#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 5.19 -0.57 0.00 2.01 -1.26 -4.89 115.64 116.12 1rk7 s THR 2 Ca 0.00 -0.42 -0.24 0.00 0.31 0.00 0.00 61.69 61.34 1rk7 s THR 2 Cb 0.00 -3.94 0.04 0.00 0.01 0.00 0.00 72.50 68.61 1rk7 s THR 2 CO 0.00 -0.30 0.96 -0.75 -0.69 0.00 0.00 174.62 173.84 1rk7 s LYS 3 N 1.90 3.31 0.42 4.92 2.36 -1.25 -3.95 119.74 127.44 1rk7 s LYS 3 Ca 0.09 -0.31 -0.05 0.00 -2.55 0.00 0.00 55.97 53.14 1rk7 s LYS 3 Cb -0.18 -4.07 -0.04 0.00 -1.05 0.00 0.00 37.83 32.49 1rk7 s LYS 3 CO 0.12 -1.54 0.71 0.00 1.55 0.00 0.00 175.35 176.18 1rk7 s ALA 4 N 4.03 3.48 0.10 3.13 0.00 0.43 -1.29 121.76 131.64 1rk7 s ALA 4 Ca 0.30 -0.53 0.06 0.00 0.00 0.00 0.00 51.96 51.79 1rk7 s ALA 4 Cb -0.13 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 1rk7 s ALA 4 CO 0.18 -0.15 -0.16 0.08 0.00 0.00 0.00 175.76 175.72 1rk7 s VAL 5 N -2.51 1.35 -0.38 0.00 1.01 0.10 0.12 120.40 120.10 1rk7 s VAL 5 Ca 0.46 -1.51 0.04 0.00 0.00 0.00 0.00 61.98 60.97 1rk7 s VAL 5 Cb -0.10 -1.35 0.16 0.00 0.00 0.00 0.00 36.38 35.08 1rk7 s VAL 5 CO 0.39 -0.24 0.40 0.00 0.00 0.00 0.00 175.10 175.65 1rk7 s ALA 6 N -1.53 -0.62 -0.51 5.51 0.00 0.45 0.85 121.76 125.91 1rk7 s ALA 6 Ca 0.04 -0.87 -0.26 0.00 0.00 0.00 0.00 51.96 50.86 1rk7 s ALA 6 Cb -0.08 -2.13 0.03 0.00 0.00 0.00 0.00 23.12 20.94 1rk7 s ALA 6 CO 0.03 -2.15 1.01 0.14 0.00 0.00 0.00 175.76 174.78 1rk7 s VAL 7 N 1.45 4.33 0.35 0.00 -7.23 -1.25 -1.07 120.40 116.98 1rk7 s VAL 7 Ca 0.17 0.69 -0.27 0.00 -1.81 0.00 0.00 61.98 60.76 1rk7 s VAL 7 Cb -0.14 -4.54 -0.12 0.00 0.56 0.00 0.00 36.38 32.13 1rk7 s VAL 7 CO -0.03 -1.04 1.17 0.18 -0.31 0.00 0.00 175.10 175.07 1rk7 n LEU 8 N 7.58 3.00 -3.65 1.32 7.99 0.29 -4.01 117.00 129.51 1rk7 n LEU 8 Ca 0.06 1.16 0.01 0.00 -0.01 0.00 0.00 56.01 57.24 1rk7 n LEU 8 Cb 0.48 -1.41 -0.06 0.00 -0.11 0.00 0.00 43.42 42.32 1rk7 n LEU 8 CO 0.66 -0.89 0.95 -1.59 -1.51 0.00 0.00 177.39 175.01 1rk7 s LYS 9 N -1.85 0.10 0.00 3.23 -2.85 -1.24 -3.85 119.74 113.28 1rk7 s LYS 9 Ca 0.58 0.18 0.00 0.00 -1.00 0.00 0.00 55.97 55.73 1rk7 s LYS 9 Cb -0.59 0.02 0.00 0.00 -2.06 0.00 0.00 37.83 35.20 1rk7 s LYS 9 CO 0.60 -0.02 0.00 0.41 0.10 0.00 0.00 175.35 176.44 1rk7 n GLY 10 N 3.13 -1.90 0.33 0.59 0.00 -1.26 -0.89 105.19 105.19 1rk7 n GLY 10 Ca -0.17 0.66 0.28 0.00 0.00 0.00 0.00 46.02 46.78 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 0.25 0.00 1.61 1.82 -1.91 -3.46 116.42 114.74 1rk7 h ASP 11 Ca 0.00 0.25 0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1rk7 h ASP 11 Cb 0.00 0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.28 1rk7 h ASP 11 CO 0.00 -0.36 0.00 0.61 -1.61 0.00 0.00 179.24 177.88 1rk7 n GLY 12 N -1.30 3.16 0.15 -0.78 0.00 -1.26 -4.85 105.19 100.31 1rk7 n GLY 12 Ca 0.34 -0.78 0.02 0.00 0.00 0.00 0.00 46.02 45.60 1rk7 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rk7 h PRO 13 N 0.00 0.00 -6.50 1.61 0.13 -1.92 -3.41 132.00 121.91 1rk7 h PRO 13 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 1rk7 h PRO 13 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 1rk7 h PRO 13 CO 0.00 0.55 0.82 0.08 -0.23 0.00 0.00 178.00 179.22 1rk7 s VAL 14 N -3.34 4.26 -0.24 1.56 1.01 -1.25 -4.05 120.40 118.35 1rk7 s VAL 14 Ca 0.01 0.99 0.15 0.00 0.00 0.00 0.00 61.98 63.13 1rk7 s VAL 14 Cb 0.10 -4.58 0.47 0.00 0.00 0.00 0.00 36.38 32.37 1rk7 s VAL 14 CO 0.73 -1.03 1.17 1.67 0.00 0.00 0.00 175.10 177.64 1rk7 n GLN 15 N 7.74 2.32 -0.68 2.72 7.27 -0.13 -3.64 117.38 132.99 1rk7 n GLN 15 Ca 0.09 -3.60 -0.32 0.00 0.07 0.00 0.00 57.00 53.25 1rk7 n GLN 15 Cb 0.49 -1.72 0.17 0.00 2.41 0.00 0.00 30.24 31.59 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 -0.60 -2.28 2.75 1.69 0.00 -1.25 -4.58 105.19 100.92 1rk7 n GLY 16 Ca 0.24 -0.82 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.30 -0.32 0.01 -0.61 1.01 0.12 0.10 121.20 119.21 1rk7 s ILE 17 Ca 0.58 -0.13 0.04 0.00 0.00 0.00 0.00 60.65 61.14 1rk7 s ILE 17 Cb -0.16 -0.69 -0.01 0.00 0.01 0.00 0.00 42.46 41.61 1rk7 s ILE 17 CO 0.66 -0.22 -0.13 -0.51 0.00 0.00 0.00 174.94 174.75 1rk7 s ILE 18 N 2.32 1.00 0.31 2.92 -1.16 -0.24 -0.13 121.20 126.23 1rk7 s ILE 18 Ca 0.07 -0.70 0.08 0.00 -0.51 0.00 0.00 60.65 59.59 1rk7 s ILE 18 Cb -0.16 -0.87 -0.06 0.00 0.61 0.00 0.00 42.46 41.99 1rk7 s ILE 18 CO -0.13 0.16 -0.08 0.20 -2.81 0.00 0.00 174.94 172.28 1rk7 s ASN 19 N -0.62 3.26 -0.26 4.50 0.01 -0.29 0.17 114.94 121.71 1rk7 s ASN 19 Ca 0.03 -1.18 -0.01 0.00 -0.71 0.00 0.00 52.86 50.99 1rk7 s ASN 19 Cb -0.06 -0.26 0.08 0.00 0.41 0.00 0.00 41.25 41.42 1rk7 s ASN 19 CO 0.00 -0.26 0.04 -0.36 -1.51 0.00 0.00 177.10 175.02 1rk7 s PHE 20 N -2.79 1.84 -0.09 2.20 0.40 0.32 -3.06 117.98 116.79 1rk7 s PHE 20 Ca 0.31 -1.60 0.02 0.00 -0.60 0.00 0.00 56.93 55.06 1rk7 s PHE 20 Cb 0.03 -1.59 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 1rk7 s PHE 20 CO 0.14 -0.79 -0.17 -2.00 0.70 0.00 0.00 175.22 173.11 1rk7 s GLU 21 N 1.58 2.94 -0.49 0.44 2.12 -0.95 0.16 118.70 124.51 1rk7 s GLU 21 Ca 0.03 -0.74 0.08 0.00 0.36 0.00 0.00 54.97 54.70 1rk7 s GLU 21 Cb -0.18 -2.44 0.35 0.00 0.26 0.00 0.00 34.13 32.12 1rk7 s GLU 21 CO -0.15 0.36 0.87 0.94 -0.54 0.00 0.00 175.26 176.74 1rk7 n GLN 22 N 3.06 2.29 -0.99 4.30 7.27 -1.25 0.19 117.38 132.24 1rk7 n GLN 22 Ca -0.18 -4.22 -0.35 0.00 0.07 0.00 0.00 57.00 52.32 1rk7 n GLN 22 Cb 0.52 -2.00 -0.04 0.00 2.41 0.00 0.00 30.24 31.13 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 -0.04 1.70 0.12 3.69 5.02 -1.26 0.20 118.16 127.60 1rk7 n LYS 23 Ca 0.28 -1.70 0.00 0.00 -2.02 0.00 0.00 58.31 54.88 1rk7 n LYS 23 Cb 0.52 -2.74 0.00 0.00 -0.02 0.00 0.00 35.03 32.78 1rk7 n LYS 23 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1rk7 n GLU 24 N 5.97 0.00 0.00 1.97 4.71 -1.26 -4.73 120.64 127.29 1rk7 n GLU 24 Ca 0.47 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.62 1rk7 n GLU 24 Cb 0.30 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.73 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 -3.20 0.00 -0.77 1.62 2.88 -1.21 -4.56 113.62 108.38 1rk7 n SER 25 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1rk7 n SER 25 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1rk7 n SER 25 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1rk7 n ASN 26 N 0.00 -0.17 -1.58 -3.46 3.02 -1.26 -5.13 115.26 106.69 1rk7 n ASN 26 Ca 0.00 -1.58 -0.03 0.00 -0.03 0.00 0.00 54.58 52.94 1rk7 n ASN 26 Cb 0.00 0.02 -0.01 0.00 -0.61 0.00 0.00 39.78 39.18 1rk7 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rk7 n GLY 27 N 0.06 3.97 3.82 7.41 0.00 -1.26 -5.15 105.19 114.03 1rk7 n GLY 27 Ca -0.07 -1.85 -0.32 0.00 0.00 0.00 0.00 46.02 43.78 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 -2.18 3.11 -0.13 1.61 0.04 -1.26 -4.82 135.00 131.38 1rk7 s PRO 28 Ca 0.03 1.04 -0.22 0.00 0.04 0.00 0.00 61.00 61.89 1rk7 s PRO 28 Cb 0.00 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1rk7 s PRO 28 CO 0.02 -0.96 0.68 0.08 0.04 0.00 0.00 177.00 176.86 1rk7 s VAL 29 N -2.83 5.02 -0.86 -0.36 1.01 0.19 -4.73 120.40 117.84 1rk7 s VAL 29 Ca 0.60 1.35 -0.25 0.00 0.00 0.00 0.00 61.98 63.68 1rk7 s VAL 29 Cb -0.14 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.26 1rk7 s VAL 29 CO 0.48 0.18 1.47 -0.54 0.00 0.00 0.00 175.10 176.68 1rk7 s LYS 30 N 1.36 3.25 -0.19 2.72 1.02 0.50 -1.75 119.74 126.65 1rk7 s LYS 30 Ca 0.34 -0.55 -0.14 0.00 0.02 0.00 0.00 55.97 55.64 1rk7 s LYS 30 Cb -0.17 -4.79 -0.04 0.00 -0.52 0.00 0.00 37.83 32.31 1rk7 s LYS 30 CO 0.14 -2.35 0.32 0.08 -0.92 0.00 0.00 175.35 172.63 1rk7 s VAL 31 N 6.13 5.27 0.08 3.17 1.01 0.13 -2.24 120.40 133.95 1rk7 s VAL 31 Ca 0.46 0.57 -0.22 0.00 0.00 0.00 0.00 61.98 62.79 1rk7 s VAL 31 Cb -0.05 -3.66 0.06 0.00 0.00 0.00 0.00 36.38 32.73 1rk7 s VAL 31 CO 0.03 0.32 0.54 -1.66 0.00 0.00 0.00 175.10 174.34 1rk7 s TRP 32 N 0.91 -0.45 -0.57 5.22 -2.14 -1.17 -0.28 118.94 120.47 1rk7 s TRP 32 Ca 0.16 0.41 0.00 0.00 2.66 0.00 0.00 56.10 59.34 1rk7 s TRP 32 Cb -0.14 0.40 0.00 0.00 -3.10 0.00 0.00 33.47 30.63 1rk7 s TRP 32 CO 0.06 -0.70 0.00 0.41 -2.66 0.00 0.00 176.95 174.05 1rk7 n GLY 33 N 0.15 -1.09 3.49 3.67 0.00 -1.11 -1.14 105.19 109.16 1rk7 n GLY 33 Ca -0.18 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 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 -4.00 -0.78 0.64 1.61 1.04 0.82 -0.84 113.70 112.19 1rk7 s SER 34 Ca 0.00 1.33 -0.08 0.00 0.48 0.00 0.00 55.95 57.69 1rk7 s SER 34 Cb 0.00 1.83 0.02 0.00 0.10 0.00 0.00 66.02 67.96 1rk7 s SER 34 CO 0.00 -0.22 0.97 -0.63 0.98 0.00 0.00 173.24 174.34 1rk7 s ILE 35 N 2.64 3.43 -0.26 -1.02 1.01 0.37 0.12 121.20 127.48 1rk7 s ILE 35 Ca -0.05 0.10 -0.05 0.00 0.00 0.00 0.00 60.65 60.65 1rk7 s ILE 35 Cb -0.11 -3.40 0.14 0.00 0.01 0.00 0.00 42.46 39.09 1rk7 s ILE 35 CO -0.17 -0.45 0.52 -0.54 0.00 0.00 0.00 174.94 174.31 1rk7 s LYS 36 N -5.13 0.47 0.00 2.79 1.02 -1.26 -3.37 119.74 114.26 1rk7 s LYS 36 Ca 0.56 1.03 0.00 0.00 0.02 0.00 0.00 55.97 57.58 1rk7 s LYS 36 Cb -0.11 0.36 0.00 0.00 -0.52 0.00 0.00 37.83 37.57 1rk7 s LYS 36 CO 0.47 -0.43 0.00 0.41 -0.92 0.00 0.00 175.35 174.88 1rk7 n GLY 37 N 5.41 3.92 0.00 -3.33 0.00 -1.26 -0.95 105.19 108.98 1rk7 n GLY 37 Ca -0.06 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 -3.99 0.99 4.32 -1.26 -4.90 117.00 112.16 1rk7 n LEU 38 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.86 1rk7 n LEU 38 Cb 0.00 0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 41.67 1rk7 n LEU 38 CO 0.00 -1.28 -0.39 0.42 -1.22 0.00 0.00 177.39 174.92 1rk7 s THR 39 N -0.64 0.32 -0.18 -5.08 -4.23 -1.26 -3.66 115.64 100.92 1rk7 s THR 39 Ca 0.00 -0.64 -0.34 0.00 -1.18 0.00 0.00 61.69 59.53 1rk7 s THR 39 Cb 0.00 -0.37 -0.16 0.00 1.34 0.00 0.00 72.50 73.32 1rk7 s THR 39 CO 0.00 -0.21 1.04 -1.84 -0.54 0.00 0.00 174.62 173.06 1rk7 n GLU 40 N 2.15 0.00 0.00 3.99 -0.00 -1.26 -4.36 120.64 121.16 1rk7 n GLU 40 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.97 1rk7 n GLU 40 Cb 0.57 -1.19 0.00 0.00 -0.00 0.00 0.00 31.44 30.82 1rk7 n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1rk7 n GLY 41 N 2.09 1.02 3.85 -1.84 0.00 -1.26 -4.88 105.19 104.17 1rk7 n GLY 41 Ca 0.20 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.86 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 3.55 -0.46 0.99 1.02 -1.26 -0.45 118.68 122.07 1rk7 s LEU 42 Ca 0.00 1.49 0.06 0.00 0.02 0.00 0.00 54.13 55.70 1rk7 s LEU 42 Cb 0.00 -4.45 0.21 0.00 0.02 0.00 0.00 46.19 41.97 1rk7 s LEU 42 CO 0.00 -0.64 0.61 1.41 0.02 0.00 0.00 176.35 177.76 1rk7 n HIS 43 N -1.83 -2.22 0.00 0.29 8.25 -1.21 -2.31 115.22 116.20 1rk7 n HIS 43 Ca 0.06 -2.44 0.00 0.00 -0.26 0.00 0.00 57.72 55.08 1rk7 n HIS 43 Cb 0.54 0.79 0.00 0.00 1.12 0.00 0.00 29.99 32.44 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 2.32 0.82 3.30 -1.41 0.00 -1.20 -2.02 105.19 107.01 1rk7 n GLY 44 Ca 0.20 -0.29 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 1rk7 n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1rk7 s PHE 45 N 0.00 -0.15 1.29 1.61 5.36 -1.26 -1.96 117.98 122.87 1rk7 s PHE 45 Ca 0.00 -0.16 -0.18 0.00 -0.96 0.00 0.00 56.93 55.63 1rk7 s PHE 45 Cb 0.00 0.21 0.32 0.00 -0.34 0.00 0.00 43.02 43.21 1rk7 s PHE 45 CO 0.00 -0.67 0.99 -3.38 -1.46 0.00 0.00 175.22 170.70 1rk7 s HIS 46 N -3.70 0.37 -0.10 10.12 -3.43 -0.86 -4.61 115.29 113.08 1rk7 s HIS 46 Ca 0.03 0.81 -0.00 0.00 -0.80 0.00 0.00 55.06 55.09 1rk7 s HIS 46 Cb 0.02 -3.04 0.00 0.00 -1.43 0.00 0.00 32.58 28.13 1rk7 s HIS 46 CO -0.11 -4.39 0.10 0.28 -2.00 0.00 0.00 174.74 168.62 1rk7 n VAL 47 N -5.23 -2.54 -3.74 -5.38 0.31 -1.25 -4.75 118.33 95.75 1rk7 n VAL 47 Ca 0.08 -0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.28 1rk7 n VAL 47 Cb 0.58 -4.10 -0.13 0.00 -0.91 0.00 0.00 33.84 29.28 1rk7 n VAL 47 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1rk7 s HIS 48 N -2.67 -0.29 -0.69 3.52 3.76 -1.26 -4.87 115.29 112.79 1rk7 s HIS 48 Ca 0.01 0.72 -0.31 0.00 -0.15 0.00 0.00 55.06 55.33 1rk7 s HIS 48 Cb -0.00 0.04 -0.15 0.00 1.11 0.00 0.00 32.58 33.58 1rk7 s HIS 48 CO 0.11 -0.21 2.48 0.39 -0.85 0.00 0.00 174.74 176.67 1rk7 n GLU 49 N 4.02 0.54 -0.11 1.40 1.02 -0.14 -4.76 120.64 122.60 1rk7 n GLU 49 Ca -0.23 0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 56.83 1rk7 n GLU 49 Cb 0.54 -2.32 -0.01 0.00 -0.02 0.00 0.00 31.44 29.63 1rk7 n GLU 49 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1rk7 h GLU 50 N 14.43 0.92 0.00 3.49 4.22 -1.92 -3.45 114.58 132.28 1rk7 h GLU 50 Ca -0.16 -0.48 0.00 0.00 0.08 0.00 0.00 59.36 58.80 1rk7 h GLU 50 Cb 1.30 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1rk7 h GLU 50 CO 1.23 1.14 0.00 -0.85 -2.18 0.00 0.00 179.01 178.35 1rk7 n GLU 51 N -4.06 0.00 0.00 1.92 0.28 -1.26 -4.85 120.64 112.68 1rk7 n GLU 51 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1rk7 n GLU 51 Cb 0.54 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.41 1rk7 n GLU 51 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1rk7 n ASP 52 N 2.30 -0.29 -2.54 -1.84 -0.08 -1.26 -4.21 116.55 108.62 1rk7 n ASP 52 Ca 0.00 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 52.92 1rk7 n ASP 52 Cb 0.00 0.94 0.06 0.00 2.34 0.00 0.00 41.12 44.46 1rk7 n ASP 52 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1rk7 n ASN 53 N -1.26 7.54 0.00 1.67 3.02 -1.26 -4.24 115.26 120.73 1rk7 n ASN 53 Ca 0.00 -3.81 0.00 0.00 -0.03 0.00 0.00 54.58 50.74 1rk7 n ASN 53 Cb 0.00 -0.99 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 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 -0.77 0.00 0.00 3.41 5.66 -1.26 -5.08 114.28 116.23 1rk7 n THR 54 Ca 0.59 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.59 1rk7 n THR 54 Cb 0.51 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 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 -2.08 0.00 0.00 1.79 0.00 -1.26 -5.10 120.51 113.86 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 1.28 0.81 0.00 0.00 -1.26 -4.85 105.19 101.17 1rk7 n GLY 56 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1rk7 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk7 n THR 58 N -2.36 0.69 -1.36 0.00 -1.04 -1.26 -5.11 114.28 103.85 1rk7 n THR 58 Ca 0.00 0.30 0.00 0.00 -2.04 0.00 0.00 64.05 62.31 1rk7 n THR 58 Cb 0.00 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 66.72 1rk7 n THR 58 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1rk7 n SER 59 N -3.35 -1.81 0.00 8.00 2.88 -1.26 -5.08 113.62 113.01 1rk7 n SER 59 Ca -0.05 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1rk7 n SER 59 Cb 0.20 -0.90 -0.00 0.00 -0.75 0.00 0.00 64.21 62.76 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 -0.05 2.68 -3.11 -1.46 0.00 -1.26 -4.98 120.51 112.33 1rk7 n ALA 60 Ca 0.00 -0.04 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 1rk7 n ALA 60 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.44 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 3.28 2.51 3.58 0.00 0.00 -1.26 -5.05 105.19 108.25 1rk7 n GLY 61 Ca -0.00 -1.30 -0.36 0.00 0.00 0.00 0.00 46.02 44.36 1rk7 n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rk7 n PRO 62 N 1.23 2.42 -0.81 1.61 -0.04 -1.26 -4.33 135.00 133.81 1rk7 n PRO 62 Ca 0.19 -2.88 0.01 0.00 -0.04 0.00 0.00 63.50 60.78 1rk7 n PRO 62 Cb 0.57 -3.61 0.01 0.00 -0.04 0.00 0.00 33.50 30.42 1rk7 n PRO 62 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1rk7 n HIS 63 N 11.33 0.00 -2.71 0.54 -0.00 -1.26 -4.89 115.22 118.23 1rk7 n HIS 63 Ca 0.47 -0.16 -0.42 0.00 0.46 0.00 0.00 57.72 58.07 1rk7 n HIS 63 Cb 0.46 -0.06 -0.03 0.00 -0.12 0.00 0.00 29.99 30.23 1rk7 n HIS 63 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 1rk7 s PHE 64 N 0.00 2.66 0.14 1.57 0.08 -1.26 -4.97 117.98 116.21 1rk7 s PHE 64 Ca 0.10 0.14 0.05 0.00 0.12 0.00 0.00 56.93 57.34 1rk7 s PHE 64 Cb 0.12 -4.32 -0.04 0.00 -0.57 0.00 0.00 43.02 38.21 1rk7 s PHE 64 CO -0.05 -1.53 0.12 -0.80 -0.10 0.00 0.00 175.22 172.86 1rk7 s ASN 65 N 3.01 5.50 0.00 1.36 0.01 -1.26 -0.97 114.94 122.59 1rk7 s ASN 65 Ca 0.36 -0.11 0.22 0.00 -0.71 0.00 0.00 52.86 52.62 1rk7 s ASN 65 Cb -0.10 -1.44 1.05 0.00 0.41 0.00 0.00 41.25 41.17 1rk7 s ASN 65 CO 0.21 0.09 1.72 -0.81 -1.51 0.00 0.00 177.10 176.80 1rk7 n PRO 66 N -0.15 0.18 0.27 -0.60 -0.04 -1.26 -2.76 135.00 130.63 1rk7 n PRO 66 Ca -0.08 0.10 0.14 0.00 -0.04 0.00 0.00 63.50 63.61 1rk7 n PRO 66 Cb 0.54 -1.50 0.79 0.00 -0.04 0.00 0.00 33.50 33.29 1rk7 n PRO 66 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 1rk7 h LEU 67 N 0.00 0.00 -0.04 1.53 8.10 -1.94 -2.46 115.31 120.50 1rk7 h LEU 67 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1rk7 h LEU 67 Cb 0.29 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.50 1rk7 h LEU 67 CO 0.00 0.09 -0.00 0.28 -4.11 0.00 0.00 178.44 174.69 1rk7 h SER 68 N 0.00 0.08 -1.26 0.17 0.02 -1.91 -3.23 113.55 107.42 1rk7 h SER 68 Ca -0.00 -0.34 -0.75 0.00 -0.84 0.00 0.00 61.79 59.86 1rk7 h SER 68 Cb 0.29 -0.02 -0.14 0.00 0.14 0.00 0.00 62.40 62.67 1rk7 h SER 68 CO 0.01 0.40 2.28 -2.11 -1.14 0.00 0.00 176.83 176.27 1rk7 n ARG 69 N -4.87 4.54 -2.16 3.45 1.85 -0.93 0.50 116.66 119.03 1rk7 n ARG 69 Ca -0.07 -3.55 -0.41 0.00 -1.00 0.00 0.00 57.85 52.82 1rk7 n ARG 69 Cb 0.20 -2.65 -0.03 0.00 -1.05 0.00 0.00 32.46 28.93 1rk7 n ARG 69 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1rk7 s LYS 70 N -1.17 3.07 -0.03 2.89 -2.85 -1.22 -4.35 119.74 116.08 1rk7 s LYS 70 Ca 0.51 0.77 -0.03 0.00 -1.00 0.00 0.00 55.97 56.23 1rk7 s LYS 70 Cb 0.17 -4.24 0.01 0.00 -2.06 0.00 0.00 37.83 31.72 1rk7 s LYS 70 CO -0.08 -2.20 0.06 -2.39 0.10 0.00 0.00 175.35 170.84 1rk7 n HIS 71 N 10.90 -3.81 -0.63 1.78 1.44 0.51 -4.39 115.22 121.01 1rk7 n HIS 71 Ca 0.18 2.26 0.00 0.00 -2.01 0.00 0.00 57.72 58.15 1rk7 n HIS 71 Cb 0.50 -3.30 0.00 0.00 0.12 0.00 0.00 29.99 27.31 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 1.89 3.31 0.00 -1.39 0.00 -1.26 -4.03 105.19 103.72 1rk7 n GLY 72 Ca -0.10 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 0.41 2.45 -0.02 0.00 -1.26 -4.78 105.19 101.98 1rk7 n GLY 73 Ca 0.00 -1.22 -0.27 0.00 0.00 0.00 0.00 46.02 44.53 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 2.66 0.00 1.61 -0.04 -1.26 -2.49 135.00 135.49 1rk7 n PRO 74 Ca 0.00 -1.68 0.00 0.00 -0.04 0.00 0.00 63.50 61.78 1rk7 n PRO 74 Cb 0.00 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 30.93 1rk7 n PRO 74 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1rk7 n LYS 75 N 3.81 0.00 -2.53 0.54 3.00 -1.26 -5.09 118.16 116.63 1rk7 n LYS 75 Ca 0.57 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.86 1rk7 n LYS 75 Cb 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.24 1rk7 n LYS 75 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1rk7 n ASP 76 N 0.00 -5.52 -0.00 3.14 8.00 -1.04 -4.98 116.55 116.15 1rk7 n ASP 76 Ca 0.00 1.23 0.02 0.00 0.71 0.00 0.00 54.79 56.76 1rk7 n ASP 76 Cb 0.00 -4.76 -0.03 0.00 -0.02 0.00 0.00 41.12 36.31 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 0.83 3.11 -3.52 -1.24 4.07 -1.26 -4.99 120.64 117.65 1rk7 n GLU 77 Ca -0.10 -0.02 -0.10 0.00 -0.06 0.00 0.00 57.16 56.88 1rk7 n GLU 77 Cb 0.15 -0.90 -0.03 0.00 -0.06 0.00 0.00 31.44 30.60 1rk7 n GLU 77 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1rk7 s GLU 78 N -1.84 0.82 0.00 5.31 0.41 -1.26 -4.97 118.70 117.17 1rk7 s GLU 78 Ca 0.00 -0.14 0.00 0.00 -0.41 0.00 0.00 54.97 54.42 1rk7 s GLU 78 Cb 0.03 0.38 0.00 0.00 -1.78 0.00 0.00 34.13 32.76 1rk7 s GLU 78 CO 0.20 -0.32 0.00 2.89 -0.49 0.00 0.00 175.26 177.53 1rk7 n ARG 79 N 0.11 0.00 0.22 1.61 1.85 0.18 -4.25 116.66 116.38 1rk7 n ARG 79 Ca -0.11 0.00 0.13 0.00 -1.00 0.00 0.00 57.85 56.88 1rk7 n ARG 79 Cb 0.61 0.00 0.72 0.00 -1.05 0.00 0.00 32.46 32.73 1rk7 n ARG 79 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1rk7 h HIS 80 N 0.00 0.00 0.00 2.89 3.86 -1.86 0.34 115.15 120.38 1rk7 h HIS 80 Ca 0.00 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 1rk7 h HIS 80 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1rk7 h HIS 80 CO 0.00 0.00 -0.96 -0.24 0.86 0.00 0.00 177.93 177.59 1rk7 h VAL 81 N 0.00 1.39 0.00 2.45 3.04 -1.86 -3.47 116.25 117.79 1rk7 h VAL 81 Ca 0.00 -2.43 0.00 0.00 -1.01 0.00 0.00 66.70 63.26 1rk7 h VAL 81 Cb 0.19 2.42 0.00 0.00 -2.01 0.00 0.00 31.29 31.88 1rk7 h VAL 81 CO 0.00 0.73 0.00 0.61 -1.01 0.00 0.00 177.57 177.90 1rk7 n GLY 82 N 0.97 1.53 3.57 3.17 0.00 0.12 -5.04 105.19 109.50 1rk7 n GLY 82 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1rk7 n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rk7 s ASP 83 N -2.00 5.74 0.00 1.61 1.11 -1.25 -4.89 116.67 116.99 1rk7 s ASP 83 Ca 0.00 0.45 0.00 0.00 0.18 0.00 0.00 52.55 53.18 1rk7 s ASP 83 Cb 0.00 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.45 1rk7 s ASP 83 CO 0.00 -1.99 0.36 -0.11 1.18 0.00 0.00 175.17 174.62 1rk7 n LEU 84 N 10.99 0.94 0.00 1.23 7.94 -1.26 -4.75 117.00 132.09 1rk7 n LEU 84 Ca 0.17 0.41 0.00 0.00 -1.11 0.00 0.00 56.01 55.48 1rk7 n LEU 84 Cb 0.50 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.34 1rk7 n LEU 84 CO 0.71 -0.11 0.00 0.61 -1.11 0.00 0.00 177.39 177.49 1rk7 n GLY 85 N 0.59 3.49 3.33 -3.96 0.00 -1.26 -4.43 105.19 102.95 1rk7 n GLY 85 Ca 0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 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 1.06 0.07 0.39 1.61 -0.87 -1.26 -4.31 114.94 111.63 1rk7 s ASN 86 Ca 0.00 -1.00 0.04 0.00 -1.57 0.00 0.00 52.86 50.33 1rk7 s ASN 86 Cb 0.00 0.43 0.04 0.00 -0.02 0.00 0.00 41.25 41.70 1rk7 s ASN 86 CO 0.00 -0.90 0.35 1.33 -2.57 0.00 0.00 177.10 175.31 1rk7 n VAL 87 N -0.23 0.00 -3.72 1.60 0.24 -0.83 -4.99 118.33 110.40 1rk7 n VAL 87 Ca -0.05 -1.48 -0.13 0.00 -2.04 0.00 0.00 64.34 60.64 1rk7 n VAL 87 Cb 0.63 -0.28 -0.09 0.00 -1.47 0.00 0.00 33.84 32.63 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 -1.81 0.01 0.57 3.34 2.01 -1.26 -3.28 115.64 115.22 1rk7 s THR 88 Ca 0.26 -0.10 -0.07 0.00 0.31 0.00 0.00 61.69 62.10 1rk7 s THR 88 Cb -0.02 -0.62 -0.01 0.00 0.01 0.00 0.00 72.50 71.85 1rk7 s THR 88 CO 0.17 -0.05 0.89 0.00 -0.69 0.00 0.00 174.62 174.94 1rk7 s ALA 89 N -0.18 3.28 0.00 7.40 0.00 0.40 -4.40 121.76 128.26 1rk7 s ALA 89 Ca -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.40 1rk7 s ALA 89 Cb -0.03 -2.69 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1rk7 s ALA 89 CO 0.02 -0.66 0.00 -3.47 0.00 0.00 0.00 175.76 171.65 1rk7 n ASP 90 N -2.53 0.00 0.00 0.00 2.03 0.23 -4.23 116.55 112.05 1rk7 n ASP 90 Ca 0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.35 1rk7 n ASP 90 Cb 0.56 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 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 0.49 -0.86 -0.67 2.85 -1.26 -4.76 118.16 113.95 1rk7 n LYS 91 Ca 0.00 -0.62 -0.04 0.00 -1.05 0.00 0.00 58.31 56.60 1rk7 n LYS 91 Cb 0.00 -0.60 -0.04 0.00 -0.65 0.00 0.00 35.03 33.75 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 -0.09 -0.47 0.00 -5.58 9.92 -1.26 -4.71 116.55 114.37 1rk7 n ASP 92 Ca 0.00 -1.68 0.00 0.00 -0.53 0.00 0.00 54.79 52.58 1rk7 n ASP 92 Cb 0.42 0.13 0.00 0.00 -0.64 0.00 0.00 41.12 41.04 1rk7 n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1rk7 n GLY 93 N 0.04 2.84 3.16 0.44 0.00 -1.24 -4.48 105.19 105.95 1rk7 n GLY 93 Ca -0.15 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 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 -3.66 1.61 0.31 -1.26 -3.83 118.33 111.51 1rk7 n VAL 94 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.95 1rk7 n VAL 94 Cb 0.00 -0.46 -0.12 0.00 -0.91 0.00 0.00 33.84 32.35 1rk7 n VAL 94 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rk7 s ALA 95 N 7.60 3.30 0.10 3.52 0.00 -1.22 0.78 121.76 135.85 1rk7 s ALA 95 Ca 1.21 -1.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.86 1rk7 s ALA 95 Cb -1.21 -2.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 1rk7 s ALA 95 CO 0.49 -0.77 0.29 0.16 0.00 0.00 0.00 175.76 175.92 1rk7 s ASP 96 N 1.64 6.41 0.21 0.00 -4.77 -1.26 0.14 116.67 119.04 1rk7 s ASP 96 Ca 0.05 0.40 0.11 0.00 -3.30 0.00 0.00 52.55 49.81 1rk7 s ASP 96 Cb -0.17 -2.01 -0.05 0.00 -1.09 0.00 0.00 42.92 39.61 1rk7 s ASP 96 CO 0.07 0.11 -0.23 -0.69 0.70 0.00 0.00 175.17 175.13 1rk7 s VAL 97 N -1.60 2.33 -0.30 2.11 1.01 -0.02 -4.87 120.40 119.05 1rk7 s VAL 97 Ca 0.38 -2.11 -0.09 0.00 0.00 0.00 0.00 61.98 60.15 1rk7 s VAL 97 Cb -0.12 -2.14 0.23 0.00 0.00 0.00 0.00 36.38 34.34 1rk7 s VAL 97 CO 0.27 -0.20 1.20 -0.24 0.00 0.00 0.00 175.10 176.12 1rk7 n SER 98 N 0.06 -1.03 -4.24 3.32 2.88 -0.99 -2.73 113.62 110.89 1rk7 n SER 98 Ca -0.11 -0.65 -0.16 0.00 -1.33 0.00 0.00 58.87 56.63 1rk7 n SER 98 Cb 0.57 0.52 -0.10 0.00 -0.75 0.00 0.00 64.21 64.45 1rk7 n SER 98 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1rk7 s ILE 99 N 0.88 0.39 -0.28 2.46 1.01 0.62 -4.98 121.20 121.29 1rk7 s ILE 99 Ca 0.22 -2.00 0.01 0.00 0.00 0.00 0.00 60.65 58.88 1rk7 s ILE 99 Cb 0.16 -2.59 0.08 0.00 0.01 0.00 0.00 42.46 40.13 1rk7 s ILE 99 CO -0.11 0.00 0.02 -1.61 0.00 0.00 0.00 174.94 173.24 1rk7 s GLU 100 N -4.04 1.23 -0.44 2.79 2.02 -1.26 -0.69 118.70 118.32 1rk7 s GLU 100 Ca 0.38 -1.15 -0.25 0.00 0.02 0.00 0.00 54.97 53.96 1rk7 s GLU 100 Cb 0.07 -2.49 0.02 0.00 0.10 0.00 0.00 34.13 31.83 1rk7 s GLU 100 CO 0.14 -0.79 0.92 -0.51 0.02 0.00 0.00 175.26 175.04 1rk7 s ASP 101 N 1.40 6.53 0.00 -0.19 1.01 -0.72 -4.70 116.67 120.01 1rk7 s ASP 101 Ca 0.03 0.21 0.13 0.00 0.71 0.00 0.00 52.55 53.64 1rk7 s ASP 101 Cb -0.18 -2.45 0.38 0.00 1.01 0.00 0.00 42.92 41.68 1rk7 s ASP 101 CO -0.13 -1.01 1.32 -1.54 0.21 0.00 0.00 175.17 174.03 1rk7 n SER 102 N 7.07 2.29 0.00 0.27 3.41 -1.26 0.55 113.62 125.95 1rk7 n SER 102 Ca 0.06 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.68 1rk7 n SER 102 Cb 0.48 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 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 0.75 0.00 -0.70 -3.33 0.31 -1.26 -4.84 118.33 109.26 1rk7 n VAL 103 Ca 0.14 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.15 1rk7 n VAL 103 Cb 0.36 -0.85 0.16 0.00 -0.91 0.00 0.00 33.84 32.61 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 -1.27 0.00 -3.75 2.52 -6.64 -1.26 -4.94 119.36 104.01 1rk7 n ILE 104 Ca 0.00 -0.24 -0.01 0.00 -1.77 0.00 0.00 62.75 60.73 1rk7 n ILE 104 Cb 0.00 -0.70 -0.00 0.00 -1.44 0.00 0.00 39.64 37.50 1rk7 n ILE 104 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1rk7 s SER 105 N -2.07 -0.09 -0.61 7.28 1.04 -1.26 -4.64 113.70 113.35 1rk7 s SER 105 Ca 0.59 -0.36 -0.02 0.00 0.48 0.00 0.00 55.95 56.64 1rk7 s SER 105 Cb -0.19 0.36 0.39 0.00 0.10 0.00 0.00 66.02 66.69 1rk7 s SER 105 CO 0.66 -0.69 2.05 0.18 0.98 0.00 0.00 173.24 176.42 1rk7 n LEU 106 N -0.55 7.45 -4.79 2.42 4.32 -1.26 -0.76 117.00 123.82 1rk7 n LEU 106 Ca -0.06 -4.12 -0.23 0.00 -0.02 0.00 0.00 56.01 51.58 1rk7 n LEU 106 Cb 0.61 -1.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.35 1rk7 n LEU 106 CO 0.15 1.44 -0.10 -0.44 -1.22 0.00 0.00 177.39 177.22 1rk7 s SER 107 N -1.36 4.67 -0.44 -1.43 0.01 -1.26 -4.88 113.70 109.00 1rk7 s SER 107 Ca 0.58 -0.94 -0.06 0.00 1.31 0.00 0.00 55.95 56.83 1rk7 s SER 107 Cb 0.45 -0.53 -0.20 0.00 0.21 0.00 0.00 66.02 65.96 1rk7 s SER 107 CO -0.04 -0.57 3.16 0.61 0.41 0.00 0.00 173.24 176.82 1rk7 n GLY 108 N -1.34 3.16 2.03 3.44 0.00 -1.26 -2.08 105.19 109.14 1rk7 n GLY 108 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 2.90 -0.58 -0.11 1.61 2.03 -1.26 -4.98 116.55 116.16 1rk7 n ASP 109 Ca 0.48 0.15 -0.22 0.00 0.52 0.00 0.00 54.79 55.73 1rk7 n ASP 109 Cb 0.64 0.81 -0.09 0.00 -0.72 0.00 0.00 41.12 41.77 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 -2.69 0.44 -2.45 -0.67 8.25 -1.20 -5.07 115.22 111.82 1rk7 n HIS 110 Ca 0.00 0.19 -0.02 0.00 -0.26 0.00 0.00 57.72 57.63 1rk7 n HIS 110 Cb 0.00 -0.94 -0.01 0.00 1.12 0.00 0.00 29.99 30.15 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 -4.38 -5.16 0.04 0.41 3.41 0.06 -4.78 113.62 103.22 1rk7 n SER 111 Ca -0.37 1.50 -0.15 0.00 -0.26 0.00 0.00 58.87 59.59 1rk7 n SER 111 Cb 0.70 -4.31 -0.14 0.00 -0.26 0.00 0.00 64.21 60.21 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 4.30 1.05 -1.10 -1.33 3.07 -1.48 -3.45 117.51 118.56 1rk7 h ILE 112 Ca -0.17 -2.76 -0.76 0.00 1.55 0.00 0.00 64.86 62.72 1rk7 h ILE 112 Cb 0.39 2.65 0.06 0.00 -0.27 0.00 0.00 36.82 39.65 1rk7 h ILE 112 CO 0.00 0.77 0.07 -0.38 -1.05 0.00 0.00 178.15 177.55 1rk7 n ILE 113 N -3.36 0.18 -0.30 0.16 2.08 -1.26 0.15 119.36 117.02 1rk7 n ILE 113 Ca -0.17 -0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.09 1rk7 n ILE 113 Cb 1.04 -0.12 0.00 0.00 -0.75 0.00 0.00 39.64 39.81 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 1.67 0.66 2.51 7.39 0.00 -1.21 -4.97 105.19 111.25 1rk7 n GLY 114 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1rk7 n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk7 n ARG 115 N -2.00 4.60 -1.29 1.61 5.12 0.12 -4.79 116.66 120.03 1rk7 n ARG 115 Ca 0.00 -3.61 -0.38 0.00 -1.93 0.00 0.00 57.85 51.93 1rk7 n ARG 115 Cb 0.00 -2.57 0.04 0.00 -1.16 0.00 0.00 32.46 28.77 1rk7 n ARG 115 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1rk7 n THR 116 N 1.32 1.18 -2.77 0.55 5.66 -1.26 -4.40 114.28 114.56 1rk7 n THR 116 Ca 0.59 -0.47 -0.38 0.00 -3.05 0.00 0.00 64.05 60.74 1rk7 n THR 116 Cb 0.27 -0.42 0.00 0.00 -1.55 0.00 0.00 70.33 68.63 1rk7 n THR 116 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1rk7 n LEU 117 N 1.17 6.57 -4.69 1.09 -0.00 -1.26 -3.86 117.00 116.03 1rk7 n LEU 117 Ca 0.09 -5.43 -0.29 0.00 -0.00 0.00 0.00 56.01 50.38 1rk7 n LEU 117 Cb 0.49 -1.05 0.18 0.00 -0.00 0.00 0.00 43.42 43.04 1rk7 n LEU 117 CO 0.52 2.07 0.66 0.68 -0.00 0.00 0.00 177.39 181.32 1rk7 s VAL 118 N -4.11 1.93 0.05 1.96 -7.23 -1.26 -4.69 120.40 107.04 1rk7 s VAL 118 Ca 0.40 0.00 -0.03 0.00 -1.81 0.00 0.00 61.98 60.54 1rk7 s VAL 118 Cb 0.19 -2.57 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 1rk7 s VAL 118 CO -0.10 0.00 0.02 0.68 -0.31 0.00 0.00 175.10 175.39 1rk7 s VAL 119 N -3.08 0.19 0.71 1.32 -7.23 -1.01 -2.03 120.40 109.27 1rk7 s VAL 119 Ca 0.66 -1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 59.21 1rk7 s VAL 119 Cb -0.16 -1.31 0.06 0.00 0.56 0.00 0.00 36.38 35.54 1rk7 s VAL 119 CO 0.56 -0.86 1.03 -1.00 -0.31 0.00 0.00 175.10 174.52 1rk7 s HIS 120 N -3.54 2.93 -0.28 2.82 3.76 -0.85 0.21 115.29 120.34 1rk7 s HIS 120 Ca 0.03 0.47 0.19 0.00 -0.15 0.00 0.00 55.06 55.61 1rk7 s HIS 120 Cb 0.05 -3.21 0.15 0.00 1.11 0.00 0.00 32.58 30.69 1rk7 s HIS 120 CO -0.09 -1.42 1.43 1.49 -0.85 0.00 0.00 174.74 175.30 1rk7 h GLU 121 N -0.62 0.00 -3.31 1.40 4.81 -1.68 -3.43 114.58 111.75 1rk7 h GLU 121 Ca -0.45 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.76 1rk7 h GLU 121 Cb 1.32 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.59 1rk7 h GLU 121 CO 0.61 0.24 0.02 0.21 -0.73 0.00 0.00 179.01 179.36 1rk7 s LYS 122 N -3.09 1.31 1.09 1.92 2.36 -1.26 -5.02 119.74 117.05 1rk7 s LYS 122 Ca 0.04 -0.81 -0.20 0.00 -2.55 0.00 0.00 55.97 52.45 1rk7 s LYS 122 Cb 0.07 0.51 0.05 0.00 -1.05 0.00 0.00 37.83 37.41 1rk7 s LYS 122 CO 0.72 -0.55 -0.25 0.00 1.55 0.00 0.00 175.35 176.83 1rk7 n ALA 123 N -0.32 -4.39 0.00 3.13 0.00 -0.98 -3.21 120.51 114.74 1rk7 n ALA 123 Ca -0.12 -1.27 0.00 0.00 0.00 0.00 0.00 53.44 52.05 1rk7 n ALA 123 Cb 0.63 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1rk7 n ALA 123 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1rk7 n ASP 124 N -0.74 0.00 0.00 0.00 5.75 -1.26 -4.43 116.55 115.87 1rk7 n ASP 124 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1rk7 n ASP 124 Cb 0.64 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1rk7 n ASP 125 N 0.00 0.00 -0.36 -1.12 9.92 -1.25 -4.53 116.55 119.20 1rk7 n ASP 125 Ca 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.24 1rk7 n ASP 125 Cb 0.00 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.50 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 -0.65 0.00 0.64 7.99 -1.26 -4.59 117.00 119.13 1rk7 n LEU 126 Ca 0.00 1.64 0.00 0.00 -0.01 0.00 0.00 56.01 57.64 1rk7 n LEU 126 Cb 0.00 -0.36 0.00 0.00 -0.11 0.00 0.00 43.42 42.95 1rk7 n LEU 126 CO 0.00 -1.46 0.00 0.61 -1.51 0.00 0.00 177.39 175.03 1rk7 n GLY 127 N -1.42 0.73 0.35 -0.72 0.00 -1.26 -4.93 105.19 97.94 1rk7 n GLY 127 Ca 0.09 -0.64 0.18 0.00 0.00 0.00 0.00 46.02 45.64 1rk7 n GLY 127 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1rk7 h LYS 128 N 0.00 0.00 0.00 1.61 2.10 -1.95 -3.42 116.57 114.92 1rk7 h LYS 128 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1rk7 h LYS 128 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1rk7 h LYS 128 CO 0.00 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.86 1rk7 n GLY 129 N -1.34 0.41 0.00 0.07 0.00 -1.26 -5.09 105.19 97.97 1rk7 n GLY 129 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 1.05 3.14 -0.02 0.00 -1.26 -5.07 105.19 103.03 1rk7 n GLY 130 Ca 0.00 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 0.00 0.53 1.61 3.84 -1.26 -4.83 114.94 114.84 1rk7 s ASN 131 Ca 0.00 -0.21 0.43 0.00 0.21 0.00 0.00 52.86 53.29 1rk7 s ASN 131 Cb 0.00 0.24 1.48 0.00 -0.55 0.00 0.00 41.25 42.42 1rk7 s ASN 131 CO 0.00 -0.43 1.41 -0.62 -2.79 0.00 0.00 177.10 174.67 1rk7 n GLU 132 N 1.22 0.00 -0.10 0.43 1.02 -1.26 0.29 120.64 122.24 1rk7 n GLU 132 Ca -0.22 1.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.74 1rk7 n GLU 132 Cb 0.56 -2.35 -0.09 0.00 -0.02 0.00 0.00 31.44 29.54 1rk7 n GLU 132 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1rk7 n GLN 133 N -3.66 0.54 0.06 3.49 7.27 -1.26 -4.03 117.38 119.79 1rk7 n GLN 133 Ca 0.38 0.57 -0.13 0.00 0.07 0.00 0.00 57.00 57.89 1rk7 n GLN 133 Cb 1.81 -1.74 -0.08 0.00 2.41 0.00 0.00 30.24 32.64 1rk7 n GLN 133 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1rk7 h SER 134 N -1.00 -0.11 -0.72 1.69 0.87 0.05 0.82 113.55 115.15 1rk7 h SER 134 Ca -0.28 -0.18 0.21 0.00 -1.23 0.00 0.00 61.79 60.31 1rk7 h SER 134 Cb 1.15 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1rk7 h SER 134 CO -0.17 0.12 0.90 0.00 -0.53 0.00 0.00 176.83 177.15 1rk7 h THR 135 N -0.33 0.13 0.00 2.23 1.03 0.41 1.18 112.91 117.55 1rk7 h THR 135 Ca -0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.08 1rk7 h THR 135 Cb 0.28 0.26 -0.06 0.00 -1.07 0.00 0.00 68.15 67.56 1rk7 h THR 135 CO 0.02 0.00 -2.17 0.29 -0.01 0.00 0.00 175.52 173.65 1rk7 n LYS 136 N -3.35 1.20 0.00 0.00 4.76 -0.84 0.19 118.16 120.11 1rk7 n LYS 136 Ca 0.15 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1rk7 n LYS 136 Cb 1.14 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.89 1rk7 n LYS 136 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1rk7 n THR 137 N -2.64 0.00 0.00 -0.18 -2.24 0.41 -4.84 114.28 104.78 1rk7 n THR 137 Ca -0.28 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1rk7 n THR 137 Cb 1.05 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 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 0.65 0.00 2.51 3.38 0.00 -1.17 -3.91 105.19 106.64 1rk7 n GLY 138 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -5.00 -2.86 1.61 2.85 -1.26 -4.59 115.26 106.01 1rk7 n ASN 139 Ca 0.00 0.40 -0.12 0.00 -0.11 0.00 0.00 54.58 54.75 1rk7 n ASN 139 Cb 0.00 -4.24 0.03 0.00 1.24 0.00 0.00 39.78 36.81 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 1.10 -0.44 -3.61 5.20 0.00 -1.26 -5.08 120.51 116.42 1rk7 n ALA 140 Ca -0.16 -1.89 -0.39 0.00 0.00 0.00 0.00 53.44 50.99 1rk7 n ALA 140 Cb 0.59 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.57 2.35 -0.47 0.00 0.00 -1.26 -4.30 107.32 102.07 1rk7 s GLY 141 Ca 0.32 -2.99 0.06 0.00 0.00 0.00 0.00 44.72 42.11 1rk7 s GLY 141 CO -0.20 1.12 0.59 1.44 0.00 0.00 0.00 173.10 176.06 1rk7 n SER 142 N 4.09 -2.11 -4.21 1.64 7.64 -1.26 -4.99 113.62 114.42 1rk7 n SER 142 Ca 0.03 -2.74 -0.36 0.00 1.01 0.00 0.00 58.87 56.81 1rk7 n SER 142 Cb 0.41 0.78 0.06 0.00 -1.01 0.00 0.00 64.21 64.45 1rk7 n SER 142 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1rk7 n ARG 143 N 2.68 -0.03 -3.89 1.43 0.00 -1.26 -2.31 116.66 113.28 1rk7 n ARG 143 Ca 0.22 0.01 -0.10 0.00 -0.00 0.00 0.00 57.85 57.98 1rk7 n ARG 143 Cb 0.54 -1.35 -0.09 0.00 -0.00 0.00 0.00 32.46 31.55 1rk7 n ARG 143 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1rk7 s LEU 144 N 3.97 1.64 0.39 2.89 1.43 0.57 -4.79 118.68 124.77 1rk7 s LEU 144 Ca 0.51 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1rk7 s LEU 144 Cb -0.25 0.72 0.00 0.00 0.03 0.00 0.00 46.19 46.68 1rk7 s LEU 144 CO 0.73 -0.50 0.00 0.00 0.23 0.00 0.00 176.35 176.81 1rk7 n ALA 145 N 0.86 -3.35 -2.86 4.21 0.00 -1.26 -2.41 120.51 115.70 1rk7 n ALA 145 Ca -0.20 0.56 -0.11 0.00 0.00 0.00 0.00 53.44 53.70 1rk7 n ALA 145 Cb 0.58 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.80 1rk7 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk7 h GLY 147 N 4.14 -0.35 -3.02 0.00 0.00 -1.79 -3.41 103.07 98.63 1rk7 h GLY 147 Ca -0.08 0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.62 1rk7 h GLY 147 CO 0.33 -0.21 -0.70 -0.62 0.00 0.00 0.00 176.54 175.34 1rk7 n VAL 148 N -5.40 -4.94 -2.60 4.60 0.31 -1.26 -3.78 118.33 105.26 1rk7 n VAL 148 Ca -0.02 1.98 -0.43 0.00 -0.01 0.00 0.00 64.34 65.85 1rk7 n VAL 148 Cb 0.31 -2.93 -0.02 0.00 -0.91 0.00 0.00 33.84 30.29 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 -1.62 4.58 -0.11 2.52 -1.09 -1.26 -3.83 121.20 120.38 1rk7 s ILE 149 Ca 0.00 1.90 0.02 0.00 -2.23 0.00 0.00 60.65 60.34 1rk7 s ILE 149 Cb 0.00 -4.23 0.01 0.00 -1.58 0.00 0.00 42.46 36.66 1rk7 s ILE 149 CO 0.00 -0.15 -0.17 -0.83 -1.23 0.00 0.00 174.94 172.55 1rk7 s GLY 150 N 1.39 1.12 0.30 6.18 0.00 0.25 -3.31 107.32 113.25 1rk7 s GLY 150 Ca 0.47 -0.81 -0.27 0.00 0.00 0.00 0.00 44.72 44.12 1rk7 s GLY 150 CO 0.09 0.12 0.84 1.39 0.00 0.00 0.00 173.10 175.54 1rk7 n ILE 151 N 4.08 1.99 -4.24 0.90 2.08 -1.26 0.01 119.36 122.91 1rk7 n ILE 151 Ca -0.19 -0.50 -0.14 0.00 0.56 0.00 0.00 62.75 62.48 1rk7 n ILE 151 Cb 0.51 -0.74 -0.10 0.00 -0.75 0.00 0.00 39.64 38.57 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 -1.13 1.40 -0.87 -1.39 0.00 -0.41 -4.72 121.76 114.65 1rk7 s ALA 152 Ca 0.61 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1rk7 s ALA 152 Cb -0.72 1.29 0.00 0.00 0.00 0.00 0.00 23.12 23.69 1rk7 s ALA 152 CO 0.59 -0.56 0.22 0.94 0.00 0.00 0.00 175.76 176.95