65 60.54 1rk7 s ILE 149 Cb -0.42 -3.25 0.04 0.00 -1.06 0.00 0.00 42.46 37.77 1rk7 s ILE 149 CO 0.40 -0.02 0.01 -0.83 -0.10 0.00 0.00 174.94 174.40 1rk7 s GLY 150 N 3.20 0.58 0.62 6.18 0.00 0.63 -4.10 107.32 114.43 1rk7 s GLY 150 Ca 0.78 -0.37 -0.17 0.00 0.00 0.00 0.00 44.72 44.96 1rk7 s GLY 150 CO 0.34 1.23 0.34 1.39 0.00 0.00 0.00 173.10 176.40 1rk7 n ILE 151 N 5.10 1.61 -3.94 0.90 2.08 -1.26 0.83 119.36 124.68 1rk7 n ILE 151 Ca -0.08 -0.47 -0.09 0.00 0.56 0.00 0.00 62.75 62.67 1rk7 n ILE 151 Cb 0.49 -0.54 -0.09 0.00 -0.75 0.00 0.00 39.64 38.75 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 -1.84 -0.02 -2.62 -1.39 0.00 -0.69 -4.64 121.76 110.57 1rk7 s ALA 152 Ca 0.64 -0.64 0.27 0.00 0.00 0.00 0.00 51.96 52.24 1rk7 s ALA 152 Cb -0.42 0.28 0.84 0.00 0.00 0.00 0.00 23.12 23.83 1rk7 s ALA 152 CO 0.59 -0.35 1.63 0.00 0.00 0.00 0.00 175.76 177.63