#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 0.04 -0.40 0.00 2.01 -1.26 -4.88 115.64 111.15 1rk7 s THR 2 Ca 0.00 -1.28 -0.01 0.00 0.31 0.00 0.00 61.69 60.71 1rk7 s THR 2 Cb 0.00 -1.88 0.11 0.00 0.01 0.00 0.00 72.50 70.74 1rk7 s THR 2 CO 0.00 -0.19 0.17 -0.75 -0.69 0.00 0.00 174.62 173.17 1rk7 s LYS 3 N -3.96 1.87 0.70 4.92 2.20 -1.24 -2.03 119.74 122.20 1rk7 s LYS 3 Ca 0.17 -1.90 -0.07 0.00 -0.36 0.00 0.00 55.97 53.81 1rk7 s LYS 3 Cb 0.02 -3.47 0.06 0.00 -1.51 0.00 0.00 37.83 32.92 1rk7 s LYS 3 CO 0.02 -1.04 1.02 0.00 -0.36 0.00 0.00 175.35 174.99 1rk7 s ALA 4 N 0.97 3.12 -0.06 3.13 0.00 0.32 -2.30 121.76 126.94 1rk7 s ALA 4 Ca 0.10 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 51.08 1rk7 s ALA 4 Cb -0.22 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 20.28 1rk7 s ALA 4 CO -0.05 -1.28 0.27 0.14 0.00 0.00 0.00 175.76 174.84 1rk7 s VAL 5 N -3.26 0.04 -0.24 0.00 -7.23 0.27 0.15 120.40 110.13 1rk7 s VAL 5 Ca 0.60 -0.29 -0.04 0.00 -1.81 0.00 0.00 61.98 60.44 1rk7 s VAL 5 Cb -0.11 -0.49 0.08 0.00 0.56 0.00 0.00 36.38 36.42 1rk7 s VAL 5 CO 0.45 -0.16 0.10 0.00 -0.31 0.00 0.00 175.10 175.18 1rk7 s ALA 6 N -0.65 0.71 -1.03 1.32 0.00 0.91 0.12 121.76 123.14 1rk7 s ALA 6 Ca -0.07 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 50.84 1rk7 s ALA 6 Cb -0.04 -1.27 0.09 0.00 0.00 0.00 0.00 23.12 21.90 1rk7 s ALA 6 CO 0.02 -1.43 1.36 0.08 0.00 0.00 0.00 175.76 175.79 1rk7 s VAL 7 N 2.02 4.33 0.41 0.00 1.01 -1.21 0.14 120.40 127.11 1rk7 s VAL 7 Ca 0.05 -1.34 -0.21 0.00 0.00 0.00 0.00 61.98 60.49 1rk7 s VAL 7 Cb -0.16 -4.96 -0.15 0.00 0.00 0.00 0.00 36.38 31.11 1rk7 s VAL 7 CO -0.22 -1.76 0.12 0.18 0.00 0.00 0.00 175.10 173.41 1rk7 n LEU 8 N 7.71 -2.61 -3.61 3.92 7.99 0.52 -4.35 117.00 126.56 1rk7 n LEU 8 Ca 0.32 0.81 0.01 0.00 -0.01 0.00 0.00 56.01 57.14 1rk7 n LEU 8 Cb 0.49 -0.91 -0.06 0.00 -0.11 0.00 0.00 43.42 42.84 1rk7 n LEU 8 CO 0.61 -4.11 0.92 -1.59 -1.51 0.00 0.00 177.39 171.71 1rk7 s LYS 9 N -1.07 0.12 0.00 3.23 -2.85 -1.05 -3.66 119.74 114.47 1rk7 s LYS 9 Ca 0.60 0.22 0.00 0.00 -1.00 0.00 0.00 55.97 55.79 1rk7 s LYS 9 Cb -0.62 0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.18 1rk7 s LYS 9 CO 0.62 -0.03 0.00 0.41 0.10 0.00 0.00 175.35 176.46 1rk7 n GLY 10 N 3.37 -2.18 0.43 0.59 0.00 -1.25 -0.79 105.19 105.35 1rk7 n GLY 10 Ca -0.17 0.81 0.37 0.00 0.00 0.00 0.00 46.02 47.03 1rk7 n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rk7 n ASP 11 N 0.00 0.20 0.00 1.61 2.03 -0.95 -4.78 116.55 114.66 1rk7 n ASP 11 Ca 0.00 1.27 0.00 0.00 0.52 0.00 0.00 54.79 56.58 1rk7 n ASP 11 Cb 0.00 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.77 1rk7 n ASP 11 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rk7 n GLY 12 N -1.47 2.62 0.18 0.27 0.00 -1.26 -4.89 105.19 100.64 1rk7 n GLY 12 Ca 0.37 -0.49 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 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 0.53 -5.23 1.61 0.13 -1.86 -3.41 132.00 123.77 1rk7 h PRO 13 Ca 0.00 -0.51 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 1rk7 h PRO 13 Cb 0.00 0.13 -0.03 0.00 0.13 0.00 0.00 31.00 31.24 1rk7 h PRO 13 CO 0.00 1.14 0.48 0.28 -0.23 0.00 0.00 178.00 179.68 1rk7 n VAL 14 N -3.82 0.00 -1.65 1.56 0.31 -1.09 -4.28 118.33 109.37 1rk7 n VAL 14 Ca -0.07 -0.45 -0.16 0.00 -0.01 0.00 0.00 64.34 63.65 1rk7 n VAL 14 Cb 0.80 -1.49 0.12 0.00 -0.91 0.00 0.00 33.84 32.36 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 7.87 2.60 -0.85 5.55 7.27 0.14 -2.53 117.38 137.43 1rk7 n GLN 15 Ca 0.49 -3.57 -0.34 0.00 0.07 0.00 0.00 57.00 53.65 1rk7 n GLN 15 Cb 0.37 -2.06 0.10 0.00 2.41 0.00 0.00 30.24 31.06 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 -0.94 -2.98 2.65 1.69 0.00 -1.24 -4.43 105.19 99.94 1rk7 n GLY 16 Ca 0.42 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.20 -0.20 0.24 -0.61 1.01 0.96 0.19 121.20 120.60 1rk7 s ILE 17 Ca 0.49 -0.35 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1rk7 s ILE 17 Cb -0.14 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 1rk7 s ILE 17 CO 0.71 -0.40 0.38 0.27 0.00 0.00 0.00 174.94 175.90 1rk7 s ILE 18 N 2.21 5.25 -0.13 2.92 -5.25 0.12 -1.99 121.20 124.34 1rk7 s ILE 18 Ca 0.06 -0.89 -0.04 0.00 -0.99 0.00 0.00 60.65 58.79 1rk7 s ILE 18 Cb -0.16 -3.85 0.06 0.00 2.95 0.00 0.00 42.46 41.47 1rk7 s ILE 18 CO -0.21 -0.33 0.18 0.20 -1.79 0.00 0.00 174.94 173.00 1rk7 s ASN 19 N -3.90 0.97 -0.69 4.36 0.01 0.13 -0.06 114.94 115.75 1rk7 s ASN 19 Ca 0.35 0.16 -0.18 0.00 -0.71 0.00 0.00 52.86 52.48 1rk7 s ASN 19 Cb -0.09 0.32 0.13 0.00 0.41 0.00 0.00 41.25 42.02 1rk7 s ASN 19 CO 0.30 -0.27 0.78 -0.36 -1.51 0.00 0.00 177.10 176.03 1rk7 s PHE 20 N 2.31 3.17 -0.22 2.20 0.40 0.12 -3.44 117.98 122.52 1rk7 s PHE 20 Ca 0.04 -1.24 -0.06 0.00 -0.60 0.00 0.00 56.93 55.07 1rk7 s PHE 20 Cb -0.13 -4.02 -0.03 0.00 0.51 0.00 0.00 43.02 39.36 1rk7 s PHE 20 CO -0.08 -1.26 0.03 -2.00 0.70 0.00 0.00 175.22 172.61 1rk7 s GLU 21 N 2.17 3.64 -0.41 0.44 -6.30 -1.02 0.12 118.70 117.33 1rk7 s GLU 21 Ca 0.16 -0.50 0.11 0.00 -2.50 0.00 0.00 54.97 52.23 1rk7 s GLU 21 Cb -0.19 -3.17 0.36 0.00 0.00 0.00 0.00 34.13 31.13 1rk7 s GLU 21 CO 0.01 -0.06 0.80 0.94 0.02 0.00 0.00 175.26 176.96 1rk7 n GLN 22 N 4.48 1.51 -0.99 4.30 7.27 -0.86 0.74 117.38 133.83 1rk7 n GLN 22 Ca -0.17 -3.71 -0.31 0.00 0.07 0.00 0.00 57.00 52.88 1rk7 n GLN 22 Cb 0.52 -1.81 -0.03 0.00 2.41 0.00 0.00 30.24 31.33 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 0.13 2.24 0.03 3.69 5.02 -1.26 0.24 118.16 128.25 1rk7 n LYS 23 Ca 0.26 -1.74 0.00 0.00 -2.02 0.00 0.00 58.31 54.81 1rk7 n LYS 23 Cb 0.61 -2.67 0.00 0.00 -0.02 0.00 0.00 35.03 32.95 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 4.90 0.00 0.00 1.97 -0.58 -1.26 -4.59 120.64 121.08 1rk7 n GLU 24 Ca 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.25 1rk7 n GLU 24 Cb 0.23 -0.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.91 1rk7 n GLU 24 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1rk7 n SER 25 N -2.89 0.00 -0.84 1.62 2.88 -1.23 -4.57 113.62 108.59 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 0.14 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.56 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 -0.44 -2.39 -3.46 2.85 -1.26 -5.02 115.26 105.55 1rk7 n ASN 26 Ca 0.00 -1.65 -0.11 0.00 -0.11 0.00 0.00 54.58 52.71 1rk7 n ASN 26 Cb 0.00 0.12 -0.03 0.00 1.24 0.00 0.00 39.78 41.11 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 0.04 3.64 3.81 8.20 0.00 -1.26 -5.15 105.19 114.47 1rk7 n GLY 27 Ca -0.14 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.64 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 -2.69 3.17 -0.24 1.61 0.04 -1.26 -4.82 135.00 130.81 1rk7 s PRO 28 Ca 0.13 1.06 -0.21 0.00 0.04 0.00 0.00 61.00 62.01 1rk7 s PRO 28 Cb 0.01 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 1rk7 s PRO 28 CO 0.09 -0.92 0.67 0.08 0.04 0.00 0.00 177.00 176.96 1rk7 s VAL 29 N -2.77 4.96 -0.87 -0.36 1.01 0.29 -4.75 120.40 117.91 1rk7 s VAL 29 Ca 0.60 1.24 -0.25 0.00 0.00 0.00 0.00 61.98 63.58 1rk7 s VAL 29 Cb -0.15 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1rk7 s VAL 29 CO 0.46 0.02 1.93 -0.75 0.00 0.00 0.00 175.10 176.76 1rk7 s LYS 30 N 2.47 2.57 -0.27 2.72 2.20 0.23 -1.65 119.74 128.01 1rk7 s LYS 30 Ca 0.29 -0.18 -0.21 0.00 -0.36 0.00 0.00 55.97 55.50 1rk7 s LYS 30 Cb -0.16 -4.98 -0.01 0.00 -1.51 0.00 0.00 37.83 31.17 1rk7 s LYS 30 CO 0.09 -3.30 0.68 0.08 -0.36 0.00 0.00 175.35 172.54 1rk7 s VAL 31 N 9.95 4.93 0.16 4.02 1.01 0.29 -2.43 120.40 138.33 1rk7 s VAL 31 Ca 0.70 1.17 -0.23 0.00 0.00 0.00 0.00 61.98 63.62 1rk7 s VAL 31 Cb -0.07 -4.00 0.07 0.00 0.00 0.00 0.00 36.38 32.37 1rk7 s VAL 31 CO 0.02 -0.05 0.59 -1.66 0.00 0.00 0.00 175.10 174.00 1rk7 s TRP 32 N 2.64 -0.51 -0.14 5.22 -2.14 -1.22 0.88 118.94 123.66 1rk7 s TRP 32 Ca 0.28 0.28 0.00 0.00 2.66 0.00 0.00 56.10 59.32 1rk7 s TRP 32 Cb -0.15 0.55 0.00 0.00 -3.10 0.00 0.00 33.47 30.77 1rk7 s TRP 32 CO 0.09 -0.86 0.00 0.41 -2.66 0.00 0.00 176.95 173.93 1rk7 n GLY 33 N -0.38 -0.75 3.49 3.67 0.00 -1.18 -0.69 105.19 109.35 1rk7 n GLY 33 Ca -0.16 -0.66 -0.06 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.77 0.65 1.61 1.04 -0.84 -2.22 113.70 109.18 1rk7 s SER 34 Ca 0.00 1.30 -0.08 0.00 0.48 0.00 0.00 55.95 57.65 1rk7 s SER 34 Cb 0.00 1.58 0.02 0.00 0.10 0.00 0.00 66.02 67.72 1rk7 s SER 34 CO 0.00 -0.22 0.99 -0.63 0.98 0.00 0.00 173.24 174.35 1rk7 s ILE 35 N 2.26 3.24 -0.32 -1.02 1.09 0.35 -0.03 121.20 126.77 1rk7 s ILE 35 Ca -0.06 0.06 0.03 0.00 -1.10 0.00 0.00 60.65 59.58 1rk7 s ILE 35 Cb -0.10 -3.34 0.16 0.00 -1.06 0.00 0.00 42.46 38.12 1rk7 s ILE 35 CO -0.17 -0.38 0.43 -0.54 -0.10 0.00 0.00 174.94 174.18 1rk7 s LYS 36 N -5.16 0.52 0.00 2.79 1.02 -1.26 -3.34 119.74 114.30 1rk7 s LYS 36 Ca 0.57 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.38 1rk7 s LYS 36 Cb -0.11 -0.36 0.00 0.00 -0.52 0.00 0.00 37.83 36.84 1rk7 s LYS 36 CO 0.47 -1.10 0.00 0.41 -0.92 0.00 0.00 175.35 174.21 1rk7 n GLY 37 N 4.96 2.12 0.17 -3.33 0.00 -1.26 -0.68 105.19 107.17 1rk7 n GLY 37 Ca 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.96 0.99 7.99 -1.26 -4.83 117.00 115.94 1rk7 n LEU 38 Ca 0.00 -0.03 -0.14 0.00 -0.01 0.00 0.00 56.01 55.83 1rk7 n LEU 38 Cb 0.00 -0.05 -0.13 0.00 -0.11 0.00 0.00 43.42 43.13 1rk7 n LEU 38 CO 0.00 -1.39 -0.39 0.42 -1.51 0.00 0.00 177.39 174.52 1rk7 s THR 39 N -0.73 0.30 -0.95 -5.08 -4.23 -1.26 -3.75 115.64 99.94 1rk7 s THR 39 Ca 0.02 -0.39 -0.26 0.00 -1.18 0.00 0.00 61.69 59.89 1rk7 s THR 39 Cb -0.00 -0.30 -0.23 0.00 1.34 0.00 0.00 72.50 73.31 1rk7 s THR 39 CO 0.02 -0.07 2.48 1.21 -0.54 0.00 0.00 174.62 177.72 1rk7 n GLU 40 N 2.58 0.00 0.00 3.99 0.00 -1.26 -4.42 120.64 121.53 1rk7 n GLU 40 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.00 1rk7 n GLU 40 Cb 0.58 -1.34 0.00 0.00 0.00 0.00 0.00 31.44 30.67 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 6.02 0.01 3.78 8.31 0.00 -1.26 -4.92 105.19 117.13 1rk7 n GLY 41 Ca 0.63 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 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 4.10 -0.01 0.99 1.43 -1.26 -1.10 118.68 122.83 1rk7 s LEU 42 Ca 0.00 2.05 -0.20 0.00 -1.03 0.00 0.00 54.13 54.95 1rk7 s LEU 42 Cb 0.00 -4.23 0.04 0.00 0.03 0.00 0.00 46.19 42.03 1rk7 s LEU 42 CO 0.00 -0.56 0.43 -1.38 0.23 0.00 0.00 176.35 175.07 1rk7 s HIS 43 N -1.68 -0.33 0.57 0.29 -3.43 0.47 -3.61 115.29 107.57 1rk7 s HIS 43 Ca 0.59 0.49 -0.10 0.00 -0.80 0.00 0.00 55.06 55.24 1rk7 s HIS 43 Cb -0.22 0.21 -0.04 0.00 -1.43 0.00 0.00 32.58 31.10 1rk7 s HIS 43 CO 0.27 -0.49 0.95 0.20 -2.00 0.00 0.00 174.74 173.67 1rk7 s GLY 44 N -1.45 1.65 -0.31 -1.38 0.00 0.16 0.03 107.32 106.02 1rk7 s GLY 44 Ca -0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 44.72 44.38 1rk7 s GLY 44 CO 0.04 0.05 0.87 -0.12 0.00 0.00 0.00 173.10 173.93 1rk7 s PHE 45 N -2.99 -1.01 0.18 1.90 5.36 -1.25 -1.63 117.98 118.54 1rk7 s PHE 45 Ca 0.53 0.48 -0.23 0.00 -0.96 0.00 0.00 56.93 56.75 1rk7 s PHE 45 Cb -0.11 0.18 0.07 0.00 -0.34 0.00 0.00 43.02 42.82 1rk7 s PHE 45 CO 0.49 -0.61 1.00 -3.38 -1.46 0.00 0.00 175.22 171.27 1rk7 s HIS 46 N 2.65 0.00 -0.43 10.12 -3.43 0.90 -4.79 115.29 120.32 1rk7 s HIS 46 Ca 0.19 -0.38 -0.18 0.00 -0.80 0.00 0.00 55.06 53.89 1rk7 s HIS 46 Cb -0.04 0.68 0.03 0.00 -1.43 0.00 0.00 32.58 31.82 1rk7 s HIS 46 CO -0.21 -0.91 0.51 0.08 -2.00 0.00 0.00 174.74 172.21 1rk7 s VAL 47 N -2.57 4.99 -0.27 -5.38 1.01 -1.20 0.94 120.40 117.93 1rk7 s VAL 47 Ca 0.18 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 1rk7 s VAL 47 Cb -0.02 -4.11 0.15 0.00 0.00 0.00 0.00 36.38 32.39 1rk7 s VAL 47 CO 0.04 -0.51 0.40 -2.28 0.00 0.00 0.00 175.10 172.75 1rk7 s HIS 48 N 2.37 -0.93 -0.23 5.22 5.65 -1.26 -3.51 115.29 122.59 1rk7 s HIS 48 Ca 0.15 0.61 -0.03 0.00 0.25 0.00 0.00 55.06 56.05 1rk7 s HIS 48 Cb -0.16 -0.05 0.12 0.00 -1.18 0.00 0.00 32.58 31.31 1rk7 s HIS 48 CO 0.15 -0.85 0.33 -2.00 -0.65 0.00 0.00 174.74 171.71 1rk7 s GLU 49 N 2.55 0.30 0.00 2.88 2.12 -1.26 -4.98 118.70 120.31 1rk7 s GLU 49 Ca 0.12 0.39 0.00 0.00 0.36 0.00 0.00 54.97 55.84 1rk7 s GLU 49 Cb -0.14 -0.71 0.00 0.00 0.26 0.00 0.00 34.13 33.54 1rk7 s GLU 49 CO -0.23 -0.67 0.15 0.39 -0.54 0.00 0.00 175.26 174.36 1rk7 n GLU 50 N 5.35 0.00 0.00 4.30 4.71 -1.26 -1.52 120.64 132.22 1rk7 n GLU 50 Ca -0.04 0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 1rk7 n GLU 50 Cb 0.50 -0.65 0.00 0.00 -1.01 0.00 0.00 31.44 30.28 1rk7 n GLU 50 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1rk7 n GLU 51 N -0.18 0.00 -2.88 3.49 1.02 -1.26 -3.06 120.64 117.77 1rk7 n GLU 51 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1rk7 n GLU 51 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 1rk7 n GLU 51 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1rk7 n ASP 52 N -0.82 -7.88 -3.36 1.62 9.92 -1.26 -4.76 116.55 110.00 1rk7 n ASP 52 Ca 0.00 0.51 -0.33 0.00 -0.53 0.00 0.00 54.79 54.43 1rk7 n ASP 52 Cb 0.00 -5.28 -0.02 0.00 -0.64 0.00 0.00 41.12 35.18 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 -0.32 5.51 0.00 -2.24 4.13 -1.26 -4.53 115.26 116.56 1rk7 n ASN 53 Ca 0.11 -3.62 0.00 0.00 1.68 0.00 0.00 54.58 52.75 1rk7 n ASN 53 Cb 0.47 -0.85 0.00 0.00 -1.54 0.00 0.00 39.78 37.86 1rk7 n ASN 53 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 1rk7 n THR 54 N 0.17 0.00 0.00 3.41 5.66 -1.26 -5.12 114.28 117.13 1rk7 n THR 54 Ca 0.35 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.35 1rk7 n THR 54 Cb 0.35 -0.22 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 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 -2.06 0.00 -2.79 1.79 0.00 -1.26 -5.10 120.51 111.10 1rk7 n ALA 55 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1rk7 n ALA 55 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 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 1.29 5.00 0.00 0.00 -1.26 -5.01 105.19 105.21 1rk7 n GLY 56 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1rk7 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk7 n THR 58 N 0.00 0.00 0.04 0.00 -2.24 -1.26 -5.13 114.28 105.69 1rk7 n THR 58 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1rk7 n THR 58 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1rk7 n THR 58 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1rk7 n SER 59 N 0.00 -0.29 0.00 3.42 7.64 -1.26 -4.95 113.62 118.18 1rk7 n SER 59 Ca 0.00 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.01 1rk7 n SER 59 Cb 0.00 0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1rk7 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rk7 n ALA 60 N -2.70 0.00 -3.33 -0.43 0.00 -1.26 -4.13 120.51 108.65 1rk7 n ALA 60 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1rk7 n ALA 60 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 -0.57 -1.10 0.00 0.00 -1.26 -5.06 107.32 99.33 1rk7 s GLY 61 Ca 0.00 1.24 -0.18 0.00 0.00 0.00 0.00 44.72 45.78 1rk7 s GLY 61 CO 0.00 2.83 2.09 -1.55 0.00 0.00 0.00 173.10 176.48 1rk7 n PRO 62 N 5.39 2.17 0.14 2.90 -0.04 -1.26 -3.61 135.00 140.69 1rk7 n PRO 62 Ca -0.04 -2.17 0.00 0.00 -0.04 0.00 0.00 63.50 61.26 1rk7 n PRO 62 Cb 0.50 -3.06 0.00 0.00 -0.04 0.00 0.00 33.50 30.90 1rk7 n PRO 62 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1rk7 n HIS 63 N 6.65 -3.42 -4.18 0.54 8.25 -0.57 -4.41 115.22 118.06 1rk7 n HIS 63 Ca 0.51 0.88 -0.41 0.00 -0.26 0.00 0.00 57.72 58.44 1rk7 n HIS 63 Cb 0.38 2.28 -0.03 0.00 1.12 0.00 0.00 29.99 33.75 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 -3.11 -1.32 -3.25 4.41 3.72 -1.24 -4.16 117.46 112.51 1rk7 n PHE 64 Ca 0.00 0.27 -0.25 0.00 -0.05 0.00 0.00 57.45 57.42 1rk7 n PHE 64 Cb 0.00 -2.77 -0.07 0.00 -0.94 0.00 0.00 39.48 35.70 1rk7 n PHE 64 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1rk7 n ASN 65 N -2.43 1.91 -4.57 4.37 3.02 -1.26 -3.95 115.26 112.35 1rk7 n ASN 65 Ca -0.20 -3.09 -0.35 0.00 -0.03 0.00 0.00 54.58 50.92 1rk7 n ASN 65 Cb 0.62 -0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 1rk7 n ASN 65 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1rk7 s PRO 66 N -2.00 3.14 0.00 3.52 0.04 -1.26 -4.13 135.00 134.32 1rk7 s PRO 66 Ca 0.39 -1.02 0.00 0.00 0.04 0.00 0.00 61.00 60.40 1rk7 s PRO 66 Cb 0.19 -5.28 0.00 0.00 0.04 0.00 0.00 34.50 29.46 1rk7 s PRO 66 CO -0.07 -2.90 0.00 -0.11 0.04 0.00 0.00 177.00 173.96 1rk7 n LEU 67 N 11.36 0.00 0.00 -3.56 0.00 -1.26 -4.77 117.00 118.77 1rk7 n LEU 67 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.41 1rk7 n LEU 67 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.90 1rk7 n LEU 67 CO 0.66 0.00 0.00 -1.20 0.00 0.00 0.00 177.39 176.85 1rk7 n SER 68 N 2.52 0.00 0.00 1.96 7.64 0.08 -4.79 113.62 121.03 1rk7 n SER 68 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1rk7 n SER 68 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1rk7 n SER 68 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rk7 n ARG 69 N 0.00 0.00 -1.00 1.43 1.74 -1.26 -0.81 116.66 116.76 1rk7 n ARG 69 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1rk7 n ARG 69 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1rk7 n ARG 69 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1rk7 n LYS 70 N 0.00 -2.71 -2.75 5.56 4.81 -1.26 -4.97 118.16 116.84 1rk7 n LYS 70 Ca 0.00 2.08 -0.00 0.00 -0.87 0.00 0.00 58.31 59.51 1rk7 n LYS 70 Cb 0.00 -2.50 -0.00 0.00 0.02 0.00 0.00 35.03 32.54 1rk7 n LYS 70 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1rk7 n HIS 71 N -1.77 -3.77 0.00 5.64 -0.00 0.13 -4.89 115.22 110.57 1rk7 n HIS 71 Ca 0.00 1.72 0.00 0.00 -0.00 0.00 0.00 57.72 59.44 1rk7 n HIS 71 Cb 0.20 -3.80 0.00 0.00 -0.00 0.00 0.00 29.99 26.39 1rk7 n HIS 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rk7 n GLY 72 N 0.84 -0.15 0.00 1.57 0.00 -1.26 -4.85 105.19 101.34 1rk7 n GLY 72 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 3.02 1.56 0.02 -0.02 0.00 -1.26 -4.47 105.19 104.05 1rk7 n GLY 73 Ca 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.04 0.00 1.61 0.13 -2.00 -3.44 132.00 128.25 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 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.08 1rk7 h PRO 74 CO 0.00 -0.03 -2.35 1.63 -0.23 0.00 0.00 178.00 177.02 1rk7 n LYS 75 N -2.38 0.54 -2.92 0.86 5.02 -1.26 -4.71 118.16 113.31 1rk7 n LYS 75 Ca -0.01 0.20 0.04 0.00 -2.02 0.00 0.00 58.31 56.52 1rk7 n LYS 75 Cb 0.02 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1rk7 n LYS 75 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1rk7 s ASP 76 N -6.88 -0.18 0.15 4.39 1.47 -1.26 -2.68 116.67 111.67 1rk7 s ASP 76 Ca -0.33 -0.04 0.25 0.00 1.18 0.00 0.00 52.55 53.61 1rk7 s ASP 76 Cb 0.11 0.65 0.51 0.00 -0.34 0.00 0.00 42.92 43.85 1rk7 s ASP 76 CO 0.47 -0.03 1.48 1.21 0.68 0.00 0.00 175.17 178.98 1rk7 n GLU 77 N 4.28 0.28 0.00 2.11 4.07 -1.26 -4.70 120.64 125.42 1rk7 n GLU 77 Ca 0.07 0.13 0.00 0.00 -0.06 0.00 0.00 57.16 57.31 1rk7 n GLU 77 Cb 0.61 -1.73 0.00 0.00 -0.06 0.00 0.00 31.44 30.26 1rk7 n GLU 77 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1rk7 n GLU 78 N -2.17 0.00 0.00 5.31 4.71 -1.26 -4.91 120.64 122.32 1rk7 n GLU 78 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 1rk7 n GLU 78 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.87 1rk7 n GLU 78 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1rk7 n ARG 79 N -0.69 0.00 -1.24 3.49 5.12 -1.20 -4.97 116.66 117.18 1rk7 n ARG 79 Ca 0.00 0.00 -0.46 0.00 -1.93 0.00 0.00 57.85 55.46 1rk7 n ARG 79 Cb 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.25 1rk7 n ARG 79 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 1rk7 n HIS 80 N 0.00 0.08 -1.21 -1.55 1.44 0.01 -0.74 115.22 113.24 1rk7 n HIS 80 Ca 0.00 0.87 -0.31 0.00 -2.01 0.00 0.00 57.72 56.27 1rk7 n HIS 80 Cb 0.00 -1.73 -0.13 0.00 0.12 0.00 0.00 29.99 28.25 1rk7 n HIS 80 CO 0.00 0.00 0.00 1.55 -2.81 0.00 0.00 176.34 175.08 1rk7 n VAL 81 N 0.66 0.00 0.00 0.61 3.14 -1.26 0.19 118.33 121.67 1rk7 n VAL 81 Ca 0.16 -0.06 0.00 0.00 -2.96 0.00 0.00 64.34 61.48 1rk7 n VAL 81 Cb 0.14 -0.35 0.00 0.00 -1.06 0.00 0.00 33.84 32.57 1rk7 n VAL 81 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1rk7 n GLY 82 N 5.14 1.31 3.00 7.55 0.00 -1.23 -4.75 105.19 116.21 1rk7 n GLY 82 Ca 0.54 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.31 1rk7 n GLY 82 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rk7 n ASP 83 N 0.00 -4.76 0.00 1.61 5.75 0.52 -3.86 116.55 115.81 1rk7 n ASP 83 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 54.79 54.76 1rk7 n ASP 83 Cb 0.00 -1.31 0.00 0.00 -1.03 0.00 0.00 41.12 38.78 1rk7 n ASP 83 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1rk7 n LEU 84 N 0.18 0.00 0.00 -2.12 4.32 -1.26 -4.89 117.00 113.22 1rk7 n LEU 84 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1rk7 n LEU 84 Cb 0.53 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.33 1rk7 n LEU 84 CO 0.35 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.13 1rk7 n GLY 85 N 0.00 -2.63 3.95 -0.72 0.00 -1.09 -4.78 105.19 99.92 1rk7 n GLY 85 Ca 0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.88 5.97 0.30 1.61 0.01 -1.26 -4.44 114.94 115.25 1rk7 s ASN 86 Ca 0.00 0.30 0.05 0.00 -0.71 0.00 0.00 52.86 52.49 1rk7 s ASN 86 Cb 0.00 -1.64 -0.06 0.00 0.41 0.00 0.00 41.25 39.96 1rk7 s ASN 86 CO 0.00 -0.57 0.02 -0.69 -1.51 0.00 0.00 177.10 174.34 1rk7 s VAL 87 N -2.46 1.32 0.02 1.60 1.01 0.10 -4.96 120.40 117.03 1rk7 s VAL 87 Ca 0.46 -2.04 -0.00 0.00 0.00 0.00 0.00 61.98 60.40 1rk7 s VAL 87 Cb -0.10 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 1rk7 s VAL 87 CO 0.37 -0.13 -0.03 -0.89 0.00 0.00 0.00 175.10 174.42 1rk7 s THR 88 N -3.22 0.12 0.56 3.92 2.01 -1.26 0.18 115.64 117.95 1rk7 s THR 88 Ca 0.33 -0.97 -0.05 0.00 0.31 0.00 0.00 61.69 61.32 1rk7 s THR 88 Cb 0.07 -0.35 0.00 0.00 0.01 0.00 0.00 72.50 72.24 1rk7 s THR 88 CO 0.14 -0.53 0.85 0.00 -0.69 0.00 0.00 174.62 174.39 1rk7 s ALA 89 N -1.62 3.39 0.00 7.40 0.00 -0.26 -4.07 121.76 126.60 1rk7 s ALA 89 Ca -0.14 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1rk7 s ALA 89 Cb -0.09 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.52 1rk7 s ALA 89 CO -0.02 -0.70 0.00 -3.47 0.00 0.00 0.00 175.76 171.58 1rk7 n ASP 90 N -2.47 0.00 -0.15 0.00 2.03 0.27 -4.31 116.55 111.92 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 0.57 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 1rk7 n ASP 90 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1rk7 n LYS 91 N 0.00 0.07 -0.70 -0.67 4.81 -1.26 -4.77 118.16 115.64 1rk7 n LYS 91 Ca 0.00 -0.68 -0.01 0.00 -0.87 0.00 0.00 58.31 56.75 1rk7 n LYS 91 Cb 0.00 -0.52 -0.01 0.00 0.02 0.00 0.00 35.03 34.52 1rk7 n LYS 91 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1rk7 n ASP 92 N -0.02 -0.08 0.00 3.14 8.00 -1.26 -4.86 116.55 121.47 1rk7 n ASP 92 Ca 0.00 -1.54 0.00 0.00 0.71 0.00 0.00 54.79 53.96 1rk7 n ASP 92 Cb 0.55 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 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 0.05 2.58 3.31 0.44 0.00 -1.25 -4.56 105.19 105.76 1rk7 n GLY 93 Ca -0.05 -0.32 -0.56 0.00 0.00 0.00 0.00 46.02 45.09 1rk7 n GLY 93 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rk7 n VAL 94 N 0.00 0.02 -3.96 1.61 0.31 -1.26 -4.20 118.33 110.85 1rk7 n VAL 94 Ca 0.00 -0.04 -0.34 0.00 -0.01 0.00 0.00 64.34 63.95 1rk7 n VAL 94 Cb 0.00 -0.66 -0.14 0.00 -0.91 0.00 0.00 33.84 32.12 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 6.57 2.68 0.00 3.52 0.00 -1.21 0.95 121.76 134.28 1rk7 s ALA 95 Ca 1.20 -1.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 1rk7 s ALA 95 Cb -1.38 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 1rk7 s ALA 95 CO 0.62 -0.55 0.14 0.16 0.00 0.00 0.00 175.76 176.13 1rk7 s ASP 96 N 1.39 6.05 0.32 0.00 -4.77 -1.26 0.13 116.67 118.53 1rk7 s ASP 96 Ca 0.04 0.24 0.09 0.00 -3.30 0.00 0.00 52.55 49.62 1rk7 s ASP 96 Cb -0.15 -1.82 -0.05 0.00 -1.09 0.00 0.00 42.92 39.81 1rk7 s ASP 96 CO -0.06 0.26 0.03 -0.69 0.70 0.00 0.00 175.17 175.41 1rk7 s VAL 97 N -1.28 2.90 -0.32 2.11 1.01 -0.94 -4.77 120.40 119.10 1rk7 s VAL 97 Ca 0.26 -1.91 -0.03 0.00 0.00 0.00 0.00 61.98 60.30 1rk7 s VAL 97 Cb -0.12 -2.83 0.19 0.00 0.00 0.00 0.00 36.38 33.62 1rk7 s VAL 97 CO 0.17 -0.24 0.85 -0.94 0.00 0.00 0.00 175.10 174.94 1rk7 s SER 98 N -3.73 -0.93 0.06 3.32 1.04 -1.18 -3.09 113.70 109.20 1rk7 s SER 98 Ca 0.34 -0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.61 1rk7 s SER 98 Cb -0.02 1.43 -0.02 0.00 0.10 0.00 0.00 66.02 67.50 1rk7 s SER 98 CO 0.20 -0.14 0.08 -0.63 0.98 0.00 0.00 173.24 173.73 1rk7 s ILE 99 N 2.51 0.17 -0.29 -1.02 1.01 0.25 -4.99 121.20 118.85 1rk7 s ILE 99 Ca 0.18 -1.43 0.03 0.00 0.00 0.00 0.00 60.65 59.43 1rk7 s ILE 99 Cb -0.03 -1.35 0.08 0.00 0.01 0.00 0.00 42.46 41.17 1rk7 s ILE 99 CO -0.19 -0.79 -0.02 -1.61 0.00 0.00 0.00 174.94 172.33 1rk7 s GLU 100 N -3.70 1.70 -0.48 2.79 2.02 -1.26 0.10 118.70 119.88 1rk7 s GLU 100 Ca 0.04 -1.47 -0.26 0.00 0.02 0.00 0.00 54.97 53.30 1rk7 s GLU 100 Cb 0.05 -2.89 0.03 0.00 0.10 0.00 0.00 34.13 31.42 1rk7 s GLU 100 CO -0.10 -0.76 0.97 -0.51 0.02 0.00 0.00 175.26 174.88 1rk7 s ASP 101 N 1.12 6.50 0.00 -0.19 1.11 -0.66 -4.70 116.67 119.85 1rk7 s ASP 101 Ca 0.01 0.12 0.25 0.00 0.18 0.00 0.00 52.55 53.10 1rk7 s ASP 101 Cb -0.19 -2.47 0.45 0.00 1.07 0.00 0.00 42.92 41.78 1rk7 s ASP 101 CO -0.08 -1.11 1.37 -1.54 1.18 0.00 0.00 175.17 174.98 1rk7 n SER 102 N 7.34 1.02 0.00 0.27 3.41 -1.26 0.10 113.62 124.50 1rk7 n SER 102 Ca 0.07 -0.81 0.00 0.00 -0.26 0.00 0.00 58.87 57.87 1rk7 n SER 102 Cb 0.48 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 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 -0.91 0.00 -0.43 -3.33 0.31 -1.26 -4.81 118.33 107.90 1rk7 n VAL 103 Ca 0.09 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.13 1rk7 n VAL 103 Cb 0.36 -0.26 0.25 0.00 -0.91 0.00 0.00 33.84 33.28 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 -0.49 0.00 0.00 2.52 -6.64 -1.26 -5.04 119.36 108.45 1rk7 n ILE 104 Ca 0.00 -0.27 0.00 0.00 -1.77 0.00 0.00 62.75 60.71 1rk7 n ILE 104 Cb 0.00 -0.88 0.00 0.00 -1.44 0.00 0.00 39.64 37.32 1rk7 n ILE 104 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 1rk7 n SER 105 N -4.35 0.00 -2.80 7.28 3.41 -1.22 -4.70 113.62 111.23 1rk7 n SER 105 Ca 0.06 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.29 1rk7 n SER 105 Cb 0.55 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.54 1rk7 n SER 105 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1rk7 n LEU 106 N 0.00 7.45 -3.48 1.04 4.32 -1.26 -1.45 117.00 123.61 1rk7 n LEU 106 Ca 0.00 -4.69 -0.37 0.00 -0.02 0.00 0.00 56.01 50.93 1rk7 n LEU 106 Cb 0.00 -1.07 0.00 0.00 -1.62 0.00 0.00 43.42 40.73 1rk7 n LEU 106 CO 0.00 1.72 1.05 -0.24 -1.22 0.00 0.00 177.39 178.70 1rk7 n SER 107 N -0.44 6.47 0.00 -1.43 2.88 -1.26 -4.72 113.62 115.12 1rk7 n SER 107 Ca 0.54 -3.66 0.00 0.00 -1.33 0.00 0.00 58.87 54.42 1rk7 n SER 107 Cb 0.31 -1.01 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 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 0.01 0.27 0.37 0.46 0.00 -1.26 -1.43 105.19 103.60 1rk7 n GLY 108 Ca 0.41 0.46 0.13 0.00 0.00 0.00 0.00 46.02 47.02 1rk7 n GLY 108 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1rk7 h ASP 109 N 0.00 0.45 1.30 1.61 1.82 -1.93 0.61 116.42 120.28 1rk7 h ASP 109 Ca 0.00 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1rk7 h ASP 109 Cb 0.00 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 39.93 1rk7 h ASP 109 CO 0.00 0.25 -0.38 0.45 -1.61 0.00 0.00 179.24 177.95 1rk7 h HIS 110 N 0.49 0.00 -0.47 0.28 3.86 -1.45 -3.47 115.15 114.39 1rk7 h HIS 110 Ca 0.34 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.98 1rk7 h HIS 110 Cb 0.65 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.12 1rk7 h HIS 110 CO -0.00 0.00 0.60 -1.13 0.86 0.00 0.00 177.93 178.25 1rk7 n SER 111 N -2.45 0.72 0.04 2.45 3.41 0.21 -3.38 113.62 114.63 1rk7 n SER 111 Ca 0.04 0.70 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 1rk7 n SER 111 Cb 0.47 -0.60 0.31 0.00 -0.26 0.00 0.00 64.21 64.13 1rk7 n SER 111 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1rk7 n ILE 112 N 3.22 0.25 -1.44 -1.33 -0.00 -1.14 -4.89 119.36 114.03 1rk7 n ILE 112 Ca 0.26 -0.16 -0.63 0.00 -0.00 0.00 0.00 62.75 62.22 1rk7 n ILE 112 Cb -0.04 -0.17 -0.11 0.00 -0.00 0.00 0.00 39.64 39.32 1rk7 n ILE 112 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1rk7 n ILE 113 N -1.88 0.00 0.00 7.28 2.08 -1.26 -1.82 119.36 123.76 1rk7 n ILE 113 Ca 0.05 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.36 1rk7 n ILE 113 Cb 0.39 -0.51 0.00 0.00 -0.75 0.00 0.00 39.64 38.78 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 6.18 1.84 3.54 7.39 0.00 -1.19 -5.00 105.19 117.95 1rk7 n GLY 114 Ca 0.46 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.05 1rk7 n GLY 114 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rk7 s ARG 115 N -0.01 3.42 -1.12 1.61 6.06 -0.76 -4.84 118.95 123.31 1rk7 s ARG 115 Ca 0.00 -0.05 -0.15 0.00 -2.50 0.00 0.00 55.73 53.03 1rk7 s ARG 115 Cb 0.00 -4.01 0.16 0.00 0.06 0.00 0.00 34.95 31.16 1rk7 s ARG 115 CO 0.00 -1.46 1.33 0.99 -2.50 0.00 0.00 175.30 173.67 1rk7 s THR 116 N 4.10 4.98 -1.07 4.11 2.01 -1.26 -2.74 115.64 125.77 1rk7 s THR 116 Ca 0.35 -2.36 -0.22 0.00 0.31 0.00 0.00 61.69 59.76 1rk7 s THR 116 Cb -0.11 -4.86 -0.09 0.00 0.01 0.00 0.00 72.50 67.44 1rk7 s THR 116 CO 0.22 -1.57 1.92 0.18 -0.69 0.00 0.00 174.62 174.68 1rk7 n LEU 117 N 5.81 3.64 -4.77 4.42 7.99 -1.26 -3.26 117.00 129.57 1rk7 n LEU 117 Ca 0.33 -3.17 -0.41 0.00 -0.01 0.00 0.00 56.01 52.74 1rk7 n LEU 117 Cb 0.44 -1.54 -0.02 0.00 -0.11 0.00 0.00 43.42 42.19 1rk7 n LEU 117 CO 0.58 -1.13 0.98 -0.69 -1.51 0.00 0.00 177.39 175.63 1rk7 s VAL 118 N 8.38 2.74 -0.17 4.08 1.01 0.27 -4.40 120.40 132.30 1rk7 s VAL 118 Ca 0.63 0.73 -0.09 0.00 0.00 0.00 0.00 61.98 63.25 1rk7 s VAL 118 Cb 0.05 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1rk7 s VAL 118 CO 0.12 0.17 0.15 0.68 0.00 0.00 0.00 175.10 176.22 1rk7 s VAL 119 N -1.02 5.43 0.05 2.92 -7.23 -1.26 -0.07 120.40 119.22 1rk7 s VAL 119 Ca 0.50 0.23 -0.16 0.00 -1.81 0.00 0.00 61.98 60.73 1rk7 s VAL 119 Cb -0.40 -3.46 -0.06 0.00 0.56 0.00 0.00 36.38 33.02 1rk7 s VAL 119 CO 0.52 0.49 0.49 -1.00 -0.31 0.00 0.00 175.10 175.29 1rk7 s HIS 120 N -0.07 3.75 0.59 2.82 3.76 -0.65 -2.58 115.29 122.91 1rk7 s HIS 120 Ca 0.11 1.11 0.30 0.00 -0.15 0.00 0.00 55.06 56.43 1rk7 s HIS 120 Cb -0.12 -2.38 1.29 0.00 1.11 0.00 0.00 32.58 32.48 1rk7 s HIS 120 CO 0.00 0.59 1.65 1.49 -0.85 0.00 0.00 174.74 177.63 1rk7 h GLU 121 N 4.47 0.00 0.00 1.40 4.81 -1.82 -3.20 114.58 120.24 1rk7 h GLU 121 Ca -0.50 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.66 1rk7 h GLU 121 Cb 1.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 1rk7 h GLU 121 CO 0.63 0.00 -0.05 1.17 -0.73 0.00 0.00 179.01 180.03 1rk7 n LYS 122 N -3.56 0.12 -0.97 1.92 4.81 -1.25 -4.90 118.16 114.33 1rk7 n LYS 122 Ca 0.17 -0.59 0.00 0.00 -0.87 0.00 0.00 58.31 57.02 1rk7 n LYS 122 Cb 1.09 0.53 0.00 0.00 0.02 0.00 0.00 35.03 36.68 1rk7 n LYS 122 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rk7 n ALA 123 N -2.55 0.00 0.28 3.14 0.00 -1.24 0.38 120.51 120.52 1rk7 n ALA 123 Ca -0.03 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1rk7 n ALA 123 Cb 0.12 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.77 1rk7 n ALA 123 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rk7 n ASP 124 N -1.10 3.39 -1.74 0.00 2.03 -1.26 -4.36 116.55 113.51 1rk7 n ASP 124 Ca 0.00 -1.97 -0.09 0.00 0.52 0.00 0.00 54.79 53.25 1rk7 n ASP 124 Cb 0.00 -0.24 -0.02 0.00 -0.72 0.00 0.00 41.12 40.14 1rk7 n ASP 124 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1rk7 n ASP 125 N 1.42 -2.56 -0.93 1.67 9.92 -1.26 0.21 116.55 125.02 1rk7 n ASP 125 Ca 0.18 0.24 -0.12 0.00 -0.53 0.00 0.00 54.79 54.57 1rk7 n ASP 125 Cb 0.59 -2.41 -0.05 0.00 -0.64 0.00 0.00 41.12 38.60 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 -2.03 -0.46 0.00 0.64 4.77 -1.26 -3.52 117.00 115.14 1rk7 n LEU 126 Ca -0.09 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1rk7 n LEU 126 Cb 0.40 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 38.78 1rk7 n LEU 126 CO 0.12 -1.05 0.00 0.61 -1.33 0.00 0.00 177.39 175.74 1rk7 n GLY 127 N 0.19 0.35 2.01 -0.72 0.00 0.56 -4.97 105.19 102.62 1rk7 n GLY 127 Ca -0.12 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 -1.64 -3.92 1.61 4.81 0.81 -1.64 118.16 118.19 1rk7 n LYS 128 Ca 0.00 0.55 -0.29 0.00 -0.87 0.00 0.00 58.31 57.70 1rk7 n LYS 128 Cb 0.00 -4.88 -0.07 0.00 0.02 0.00 0.00 35.03 30.10 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 -0.39 -0.20 3.21 3.14 0.00 -1.26 -4.88 105.19 104.82 1rk7 n GLY 129 Ca -0.11 0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1rk7 n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk7 s GLY 130 N -3.47 0.96 -0.02 -0.02 0.00 -0.65 -5.08 107.32 99.03 1rk7 s GLY 130 Ca 0.31 -1.44 0.00 0.00 0.00 0.00 0.00 44.72 43.59 1rk7 s GLY 130 CO 0.80 -1.52 -0.00 -1.31 0.00 0.00 0.00 173.10 171.06 1rk7 s ASN 131 N -3.11 0.26 0.00 1.64 -0.87 -1.26 -4.14 114.94 107.46 1rk7 s ASN 131 Ca 0.16 -0.02 0.00 0.00 -1.57 0.00 0.00 52.86 51.43 1rk7 s ASN 131 Cb 0.04 -0.11 0.00 0.00 -0.02 0.00 0.00 41.25 41.16 1rk7 s ASN 131 CO -0.01 -0.05 0.00 1.21 -2.57 0.00 0.00 177.10 175.67 1rk7 n GLU 132 N 3.69 -0.53 0.04 -0.60 2.13 -1.26 -4.71 120.64 119.40 1rk7 n GLU 132 Ca -0.21 0.13 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1rk7 n GLU 132 Cb 0.54 -3.58 0.00 0.00 0.27 0.00 0.00 31.44 28.67 1rk7 n GLU 132 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1rk7 n GLN 133 N -1.70 0.00 0.12 5.31 1.13 -1.26 -4.84 117.38 116.14 1rk7 n GLN 133 Ca 0.00 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.11 1rk7 n GLN 133 Cb 0.13 -0.06 0.02 0.00 0.11 0.00 0.00 30.24 30.44 1rk7 n GLN 133 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1rk7 h SER 134 N 0.00 0.00 0.54 1.08 4.64 -1.84 -1.84 113.55 116.14 1rk7 h SER 134 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rk7 h SER 134 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1rk7 h SER 134 CO 0.00 0.36 0.00 0.71 -0.87 0.00 0.00 176.83 177.03 1rk7 h THR 135 N 0.00 0.00 0.00 2.95 1.35 -1.83 -3.13 112.91 112.25 1rk7 h THR 135 Ca -0.04 -0.21 -0.24 0.00 -0.55 0.00 0.00 66.41 65.37 1rk7 h THR 135 Cb 1.31 0.97 -0.04 0.00 -1.73 0.00 0.00 68.15 68.66 1rk7 h THR 135 CO 0.04 0.00 -1.84 2.29 -0.25 0.00 0.00 175.52 175.76 1rk7 n LYS 136 N -2.51 0.34 0.00 4.72 2.85 -1.21 0.19 118.16 122.53 1rk7 n LYS 136 Ca 0.00 0.12 0.00 0.00 -1.05 0.00 0.00 58.31 57.38 1rk7 n LYS 136 Cb 0.18 -1.14 0.00 0.00 -0.65 0.00 0.00 35.03 33.43 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 -3.38 0.00 0.00 0.58 -2.24 -0.70 -4.51 114.28 104.03 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 0.73 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 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 4.04 0.00 3.07 3.38 0.00 -1.15 -4.06 105.19 110.46 1rk7 n GLY 138 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1rk7 n GLY 138 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rk7 n ASN 139 N 0.00 -1.22 -0.81 1.61 5.15 -1.24 -4.44 115.26 114.31 1rk7 n ASN 139 Ca 0.00 -0.04 -0.02 0.00 -0.60 0.00 0.00 54.58 53.92 1rk7 n ASN 139 Cb 0.00 -1.15 -0.02 0.00 -0.53 0.00 0.00 39.78 38.08 1rk7 n ASN 139 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rk7 n ALA 140 N -2.90 2.68 -2.60 5.20 0.00 -1.26 -4.96 120.51 116.66 1rk7 n ALA 140 Ca 0.04 -0.70 -0.43 0.00 0.00 0.00 0.00 53.44 52.35 1rk7 n ALA 140 Cb 0.47 -0.29 -0.00 0.00 0.00 0.00 0.00 19.45 19.63 1rk7 n ALA 140 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk7 s GLY 141 N -0.76 1.63 -0.01 0.00 0.00 -1.26 -2.47 107.32 104.45 1rk7 s GLY 141 Ca 0.05 -2.86 0.09 0.00 0.00 0.00 0.00 44.72 42.00 1rk7 s GLY 141 CO -0.02 2.69 0.30 -1.26 0.00 0.00 0.00 173.10 174.81 1rk7 n SER 142 N 8.32 1.59 -1.83 1.64 2.88 -1.26 -5.05 113.62 119.91 1rk7 n SER 142 Ca 0.46 -0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1rk7 n SER 142 Cb 0.46 1.21 0.00 0.00 -0.75 0.00 0.00 64.21 65.13 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 -1.51 -5.16 -2.69 -1.46 1.74 -1.26 -5.02 116.66 101.31 1rk7 n ARG 143 Ca 0.00 3.75 -0.05 0.00 -0.77 0.00 0.00 57.85 60.78 1rk7 n ARG 143 Cb 0.19 -4.16 0.09 0.00 -1.02 0.00 0.00 32.46 27.57 1rk7 n ARG 143 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1rk7 n LEU 144 N 0.13 -1.64 0.00 0.55 -0.00 -1.07 -4.95 117.00 110.04 1rk7 n LEU 144 Ca 0.00 -2.58 0.00 0.00 -0.00 0.00 0.00 56.01 53.43 1rk7 n LEU 144 Cb 0.00 0.90 0.00 0.00 -0.00 0.00 0.00 43.42 44.32 1rk7 n LEU 144 CO 0.00 1.73 0.00 0.00 -0.00 0.00 0.00 177.39 179.12 1rk7 n ALA 145 N 0.28 0.00 -2.85 1.47 0.00 -1.26 -2.23 120.51 115.92 1rk7 n ALA 145 Ca -0.04 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 1rk7 n ALA 145 Cb 0.73 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.24 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 3.05 0.41 -3.36 0.00 0.00 -1.78 -3.42 103.07 97.97 1rk7 h GLY 147 Ca -0.05 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1rk7 h GLY 147 CO 0.23 -0.28 -0.72 -0.62 0.00 0.00 0.00 176.54 175.15 1rk7 n VAL 148 N -5.50 -8.41 -2.66 4.60 0.31 -1.18 -3.33 118.33 102.15 1rk7 n VAL 148 Ca 0.10 2.38 -0.42 0.00 -0.01 0.00 0.00 64.34 66.39 1rk7 n VAL 148 Cb 0.40 -3.98 -0.03 0.00 -0.91 0.00 0.00 33.84 29.31 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 -0.92 4.72 0.08 2.52 1.09 -1.11 -3.82 121.20 123.76 1rk7 s ILE 149 Ca 0.00 1.96 0.04 0.00 -1.10 0.00 0.00 60.65 61.55 1rk7 s ILE 149 Cb 0.00 -4.25 -0.03 0.00 -1.06 0.00 0.00 42.46 37.11 1rk7 s ILE 149 CO 0.00 0.13 -0.11 -0.83 -0.10 0.00 0.00 174.94 174.03 1rk7 s GLY 150 N 1.04 0.78 0.18 6.18 0.00 0.33 -3.19 107.32 112.64 1rk7 s GLY 150 Ca 0.53 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 43.91 1rk7 s GLY 150 CO 0.27 -1.09 1.33 -0.42 0.00 0.00 0.00 173.10 173.19 1rk7 s ILE 151 N -1.83 3.23 0.68 0.90 -1.09 -1.26 0.96 121.20 122.80 1rk7 s ILE 151 Ca -0.00 0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 59.38 1rk7 s ILE 151 Cb -0.07 -3.62 0.10 0.00 -1.58 0.00 0.00 42.46 37.28 1rk7 s ILE 151 CO 0.01 0.13 0.95 0.00 -1.23 0.00 0.00 174.94 174.80 1rk7 s ALA 152 N 0.38 3.62 0.00 9.38 0.00 -0.97 -4.84 121.76 129.32 1rk7 s ALA 152 Ca 0.59 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1rk7 s ALA 152 Cb -0.37 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.62 1rk7 s ALA 152 CO 0.36 -1.29 0.14 0.00 0.00 0.00 0.00 175.76 174.98