#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qb9 s LEU 10 N 0.00 -0.26 -0.30 -1.84 1.43 -1.25 -3.95 118.68 112.52 2qb9 s LEU 10 Ca 0.00 0.21 -0.09 0.00 -1.03 0.00 0.00 54.13 53.22 2qb9 s LEU 10 Cb 0.00 0.61 -0.01 0.00 0.03 0.00 0.00 46.19 46.82 2qb9 s LEU 10 CO 0.00 -0.28 0.13 -1.10 0.23 0.00 0.00 176.35 175.32 2qb9 s GLN 11 N 2.39 3.34 -1.01 1.70 -0.21 0.14 -4.94 119.66 121.08 2qb9 s GLN 11 Ca 0.05 -0.71 -0.03 0.00 0.02 0.00 0.00 55.36 54.69 2qb9 s GLN 11 Cb -0.14 -3.49 0.28 0.00 1.00 0.00 0.00 33.01 30.66 2qb9 s GLN 11 CO -0.11 -0.39 1.22 0.39 -2.12 0.00 0.00 175.29 174.29 2qb9 n GLU 12 N 4.95 3.79 -2.61 2.91 1.02 -1.26 -2.16 120.64 127.29 2qb9 n GLU 12 Ca -0.14 -4.54 -0.43 0.00 -0.02 0.00 0.00 57.16 52.03 2qb9 n GLU 12 Cb 0.49 -2.47 -0.02 0.00 -0.02 0.00 0.00 31.44 29.42 2qb9 n GLU 12 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2qb9 s LYS 13 N -2.26 4.35 -0.54 3.49 2.47 -1.15 -4.95 119.74 121.15 2qb9 s LYS 13 Ca 0.32 1.47 -0.27 0.00 -1.56 0.00 0.00 55.97 55.93 2qb9 s LYS 13 Cb 0.01 -3.59 0.03 0.00 -1.46 0.00 0.00 37.83 32.83 2qb9 s LYS 13 CO 0.02 -0.46 1.07 -1.17 0.16 0.00 0.00 175.35 174.97 2qb9 s LEU 14 N 2.50 3.76 0.03 5.43 1.98 -1.26 -2.62 118.68 128.51 2qb9 s LEU 14 Ca 0.49 0.00 -0.23 0.00 -2.89 0.00 0.00 54.13 51.51 2qb9 s LEU 14 Cb -0.19 -3.11 -0.12 0.00 0.66 0.00 0.00 46.19 43.43 2qb9 s LEU 14 CO 0.15 -1.31 1.32 0.40 -1.89 0.00 0.00 176.35 175.02 2qb9 h ILE 15 N 6.11 0.00 -2.26 6.68 2.04 -1.51 -3.49 117.51 125.09 2qb9 h ILE 15 Ca -0.25 -0.01 0.18 0.00 1.00 0.00 0.00 64.86 65.78 2qb9 h ILE 15 Cb 1.07 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.05 2qb9 h ILE 15 CO 1.13 0.00 0.51 0.00 0.00 0.00 0.00 178.15 179.79 2qb9 s ALA 16 N -4.77 -1.72 -0.10 1.87 0.00 -0.70 -4.91 121.76 111.43 2qb9 s ALA 16 Ca -0.12 0.28 -0.07 0.00 0.00 0.00 0.00 51.96 52.06 2qb9 s ALA 16 Cb 0.01 0.59 0.04 0.00 0.00 0.00 0.00 23.12 23.76 2qb9 s ALA 16 CO 0.36 -1.00 0.26 0.54 0.00 0.00 0.00 175.76 175.92 2qb9 s VAL 17 N -3.20 -0.02 0.27 0.00 0.11 -1.26 0.66 120.40 116.96 2qb9 s VAL 17 Ca 0.11 0.09 0.12 0.00 -2.93 0.00 0.00 61.98 59.37 2qb9 s VAL 17 Cb -0.01 -0.38 -0.05 0.00 -1.53 0.00 0.00 36.38 34.41 2qb9 s VAL 17 CO 0.00 0.04 -0.19 0.20 -3.33 0.00 0.00 175.10 171.82 2qb9 s ASN 18 N 0.85 3.64 0.00 3.54 -0.87 0.96 -4.97 114.94 118.10 2qb9 s ASN 18 Ca -0.06 -0.98 0.00 0.00 -1.57 0.00 0.00 52.86 50.25 2qb9 s ASN 18 Cb -0.07 -0.34 0.00 0.00 -0.02 0.00 0.00 41.25 40.82 2qb9 s ASN 18 CO -0.06 0.05 0.08 -1.14 -2.57 0.00 0.00 177.10 173.46 2qb9 n ARG 19 N -0.54 0.00 -0.39 -0.60 0.63 -1.26 -0.09 116.66 114.40 2qb9 n ARG 19 Ca -0.06 0.28 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 2qb9 n ARG 19 Cb 0.59 -0.84 0.00 0.00 0.45 0.00 0.00 32.46 32.67 2qb9 n ARG 19 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2qb9 n VAL 20 N -1.35 -0.81 -4.07 5.15 0.31 -1.26 -2.23 118.33 114.07 2qb9 n VAL 20 Ca 0.00 0.38 -0.14 0.00 -0.01 0.00 0.00 64.34 64.57 2qb9 n VAL 20 Cb 0.00 -0.62 -0.04 0.00 -0.91 0.00 0.00 33.84 32.28 2qb9 n VAL 20 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2qb9 n SER 21 N -1.72 -0.99 -3.18 4.52 3.41 -1.26 -1.42 113.62 112.97 2qb9 n SER 21 Ca 0.00 -2.70 0.01 0.00 -0.26 0.00 0.00 58.87 55.92 2qb9 n SER 21 Cb 0.11 1.95 -0.01 0.00 -0.26 0.00 0.00 64.21 66.00 2qb9 n SER 21 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2qb9 s LYS 22 N -2.83 0.53 0.30 4.33 2.20 -0.65 -4.95 119.74 118.67 2qb9 s LYS 22 Ca 0.28 0.59 -0.29 0.00 -0.36 0.00 0.00 55.97 56.19 2qb9 s LYS 22 Cb -0.00 0.20 -0.10 0.00 -1.51 0.00 0.00 37.83 36.42 2qb9 s LYS 22 CO 0.20 -0.93 1.13 -0.08 -0.36 0.00 0.00 175.35 175.31 2qb9 s THR 23 N 2.78 3.36 0.30 3.43 -1.32 -1.26 -1.80 115.64 121.13 2qb9 s THR 23 Ca 0.12 1.34 0.05 0.00 -1.21 0.00 0.00 61.69 62.00 2qb9 s THR 23 Cb -0.12 -3.84 -0.03 0.00 -1.51 0.00 0.00 72.50 67.00 2qb9 s THR 23 CO -0.25 0.30 0.22 0.68 -2.21 0.00 0.00 174.62 173.36 2qb9 s VAL 24 N -1.20 0.07 0.36 5.08 -7.23 0.18 -4.93 120.40 112.73 2qb9 s VAL 24 Ca 0.46 -2.00 0.18 0.00 -1.81 0.00 0.00 61.98 58.81 2qb9 s VAL 24 Cb -0.33 -2.49 0.36 0.00 0.56 0.00 0.00 36.38 34.48 2qb9 s VAL 24 CO 0.42 0.00 1.66 0.07 -0.31 0.00 0.00 175.10 176.94 2qb9 h LYS 25 N 2.24 0.27 -0.21 4.82 2.10 -2.02 0.32 116.57 124.09 2qb9 h LYS 25 Ca -0.29 -0.02 -0.21 0.00 -2.00 0.00 0.00 60.65 58.14 2qb9 h LYS 25 Cb 1.24 -0.06 0.01 0.00 -0.90 0.00 0.00 32.23 32.51 2qb9 h LYS 25 CO 0.43 0.18 -0.67 0.78 -2.00 0.00 0.00 179.45 178.16 2qb9 h GLY 26 N 0.28 0.91 0.00 0.07 0.00 -2.00 -3.50 103.07 98.83 2qb9 h GLY 26 Ca 0.74 -1.19 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2qb9 h GLY 26 CO -0.55 1.06 0.00 0.61 0.00 0.00 0.00 176.54 177.66 2qb9 n GLY 27 N 0.57 -0.14 3.77 4.60 0.00 0.11 -5.12 105.19 108.98 2qb9 n GLY 27 Ca -0.06 -1.25 -0.39 0.00 0.00 0.00 0.00 46.02 44.32 2qb9 n GLY 27 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qb9 s ARG 28 N -2.00 4.42 -0.38 1.61 3.52 -1.26 0.51 118.95 125.37 2qb9 s ARG 28 Ca 0.00 1.67 0.04 0.00 -0.13 0.00 0.00 55.73 57.31 2qb9 s ARG 28 Cb 0.00 -2.90 0.11 0.00 -1.56 0.00 0.00 34.95 30.60 2qb9 s ARG 28 CO 0.00 0.05 0.11 0.42 -0.81 0.00 0.00 175.30 175.07 2qb9 s ILE 29 N -1.38 2.26 1.01 4.11 1.01 -0.75 -4.90 121.20 122.56 2qb9 s ILE 29 Ca 0.50 -2.54 -0.12 0.00 0.00 0.00 0.00 60.65 58.50 2qb9 s ILE 29 Cb -0.28 -2.65 0.17 0.00 0.01 0.00 0.00 42.46 39.71 2qb9 s ILE 29 CO 0.35 -0.66 0.91 2.22 0.00 0.00 0.00 174.94 177.76 2qb9 n PHE 30 N 3.99 -0.25 -3.65 3.97 1.16 -1.26 -1.64 117.46 119.78 2qb9 n PHE 30 Ca 0.04 0.21 -0.03 0.00 -1.87 0.00 0.00 57.45 55.79 2qb9 n PHE 30 Cb 0.39 -1.85 0.02 0.00 -1.61 0.00 0.00 39.48 36.43 2qb9 n PHE 30 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2qb9 n SER 31 N -3.79 -1.28 -3.70 5.98 2.88 -0.50 -4.85 113.62 108.36 2qb9 n SER 31 Ca 0.08 -1.77 -0.11 0.00 -1.33 0.00 0.00 58.87 55.75 2qb9 n SER 31 Cb 0.54 2.10 -0.11 0.00 -0.75 0.00 0.00 64.21 65.99 2qb9 n SER 31 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2qb9 s PHE 32 N -3.87 -0.58 -0.07 0.66 0.08 -0.85 -4.07 117.98 109.28 2qb9 s PHE 32 Ca 0.13 1.26 0.04 0.00 0.12 0.00 0.00 56.93 58.49 2qb9 s PHE 32 Cb -0.02 0.25 -0.00 0.00 -0.57 0.00 0.00 43.02 42.68 2qb9 s PHE 32 CO 0.05 -0.33 -0.20 0.95 -0.10 0.00 0.00 175.22 175.59 2qb9 s THR 33 N 1.26 1.73 -0.05 0.64 -4.23 0.86 -0.35 115.64 115.50 2qb9 s THR 33 Ca -0.08 -0.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.61 2qb9 s THR 33 Cb -0.08 -1.49 -0.00 0.00 1.34 0.00 0.00 72.50 72.27 2qb9 s THR 33 CO -0.11 0.49 -0.18 0.00 -0.54 0.00 0.00 174.62 174.28 2qb9 s ALA 34 N 0.19 1.60 -0.22 3.99 0.00 0.50 -0.03 121.76 127.79 2qb9 s ALA 34 Ca -0.10 -0.70 -0.06 0.00 0.00 0.00 0.00 51.96 51.10 2qb9 s ALA 34 Cb -0.15 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 2qb9 s ALA 34 CO 0.05 0.26 0.02 -1.17 0.00 0.00 0.00 175.76 174.92 2qb9 s LEU 35 N 0.16 3.29 0.02 0.00 2.96 0.21 -2.26 118.68 123.06 2qb9 s LEU 35 Ca -0.07 -0.21 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 2qb9 s LEU 35 Cb -0.13 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 2qb9 s LEU 35 CO 0.03 0.03 0.07 0.28 -1.32 0.00 0.00 176.35 175.44 2qb9 s THR 36 N 1.23 0.11 0.23 3.68 -1.32 -1.21 -1.19 115.64 117.16 2qb9 s THR 36 Ca 0.04 -0.88 0.11 0.00 -1.21 0.00 0.00 61.69 59.74 2qb9 s THR 36 Cb -0.15 -0.51 -0.05 0.00 -1.51 0.00 0.00 72.50 70.29 2qb9 s THR 36 CO 0.02 -0.49 -0.21 0.68 -2.21 0.00 0.00 174.62 172.41 2qb9 s VAL 37 N -1.75 2.31 -0.07 5.08 -7.23 -1.08 0.66 120.40 118.33 2qb9 s VAL 37 Ca -0.12 -2.20 0.01 0.00 -1.81 0.00 0.00 61.98 57.85 2qb9 s VAL 37 Cb -0.07 -2.17 0.02 0.00 0.56 0.00 0.00 36.38 34.73 2qb9 s VAL 37 CO -0.01 -0.29 -0.06 -0.69 -0.31 0.00 0.00 175.10 173.74 2qb9 s VAL 38 N -2.16 0.73 0.26 1.32 1.01 -0.72 -2.92 120.40 117.92 2qb9 s VAL 38 Ca 0.24 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.09 2qb9 s VAL 38 Cb -0.06 -0.75 -0.06 0.00 0.00 0.00 0.00 36.38 35.52 2qb9 s VAL 38 CO 0.12 0.29 -0.02 -0.83 0.00 0.00 0.00 175.10 174.65 2qb9 s GLY 39 N 1.20 1.73 -0.02 4.51 0.00 -0.92 -2.81 107.32 111.02 2qb9 s GLY 39 Ca -0.06 -1.86 0.13 0.00 0.00 0.00 0.00 44.72 42.93 2qb9 s GLY 39 CO -0.02 -1.76 0.31 2.09 0.00 0.00 0.00 173.10 173.72 2qb9 n ASP 40 N -0.52 1.94 0.00 1.64 5.75 -0.96 0.27 116.55 124.66 2qb9 n ASP 40 Ca -0.05 -0.09 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 2qb9 n ASP 40 Cb 0.64 1.51 0.00 0.00 -1.03 0.00 0.00 41.12 42.24 2qb9 n ASP 40 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qb9 n GLY 41 N 1.73 0.73 0.00 6.12 0.00 -0.06 -3.54 105.19 110.16 2qb9 n GLY 41 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2qb9 n GLY 41 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qb9 n ASN 42 N 0.00 3.61 0.00 1.61 4.05 -1.25 -4.45 115.26 118.83 2qb9 n ASN 42 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2qb9 n ASN 42 Cb 0.00 0.06 0.00 0.00 1.23 0.00 0.00 39.78 41.07 2qb9 n ASN 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qb9 n GLY 43 N 3.17 0.00 3.05 8.20 0.00 -1.15 -4.80 105.19 113.65 2qb9 n GLY 43 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2qb9 n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qb9 s ARG 44 N 0.00 1.37 0.03 1.61 3.00 -1.25 -1.09 118.95 122.62 2qb9 s ARG 44 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 55.73 55.31 2qb9 s ARG 44 Cb 0.00 -1.21 -0.00 0.00 0.00 0.00 0.00 34.95 33.74 2qb9 s ARG 44 CO 0.00 0.14 0.01 1.33 0.00 0.00 0.00 175.30 176.78 2qb9 n VAL 45 N 3.35 0.00 0.00 3.52 0.24 -0.81 -2.27 118.33 122.36 2qb9 n VAL 45 Ca -0.19 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2qb9 n VAL 45 Cb 0.53 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 2qb9 n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qb9 n GLY 46 N 1.33 2.80 3.89 7.63 0.00 -1.13 -0.76 105.19 118.96 2qb9 n GLY 46 Ca -0.00 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2qb9 n GLY 46 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qb9 s PHE 47 N 0.00 3.53 -0.22 1.61 -0.71 -1.26 -1.75 117.98 119.17 2qb9 s PHE 47 Ca 0.00 1.03 -0.04 0.00 -1.04 0.00 0.00 56.93 56.89 2qb9 s PHE 47 Cb 0.00 -2.64 0.09 0.00 -1.21 0.00 0.00 43.02 39.26 2qb9 s PHE 47 CO 0.00 -0.64 0.18 0.20 -1.34 0.00 0.00 175.22 173.62 2qb9 s GLY 48 N -4.20 0.16 -0.13 1.99 0.00 0.21 -4.27 107.32 101.08 2qb9 s GLY 48 Ca 0.53 -0.22 -0.20 0.00 0.00 0.00 0.00 44.72 44.83 2qb9 s GLY 48 CO 0.50 2.10 0.59 -0.47 0.00 0.00 0.00 173.10 175.81 2qb9 s TYR 49 N 2.24 3.48 -0.06 1.90 5.04 -1.26 -3.31 117.35 125.39 2qb9 s TYR 49 Ca 0.06 0.99 -0.14 0.00 -2.44 0.00 0.00 57.07 55.54 2qb9 s TYR 49 Cb -0.16 -2.70 0.03 0.00 0.35 0.00 0.00 41.96 39.48 2qb9 s TYR 49 CO -0.19 0.02 0.33 0.20 -1.34 0.00 0.00 175.55 174.57 2qb9 s GLY 50 N 0.88 -0.19 0.07 8.97 0.00 -0.96 -4.77 107.32 111.32 2qb9 s GLY 50 Ca 0.30 0.56 0.02 0.00 0.00 0.00 0.00 44.72 45.60 2qb9 s GLY 50 CO 0.12 0.38 -0.08 -1.59 0.00 0.00 0.00 173.10 171.94 2qb9 s LYS 51 N -0.79 0.71 0.20 2.90 -2.85 -1.26 -0.37 119.74 118.28 2qb9 s LYS 51 Ca -0.09 -1.07 -0.23 0.00 -1.00 0.00 0.00 55.97 53.58 2qb9 s LYS 51 Cb -0.04 -0.30 0.05 0.00 -2.06 0.00 0.00 37.83 35.47 2qb9 s LYS 51 CO 0.03 0.03 0.83 0.00 0.10 0.00 0.00 175.35 176.34 2qb9 s ALA 52 N -2.49 -1.46 0.46 0.59 0.00 0.53 -4.69 121.76 114.69 2qb9 s ALA 52 Ca 0.02 -0.02 0.15 0.00 0.00 0.00 0.00 51.96 52.10 2qb9 s ALA 52 Cb -0.02 0.74 1.09 0.00 0.00 0.00 0.00 23.12 24.92 2qb9 s ALA 52 CO -0.02 -1.01 2.02 -0.09 0.00 0.00 0.00 175.76 176.66 2qb9 h ARG 53 N 2.00 0.31 -5.95 0.00 2.43 -1.92 -2.25 114.38 109.01 2qb9 h ARG 53 Ca -0.22 -0.02 -0.63 0.00 -0.81 0.00 0.00 59.98 58.30 2qb9 h ARG 53 Cb 1.24 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.66 2qb9 h ARG 53 CO 0.25 0.21 -0.53 -1.21 -1.51 0.00 0.00 179.97 177.18 2qb9 s GLU 54 N -5.31 3.28 0.11 0.20 0.41 -1.26 -4.64 118.70 111.49 2qb9 s GLU 54 Ca -0.07 -0.47 -0.19 0.00 -0.41 0.00 0.00 54.97 53.84 2qb9 s GLU 54 Cb 0.19 -2.97 -0.06 0.00 -1.78 0.00 0.00 34.13 29.51 2qb9 s GLU 54 CO 0.73 0.62 1.70 0.28 -0.49 0.00 0.00 175.26 178.11 2qb9 h VAL 55 N 2.50 1.13 -0.09 2.63 2.07 -1.92 -3.02 116.25 119.55 2qb9 h VAL 55 Ca -0.47 -0.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.61 2qb9 h VAL 55 Cb 1.17 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2qb9 h VAL 55 CO 0.71 0.13 -0.27 1.55 0.02 0.00 0.00 177.57 179.71 2qb9 h PRO 56 N 0.30 0.34 -0.78 1.57 0.13 -1.95 -3.31 132.00 128.29 2qb9 h PRO 56 Ca 0.09 -0.25 0.18 0.00 -0.87 0.00 0.00 66.00 65.15 2qb9 h PRO 56 Cb 0.09 0.04 -0.14 0.00 0.13 0.00 0.00 31.00 31.12 2qb9 h PRO 56 CO -0.01 0.87 0.00 0.00 -0.23 0.00 0.00 178.00 178.63 2qb9 h ALA 57 N 0.47 0.81 -0.22 -0.56 0.00 -1.94 -0.49 119.26 117.33 2qb9 h ALA 57 Ca -0.01 0.25 0.05 0.00 0.00 0.00 0.00 54.91 55.20 2qb9 h ALA 57 Cb 0.89 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2qb9 h ALA 57 CO 0.06 -0.43 -0.11 0.00 0.00 0.00 0.00 179.25 178.77 2qb9 h ALA 58 N 1.73 0.08 0.22 0.00 0.00 -1.61 -2.24 119.26 117.43 2qb9 h ALA 58 Ca 0.43 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 2qb9 h ALA 58 Cb 0.76 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2qb9 h ALA 58 CO -0.69 -0.53 -0.13 0.82 0.00 0.00 0.00 179.25 178.73 2qb9 h ILE 59 N -0.08 0.73 -0.57 0.00 2.04 -1.23 0.15 117.51 118.55 2qb9 h ILE 59 Ca 0.12 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.08 2qb9 h ILE 59 Cb 0.26 0.73 -0.11 0.00 -0.74 0.00 0.00 36.82 36.96 2qb9 h ILE 59 CO -0.28 0.00 -0.31 -0.61 0.00 0.00 0.00 178.15 176.96 2qb9 h GLN 60 N -0.33 -0.15 -0.27 2.37 5.75 -0.98 0.27 115.11 121.77 2qb9 h GLN 60 Ca -0.02 0.01 -0.17 0.00 -0.15 0.00 0.00 58.65 58.32 2qb9 h GLN 60 Cb 0.27 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.85 2qb9 h GLN 60 CO 0.03 -0.10 -0.51 1.57 -2.65 0.00 0.00 178.83 177.17 2qb9 h LYS 61 N -0.15 0.76 0.00 1.69 2.10 -1.31 -2.77 116.57 116.89 2qb9 h LYS 61 Ca 0.24 -0.46 -0.01 0.00 -2.00 0.00 0.00 60.65 58.42 2qb9 h LYS 61 Cb 0.54 0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.91 2qb9 h LYS 61 CO -0.65 1.09 -0.03 0.00 -2.00 0.00 0.00 179.45 177.85 2qb9 h ALA 62 N 0.82 1.20 0.13 0.07 0.00 0.66 -2.06 119.26 120.08 2qb9 h ALA 62 Ca 0.02 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2qb9 h ALA 62 Cb 1.09 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.90 2qb9 h ALA 62 CO 0.11 0.04 -0.81 0.52 0.00 0.00 0.00 179.25 179.11 2qb9 h MET 63 N 0.00 0.31 -0.95 0.00 2.86 -0.27 -2.74 114.93 114.14 2qb9 h MET 63 Ca -0.00 -0.51 0.09 0.00 -2.06 0.00 0.00 59.70 57.22 2qb9 h MET 63 Cb 0.15 0.19 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 2qb9 h MET 63 CO 0.00 1.24 0.59 1.05 1.06 0.00 0.00 176.91 180.85 2qb9 h GLU 64 N -0.35 0.96 -0.71 1.72 -0.00 -1.15 0.68 114.58 115.73 2qb9 h GLU 64 Ca -0.14 -0.06 -0.07 0.00 -0.00 0.00 0.00 59.36 59.09 2qb9 h GLU 64 Cb 1.63 -0.22 -0.03 0.00 -0.00 0.00 0.00 28.75 30.13 2qb9 h GLU 64 CO 0.15 0.64 0.16 0.87 -0.00 0.00 0.00 179.01 180.83 2qb9 h LYS 65 N 0.99 1.15 0.00 1.06 1.79 -1.46 -1.60 116.57 118.49 2qb9 h LYS 65 Ca 0.44 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2qb9 h LYS 65 Cb 0.34 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2qb9 h LYS 65 CO -0.23 1.01 0.00 0.00 -1.08 0.00 0.00 179.45 179.16 2qb9 h ALA 66 N 1.08 1.00 0.00 3.86 0.00 -0.56 -0.35 119.26 124.30 2qb9 h ALA 66 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.78 2qb9 h ALA 66 Cb 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2qb9 h ALA 66 CO 0.00 0.00 -1.90 0.54 0.00 0.00 0.00 179.25 177.90 2qb9 n ARG 67 N -2.48 0.58 -0.28 0.00 1.74 -0.76 -4.23 116.66 111.23 2qb9 n ARG 67 Ca -0.01 0.42 0.17 0.00 -0.77 0.00 0.00 57.85 57.66 2qb9 n ARG 67 Cb 0.07 -1.62 0.45 0.00 -1.02 0.00 0.00 32.46 30.34 2qb9 n ARG 67 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qb9 h ARG 68 N -1.00 0.51 -4.17 5.56 2.47 -0.88 -3.29 114.38 113.58 2qb9 h ARG 68 Ca -0.53 -0.03 -0.71 0.00 -1.26 0.00 0.00 59.98 57.45 2qb9 h ARG 68 Cb 1.46 -0.12 -0.33 0.00 -1.65 0.00 0.00 29.97 29.34 2qb9 h ARG 68 CO -0.32 0.34 -0.42 1.21 0.56 0.00 0.00 179.97 181.34 2qb9 s ASN 69 N -5.56 5.48 0.00 7.04 2.47 -0.18 -5.06 114.94 119.13 2qb9 s ASN 69 Ca -0.09 -2.23 0.00 0.00 0.42 0.00 0.00 52.86 50.96 2qb9 s ASN 69 Cb 0.23 -1.92 0.00 0.00 -1.45 0.00 0.00 41.25 38.12 2qb9 s ASN 69 CO 0.79 -0.55 0.00 0.23 -3.72 0.00 0.00 177.10 173.85 2qb9 n MET 70 N 4.39 2.59 -3.57 0.43 2.81 -1.24 -4.31 117.12 118.21 2qb9 n MET 70 Ca -0.01 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.81 2qb9 n MET 70 Cb 0.41 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.88 2qb9 n MET 70 CO 0.00 0.00 0.00 -1.50 1.51 0.00 0.00 175.97 175.98 2qb9 s ILE 71 N -0.02 0.00 -0.01 2.02 2.07 0.06 -4.82 121.20 120.51 2qb9 s ILE 71 Ca 0.00 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.31 2qb9 s ILE 71 Cb 0.00 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.56 2qb9 s ILE 71 CO 0.00 0.00 -0.21 0.20 -1.91 0.00 0.00 174.94 173.02 2qb9 s ASN 72 N -1.78 3.47 -0.03 4.50 -0.87 -1.26 -1.92 114.94 117.05 2qb9 s ASN 72 Ca 0.04 -0.41 0.01 0.00 -1.57 0.00 0.00 52.86 50.93 2qb9 s ASN 72 Cb -0.01 -0.52 0.02 0.00 -0.02 0.00 0.00 41.25 40.73 2qb9 s ASN 72 CO -0.04 0.31 -0.01 -0.69 -2.57 0.00 0.00 177.10 174.09 2qb9 s VAL 73 N -0.73 0.27 -1.08 1.60 1.01 -0.25 -4.87 120.40 116.35 2qb9 s VAL 73 Ca 0.12 0.01 -0.24 0.00 0.00 0.00 0.00 61.98 61.86 2qb9 s VAL 73 Cb -0.10 -0.33 -0.09 0.00 0.00 0.00 0.00 36.38 35.86 2qb9 s VAL 73 CO 0.01 0.15 1.97 0.00 0.00 0.00 0.00 175.10 177.24 2qb9 s ALA 74 N 0.84 1.60 -0.78 5.51 0.00 -1.26 -4.76 121.76 122.91 2qb9 s ALA 74 Ca -0.09 -1.86 -0.23 0.00 0.00 0.00 0.00 51.96 49.78 2qb9 s ALA 74 Cb -0.12 -4.64 0.07 0.00 0.00 0.00 0.00 23.12 18.43 2qb9 s ALA 74 CO -0.01 -5.30 1.11 -0.51 0.00 0.00 0.00 175.76 171.06 2qb9 s LEU 75 N 11.46 4.21 -0.47 0.00 1.43 -1.26 -4.31 118.68 129.74 2qb9 s LEU 75 Ca 0.71 -1.19 -0.27 0.00 -1.03 0.00 0.00 54.13 52.36 2qb9 s LEU 75 Cb -0.03 -2.46 -0.05 0.00 0.03 0.00 0.00 46.19 43.68 2qb9 s LEU 75 CO 0.10 -1.44 2.19 0.21 0.23 0.00 0.00 176.35 177.64 2qb9 s ASN 76 N 3.85 4.91 1.43 2.29 2.47 -1.22 -4.61 114.94 124.06 2qb9 s ASN 76 Ca 0.30 1.02 0.00 0.00 0.42 0.00 0.00 52.86 54.59 2qb9 s ASN 76 Cb -0.11 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 2qb9 s ASN 76 CO 0.04 -2.53 0.00 -3.20 -3.72 0.00 0.00 177.10 167.69 2qb9 n ASN 77 N 14.06 0.00 -0.21 -4.21 2.85 -1.26 -2.79 115.26 123.70 2qb9 n ASN 77 Ca 0.30 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.81 2qb9 n ASN 77 Cb 0.52 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.56 2qb9 n ASN 77 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2qb9 n GLY 78 N 0.00 -0.54 0.00 8.20 0.00 -1.26 -4.99 105.19 106.60 2qb9 n GLY 78 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qb9 n GLY 78 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2qb9 n THR 79 N 0.06 0.00 -2.70 2.61 5.66 -1.12 0.51 114.28 119.30 2qb9 n THR 79 Ca 0.03 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.79 2qb9 n THR 79 Cb 0.15 -0.27 0.02 0.00 -1.55 0.00 0.00 70.33 68.68 2qb9 n THR 79 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2qb9 s LEU 80 N 0.00 3.43 0.25 1.09 1.43 -1.26 -3.37 118.68 120.25 2qb9 s LEU 80 Ca 0.00 0.42 0.10 0.00 -1.03 0.00 0.00 54.13 53.62 2qb9 s LEU 80 Cb 0.00 -3.27 0.28 0.00 0.03 0.00 0.00 46.19 43.23 2qb9 s LEU 80 CO 0.00 -0.91 1.57 -0.61 0.23 0.00 0.00 176.35 176.63 2qb9 h GLN 81 N 0.12 0.02 -1.11 1.70 5.75 -1.87 -3.41 115.11 116.31 2qb9 h GLN 81 Ca -0.45 -0.02 0.37 0.00 -0.15 0.00 0.00 58.65 58.40 2qb9 h GLN 81 Cb 1.26 0.00 -0.15 0.00 1.07 0.00 0.00 27.48 29.66 2qb9 h GLN 81 CO 0.58 0.67 0.96 -3.38 -2.65 0.00 0.00 178.83 175.01 2qb9 s HIS 82 N -3.52 -0.01 0.20 3.99 -3.43 -1.26 -5.00 115.29 106.25 2qb9 s HIS 82 Ca -0.01 -0.01 -0.31 0.00 -0.80 0.00 0.00 55.06 53.93 2qb9 s HIS 82 Cb 0.12 0.51 -0.10 0.00 -1.43 0.00 0.00 32.58 31.68 2qb9 s HIS 82 CO 0.77 -0.06 1.52 -1.25 -2.00 0.00 0.00 174.74 173.72 2qb9 s PRO 83 N -2.10 4.23 0.15 -0.38 0.04 -1.26 -4.58 135.00 131.10 2qb9 s PRO 83 Ca 0.14 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2qb9 s PRO 83 Cb 0.06 -3.13 -0.00 0.00 0.04 0.00 0.00 34.50 31.46 2qb9 s PRO 83 CO -0.06 -0.54 0.01 1.33 0.04 0.00 0.00 177.00 177.79 2qb9 n VAL 84 N 3.27 0.00 -2.98 -0.36 0.24 -0.86 -4.94 118.33 112.70 2qb9 n VAL 84 Ca 0.11 -0.76 -0.07 0.00 -2.04 0.00 0.00 64.34 61.58 2qb9 n VAL 84 Cb 0.39 0.19 -0.01 0.00 -1.47 0.00 0.00 33.84 32.93 2qb9 n VAL 84 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2qb9 s LYS 85 N -2.56 0.97 0.71 7.34 2.20 -1.26 -1.95 119.74 125.19 2qb9 s LYS 85 Ca 0.02 -1.00 -0.11 0.00 -0.36 0.00 0.00 55.97 54.51 2qb9 s LYS 85 Cb 0.00 -0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.11 2qb9 s LYS 85 CO 0.01 -1.30 1.08 0.20 -0.36 0.00 0.00 175.35 174.99 2qb9 s GLY 86 N 1.03 1.64 -0.04 5.54 0.00 -0.74 -4.84 107.32 109.90 2qb9 s GLY 86 Ca 0.26 -0.22 -0.29 0.00 0.00 0.00 0.00 44.72 44.47 2qb9 s GLY 86 CO -0.07 0.13 0.81 0.54 0.00 0.00 0.00 173.10 174.51 2qb9 s VAL 87 N -3.25 0.00 -0.30 1.40 0.11 -1.25 -0.17 120.40 116.94 2qb9 s VAL 87 Ca 0.58 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.47 2qb9 s VAL 87 Cb -0.12 -1.00 0.17 0.00 -1.53 0.00 0.00 36.38 33.89 2qb9 s VAL 87 CO 0.53 0.00 1.04 -2.28 -3.33 0.00 0.00 175.10 171.06 2qb9 s HIS 88 N -2.02 -0.51 0.00 1.54 2.46 0.43 -4.75 115.29 112.44 2qb9 s HIS 88 Ca -0.03 0.94 0.00 0.00 0.47 0.00 0.00 55.06 56.45 2qb9 s HIS 88 Cb -0.01 0.30 0.00 0.00 -0.13 0.00 0.00 32.58 32.75 2qb9 s HIS 88 CO -0.01 -0.25 0.00 2.41 -2.47 0.00 0.00 174.74 174.42 2qb9 n THR 89 N 4.17 0.00 -0.30 0.89 -1.04 -1.26 -1.39 114.28 115.35 2qb9 n THR 89 Ca -0.14 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 61.93 2qb9 n THR 89 Cb 0.55 0.00 0.29 0.00 -1.82 0.00 0.00 70.33 69.36 2qb9 n THR 89 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qb9 n GLY 90 N 0.00 2.43 3.32 3.41 0.00 -1.26 -4.84 105.19 108.25 2qb9 n GLY 90 Ca 0.00 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 2qb9 n GLY 90 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qb9 s SER 91 N -0.66 4.83 -0.13 1.61 0.15 -0.49 0.13 113.70 119.15 2qb9 s SER 91 Ca 0.40 -0.64 0.02 0.00 0.70 0.00 0.00 55.95 56.44 2qb9 s SER 91 Cb 0.29 -1.82 0.01 0.00 -1.71 0.00 0.00 66.02 62.79 2qb9 s SER 91 CO 0.14 -0.13 -0.20 -0.13 1.20 0.00 0.00 173.24 174.11 2qb9 s ARG 92 N 1.47 2.82 0.17 5.44 0.52 -0.89 -0.43 118.95 128.06 2qb9 s ARG 92 Ca 0.03 -0.78 0.10 0.00 -0.52 0.00 0.00 55.73 54.56 2qb9 s ARG 92 Cb -0.16 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 32.98 2qb9 s ARG 92 CO 0.00 -0.01 -0.22 0.08 0.02 0.00 0.00 175.30 175.17 2qb9 s VAL 93 N 0.82 2.10 -0.29 3.52 1.01 0.76 0.11 120.40 128.43 2qb9 s VAL 93 Ca -0.08 -1.93 -0.01 0.00 0.00 0.00 0.00 61.98 59.96 2qb9 s VAL 93 Cb -0.16 -1.96 0.09 0.00 0.00 0.00 0.00 36.38 34.35 2qb9 s VAL 93 CO -0.01 -0.17 0.08 0.12 0.00 0.00 0.00 175.10 175.12 2qb9 s PHE 94 N -1.72 1.64 0.54 5.22 2.19 -0.61 -1.79 117.98 123.44 2qb9 s PHE 94 Ca 0.17 -1.59 -0.05 0.00 0.33 0.00 0.00 56.93 55.79 2qb9 s PHE 94 Cb -0.07 -1.59 -0.01 0.00 -1.31 0.00 0.00 43.02 40.04 2qb9 s PHE 94 CO 0.08 -0.83 0.85 -1.64 1.83 0.00 0.00 175.22 175.51 2qb9 s MET 95 N 1.64 3.16 -0.29 10.12 -1.94 -0.82 -1.67 119.30 129.49 2qb9 s MET 95 Ca 0.07 0.04 -0.17 0.00 -1.71 0.00 0.00 55.69 53.92 2qb9 s MET 95 Cb -0.17 -2.33 0.14 0.00 2.01 0.00 0.00 34.83 34.48 2qb9 s MET 95 CO -0.21 -0.49 0.99 -1.14 -0.01 0.00 0.00 175.02 174.15 2qb9 s GLN 96 N -4.87 0.40 0.15 2.03 0.74 -1.26 -2.04 119.66 114.80 2qb9 s GLN 96 Ca 0.51 0.65 -0.31 0.00 0.05 0.00 0.00 55.36 56.26 2qb9 s GLN 96 Cb -0.10 0.10 -0.09 0.00 1.10 0.00 0.00 33.01 34.01 2qb9 s GLN 96 CO 0.45 -0.08 1.47 -1.25 -0.55 0.00 0.00 175.29 175.33 2qb9 s PRO 97 N 1.17 4.27 0.53 1.67 0.04 -1.26 -2.53 135.00 138.89 2qb9 s PRO 97 Ca -0.07 2.22 0.08 0.00 0.04 0.00 0.00 61.00 63.27 2qb9 s PRO 97 Cb -0.04 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.36 2qb9 s PRO 97 CO -0.14 -0.51 0.58 0.00 0.04 0.00 0.00 177.00 176.97 2qb9 s ALA 98 N 1.01 4.52 0.81 8.56 0.00 -0.93 -4.88 121.76 130.84 2qb9 s ALA 98 Ca 0.66 -1.76 -0.11 0.00 0.00 0.00 0.00 51.96 50.76 2qb9 s ALA 98 Cb -0.40 -1.15 0.07 0.00 0.00 0.00 0.00 23.12 21.65 2qb9 s ALA 98 CO 0.32 -0.59 1.09 0.45 0.00 0.00 0.00 175.76 177.03 2qb9 s SER 99 N -4.43 4.39 0.00 0.00 0.15 -1.26 -4.80 113.70 107.74 2qb9 s SER 99 Ca 0.49 1.37 0.01 0.00 0.70 0.00 0.00 55.95 58.52 2qb9 s SER 99 Cb -0.04 -2.10 0.05 0.00 -1.71 0.00 0.00 66.02 62.21 2qb9 s SER 99 CO 0.31 -2.04 0.61 -0.62 1.20 0.00 0.00 173.24 172.69 2qb9 n GLU 100 N -3.49 0.57 0.00 5.44 1.02 -1.26 -2.48 120.64 120.45 2qb9 n GLU 100 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 2qb9 n GLU 100 Cb 0.56 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.96 2qb9 n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qb9 n GLY 101 N 0.08 0.04 0.00 0.62 0.00 -1.26 -4.94 105.19 99.73 2qb9 n GLY 101 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2qb9 n GLY 101 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2qb9 n THR 102 N -1.31 0.00 0.00 2.61 -1.04 -1.03 -5.07 114.28 108.43 2qb9 n THR 102 Ca 0.00 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2qb9 n THR 102 Cb 0.00 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 2qb9 n THR 102 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qb9 n GLY 103 N 0.16 1.16 3.74 3.41 0.00 -1.26 -5.03 105.19 107.38 2qb9 n GLY 103 Ca 0.00 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2qb9 n GLY 103 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qb9 s ILE 104 N -1.07 3.18 -0.36 -0.61 2.07 -0.79 -1.75 121.20 121.86 2qb9 s ILE 104 Ca 0.00 0.98 0.02 0.00 -1.41 0.00 0.00 60.65 60.24 2qb9 s ILE 104 Cb 0.00 -3.63 0.15 0.00 0.13 0.00 0.00 42.46 39.11 2qb9 s ILE 104 CO 0.00 0.15 0.34 -0.63 -1.91 0.00 0.00 174.94 172.89 2qb9 s ILE 105 N 0.04 -0.26 0.27 2.00 1.01 -1.14 -4.91 121.20 118.23 2qb9 s ILE 105 Ca 0.56 -1.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.00 2qb9 s ILE 105 Cb -0.37 -0.78 0.01 0.00 0.01 0.00 0.00 42.46 41.33 2qb9 s ILE 105 CO 0.39 -0.64 0.57 0.00 0.00 0.00 0.00 174.94 175.25 2qb9 s ALA 106 N 1.46 -0.48 0.93 9.38 0.00 -1.26 -2.82 121.76 128.96 2qb9 s ALA 106 Ca 0.16 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.37 2qb9 s ALA 106 Cb -0.16 0.99 0.00 0.00 0.00 0.00 0.00 23.12 23.94 2qb9 s ALA 106 CO -0.06 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.20 2qb9 n GLY 107 N -0.43 0.16 0.00 0.00 0.00 -1.26 -4.55 105.19 99.12 2qb9 n GLY 107 Ca -0.03 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2qb9 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qb9 n GLY 108 N 4.08 -2.03 0.21 -0.02 0.00 -1.26 -2.53 105.19 103.63 2qb9 n GLY 108 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2qb9 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qb9 h ALA 109 N -2.07 1.28 0.08 4.61 0.00 -1.92 -1.28 119.26 119.96 2qb9 h ALA 109 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qb9 h ALA 109 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qb9 h ALA 109 CO 0.00 -0.28 -0.04 0.52 0.00 0.00 0.00 179.25 179.46 2qb9 h MET 110 N 0.00 -0.10 0.10 0.00 2.07 -1.90 -3.26 114.93 111.84 2qb9 h MET 110 Ca 0.00 0.01 -0.28 0.00 -2.07 0.00 0.00 59.70 57.36 2qb9 h MET 110 Cb 0.73 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 30.47 2qb9 h MET 110 CO 0.00 0.00 -1.33 0.07 1.07 0.00 0.00 176.91 176.72 2qb9 h ARG 111 N -0.18 0.21 -0.89 1.72 0.11 -0.94 -3.31 114.38 111.11 2qb9 h ARG 111 Ca -0.01 -0.36 0.26 0.00 0.10 0.00 0.00 59.98 59.97 2qb9 h ARG 111 Cb 0.15 0.13 -0.04 0.00 1.11 0.00 0.00 29.97 31.32 2qb9 h ARG 111 CO 0.02 1.11 0.82 0.00 0.10 0.00 0.00 179.97 182.02 2qb9 h ALA 112 N 0.63 2.74 0.07 0.08 0.00 -1.57 -0.74 119.26 120.47 2qb9 h ALA 112 Ca -0.16 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.37 2qb9 h ALA 112 Cb 1.96 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 2qb9 h ALA 112 CO 0.17 -1.28 -1.93 1.33 0.00 0.00 0.00 179.25 177.55 2qb9 n VAL 113 N -3.75 1.66 -0.13 0.00 0.24 -1.24 -3.97 118.33 111.14 2qb9 n VAL 113 Ca 0.19 -0.46 0.07 0.00 -2.04 0.00 0.00 64.34 62.10 2qb9 n VAL 113 Cb 1.12 -1.78 0.40 0.00 -1.47 0.00 0.00 33.84 32.11 2qb9 n VAL 113 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2qb9 h LEU 114 N -0.30 0.57 0.39 1.34 3.38 -1.27 0.48 115.31 119.90 2qb9 h LEU 114 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 2qb9 h LEU 114 Cb 1.80 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.43 2qb9 h LEU 114 CO -0.05 0.37 -0.19 -0.08 0.09 0.00 0.00 178.44 178.58 2qb9 h GLU 115 N 0.65 -0.51 0.00 1.13 4.81 -1.40 -0.94 114.58 118.32 2qb9 h GLU 115 Ca 0.27 0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.40 2qb9 h GLU 115 Cb 0.26 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2qb9 h GLU 115 CO -0.08 -0.28 -0.67 -0.39 -0.73 0.00 0.00 179.01 176.86 2qb9 h VAL 116 N -0.62 1.32 0.00 0.32 -1.51 -1.59 -3.16 116.25 111.01 2qb9 h VAL 116 Ca -0.05 -2.41 -0.02 0.00 -1.23 0.00 0.00 66.70 62.99 2qb9 h VAL 116 Cb 0.46 2.36 -0.00 0.00 -2.13 0.00 0.00 31.29 31.98 2qb9 h VAL 116 CO 0.09 0.65 -0.08 0.00 -1.23 0.00 0.00 177.57 177.00 2qb9 h ALA 117 N 1.33 1.41 0.00 5.19 0.00 -0.03 -0.03 119.26 127.14 2qb9 h ALA 117 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qb9 h ALA 117 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2qb9 h ALA 117 CO 0.09 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.84 2qb9 n GLY 118 N -0.96 0.80 3.75 0.00 0.00 -1.13 -2.95 105.19 104.70 2qb9 n GLY 118 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2qb9 n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qb9 s VAL 119 N -2.00 3.61 0.00 1.61 1.01 -0.37 -4.81 120.40 119.45 2qb9 s VAL 119 Ca 0.00 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.43 2qb9 s VAL 119 Cb 0.00 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2qb9 s VAL 119 CO 0.00 0.28 0.00 1.41 0.00 0.00 0.00 175.10 176.79 2qb9 n HIS 120 N 1.97 0.00 -3.78 5.22 -0.00 0.18 -4.30 115.22 114.51 2qb9 n HIS 120 Ca 0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.45 2qb9 n HIS 120 Cb 0.45 0.00 -0.16 0.00 -0.00 0.00 0.00 29.99 30.28 2qb9 n HIS 120 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.34 175.54 2qb9 s ASN 121 N -2.73 3.59 0.28 0.41 0.01 -1.20 -1.89 114.94 113.40 2qb9 s ASN 121 Ca 0.00 -1.25 -0.09 0.00 -0.71 0.00 0.00 52.86 50.81 2qb9 s ASN 121 Cb 0.00 -0.84 -0.00 0.00 0.41 0.00 0.00 41.25 40.82 2qb9 s ASN 121 CO 0.00 -0.34 0.47 0.68 -1.51 0.00 0.00 177.10 176.40 2qb9 s VAL 122 N 1.65 0.00 -0.47 1.60 -7.23 -0.72 -2.19 120.40 113.05 2qb9 s VAL 122 Ca 0.03 -1.48 0.06 0.00 -1.81 0.00 0.00 61.98 58.78 2qb9 s VAL 122 Cb -0.18 -2.39 0.25 0.00 0.56 0.00 0.00 36.38 34.62 2qb9 s VAL 122 CO -0.15 0.00 0.86 0.00 -0.31 0.00 0.00 175.10 175.50 2qb9 n LEU 123 N -0.43 -2.31 -4.95 1.32 -0.00 -1.05 -2.86 117.00 106.71 2qb9 n LEU 123 Ca -0.01 -3.60 -0.23 0.00 -0.00 0.00 0.00 56.01 52.18 2qb9 n LEU 123 Cb 0.62 0.82 0.02 0.00 -0.00 0.00 0.00 43.42 44.88 2qb9 n LEU 123 CO 0.26 2.03 0.32 0.00 -0.00 0.00 0.00 177.39 179.99 2qb9 s ALA 124 N 0.31 3.74 0.07 1.47 0.00 -1.13 -4.52 121.76 121.70 2qb9 s ALA 124 Ca 0.31 -1.07 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2qb9 s ALA 124 Cb 0.23 -2.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.15 2qb9 s ALA 124 CO -0.20 -0.49 -0.18 0.21 0.00 0.00 0.00 175.76 175.10 2qb9 s LYS 125 N -4.64 1.11 -0.22 0.00 2.47 -0.67 -4.60 119.74 113.19 2qb9 s LYS 125 Ca 0.51 -0.98 -0.07 0.00 -1.56 0.00 0.00 55.97 53.87 2qb9 s LYS 125 Cb -0.10 -1.23 -0.03 0.00 -1.46 0.00 0.00 37.83 35.00 2qb9 s LYS 125 CO 0.39 0.30 0.06 0.00 0.16 0.00 0.00 175.35 176.25 2qb9 s ALA 126 N -1.01 3.22 0.44 3.13 0.00 -1.26 -1.58 121.76 124.70 2qb9 s ALA 126 Ca 0.04 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.09 2qb9 s ALA 126 Cb -0.09 -1.97 -0.05 0.00 0.00 0.00 0.00 23.12 21.01 2qb9 s ALA 126 CO 0.03 -0.19 0.10 0.71 0.00 0.00 0.00 175.76 176.40 2qb9 s TYR 127 N 1.08 2.38 0.00 0.00 2.02 0.30 -5.01 117.35 118.12 2qb9 s TYR 127 Ca 0.04 -0.70 0.00 0.00 -0.37 0.00 0.00 57.07 56.04 2qb9 s TYR 127 Cb -0.14 -1.83 0.00 0.00 -0.40 0.00 0.00 41.96 39.59 2qb9 s TYR 127 CO 0.03 0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.67 2qb9 n GLY 128 N -1.18 1.02 3.77 0.71 0.00 -1.26 -2.09 105.19 106.16 2qb9 n GLY 128 Ca -0.06 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 44.88 2qb9 n GLY 128 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qb9 s SER 129 N -4.00 7.30 -0.45 1.61 1.04 0.36 -4.92 113.70 114.64 2qb9 s SER 129 Ca 0.00 2.01 0.04 0.00 0.48 0.00 0.00 55.95 58.48 2qb9 s SER 129 Cb 0.00 -2.60 0.64 0.00 0.10 0.00 0.00 66.02 64.16 2qb9 s SER 129 CO 0.00 -0.10 1.88 0.35 0.98 0.00 0.00 173.24 176.35 2qb9 n THR 130 N 0.86 3.18 -1.73 2.02 -2.24 -1.26 -4.12 114.28 110.98 2qb9 n THR 130 Ca 0.01 -2.07 -0.42 0.00 -2.27 0.00 0.00 64.05 59.29 2qb9 n THR 130 Cb 0.48 -0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 2qb9 n THR 130 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2qb9 n ASN 131 N -1.13 3.85 0.32 3.42 5.15 -1.26 -4.78 115.26 120.83 2qb9 n ASN 131 Ca 0.58 1.11 -0.17 0.00 -0.60 0.00 0.00 54.58 55.49 2qb9 n ASN 131 Cb 1.56 -1.57 -0.09 0.00 -0.53 0.00 0.00 39.78 39.14 2qb9 n ASN 131 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2qb9 h PRO 132 N 5.69 -0.90 -1.48 1.20 0.13 -1.98 0.65 132.00 135.31 2qb9 h PRO 132 Ca -0.45 0.06 0.43 0.00 -0.87 0.00 0.00 66.00 65.17 2qb9 h PRO 132 Cb 1.22 0.20 -0.06 0.00 0.13 0.00 0.00 31.00 32.49 2qb9 h PRO 132 CO 0.87 -0.60 1.09 0.82 -0.23 0.00 0.00 178.00 179.95 2qb9 h ILE 133 N -0.93 0.22 0.00 -3.56 2.04 -2.00 -1.41 117.51 111.87 2qb9 h ILE 133 Ca -0.06 0.00 -0.31 0.00 1.00 0.00 0.00 64.86 65.49 2qb9 h ILE 133 Cb 0.78 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 2qb9 h ILE 133 CO 0.02 0.00 -2.18 0.59 0.00 0.00 0.00 178.15 176.59 2qb9 n ASN 134 N -4.01 1.70 0.06 1.72 3.02 -0.99 -4.34 115.26 112.43 2qb9 n ASN 134 Ca 0.33 -0.06 -0.13 0.00 -0.03 0.00 0.00 54.58 54.68 2qb9 n ASN 134 Cb 1.56 0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 40.89 2qb9 n ASN 134 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2qb9 h VAL 135 N 0.00 0.22 -0.29 2.41 2.07 0.14 0.35 116.25 121.15 2qb9 h VAL 135 Ca -0.46 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.12 2qb9 h VAL 135 Cb 1.86 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 31.78 2qb9 h VAL 135 CO -0.03 0.00 -0.20 1.62 0.02 0.00 0.00 177.57 178.98 2qb9 h VAL 136 N -0.54 0.45 -0.82 2.57 3.04 -1.70 0.18 116.25 119.44 2qb9 h VAL 136 Ca 0.05 0.00 0.04 0.00 -1.01 0.00 0.00 66.70 65.78 2qb9 h VAL 136 Cb 0.62 0.45 -0.05 0.00 -2.01 0.00 0.00 31.29 30.30 2qb9 h VAL 136 CO -0.29 0.00 0.54 -0.09 -1.01 0.00 0.00 177.57 176.72 2qb9 h ARG 137 N -0.18 0.98 -0.50 4.17 2.43 -1.67 0.30 114.38 119.90 2qb9 h ARG 137 Ca 0.15 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 2qb9 h ARG 137 Cb 0.41 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2qb9 h ARG 137 CO -0.39 0.65 0.01 0.00 -1.51 0.00 0.00 179.97 178.72 2qb9 h ALA 138 N 1.52 0.68 0.34 2.80 0.00 0.32 -1.23 119.26 123.68 2qb9 h ALA 138 Ca 0.32 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2qb9 h ALA 138 Cb 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2qb9 h ALA 138 CO -0.10 0.48 -0.16 1.15 0.00 0.00 0.00 179.25 180.62 2qb9 h THR 139 N 0.75 0.68 -0.01 0.00 2.02 0.56 -2.39 112.91 114.53 2qb9 h THR 139 Ca 0.14 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.10 2qb9 h THR 139 Cb 0.51 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 2qb9 h THR 139 CO 0.02 0.05 -0.52 0.40 0.37 0.00 0.00 175.52 175.85 2qb9 h ILE 140 N -0.59 0.00 -1.10 3.11 2.04 -0.38 -0.30 117.51 120.29 2qb9 h ILE 140 Ca -0.05 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.11 2qb9 h ILE 140 Cb 0.43 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.42 2qb9 h ILE 140 CO 0.08 0.00 0.72 -0.78 0.00 0.00 0.00 178.15 178.17 2qb9 h ASP 141 N -0.64 0.34 0.48 1.72 1.82 -1.23 -0.26 116.42 118.64 2qb9 h ASP 141 Ca 0.01 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 2qb9 h ASP 141 Cb 0.69 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.72 2qb9 h ASP 141 CO -0.35 0.04 -0.30 1.23 -1.61 0.00 0.00 179.24 178.24 2qb9 h GLY 142 N 0.28 -0.79 0.51 -0.78 0.00 -0.51 -1.92 103.07 99.86 2qb9 h GLY 142 Ca 0.62 0.34 0.07 0.00 0.00 0.00 0.00 47.33 48.36 2qb9 h GLY 142 CO -0.26 -0.29 0.20 1.41 0.00 0.00 0.00 176.54 177.60 2qb9 h LEU 143 N -0.75 0.22 -0.30 3.11 3.38 -0.75 0.41 115.31 120.62 2qb9 h LEU 143 Ca -0.05 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2qb9 h LEU 143 Cb 0.61 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2qb9 h LEU 143 CO 0.05 0.15 0.00 1.21 0.09 0.00 0.00 178.44 179.94 2qb9 n GLU 144 N -4.99 0.04 -0.03 1.13 2.13 -0.74 -2.26 120.64 115.92 2qb9 n GLU 144 Ca 0.06 0.46 -0.09 0.00 0.66 0.00 0.00 57.16 58.25 2qb9 n GLU 144 Cb 0.21 -1.61 -0.14 0.00 0.27 0.00 0.00 31.44 30.17 2qb9 n GLU 144 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2qb9 n ASN 145 N -1.69 0.85 -4.77 4.31 5.15 0.12 -4.92 115.26 114.31 2qb9 n ASN 145 Ca 0.01 0.38 -0.38 0.00 -0.60 0.00 0.00 54.58 53.98 2qb9 n ASN 145 Cb 0.06 -0.01 -0.03 0.00 -0.53 0.00 0.00 39.78 39.28 2qb9 n ASN 145 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qb9 s MET 146 N -2.59 4.14 -0.04 1.20 0.23 -0.96 -5.05 119.30 116.24 2qb9 s MET 146 Ca -0.06 1.77 0.06 0.00 -1.03 0.00 0.00 55.69 56.43 2qb9 s MET 146 Cb 0.08 -2.71 -0.01 0.00 -1.53 0.00 0.00 34.83 30.66 2qb9 s MET 146 CO 0.82 -0.22 -0.22 0.54 -2.03 0.00 0.00 175.02 173.91 2qb9 s ASN 147 N -1.19 2.70 0.95 -1.18 2.20 -1.26 -4.78 114.94 112.39 2qb9 s ASN 147 Ca 0.56 -0.44 -0.11 0.00 -0.94 0.00 0.00 52.86 51.93 2qb9 s ASN 147 Cb -0.29 -0.58 0.16 0.00 -2.00 0.00 0.00 41.25 38.55 2qb9 s ASN 147 CO 0.37 0.24 1.09 -0.94 -2.94 0.00 0.00 177.10 174.92 2qb9 s SER 148 N -0.26 2.83 0.14 3.54 1.04 -1.26 -4.85 113.70 114.88 2qb9 s SER 148 Ca 0.01 1.77 -0.16 0.00 0.48 0.00 0.00 55.95 58.04 2qb9 s SER 148 Cb -0.11 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2qb9 s SER 148 CO 0.02 -3.09 1.74 1.55 0.98 0.00 0.00 173.24 174.44 2qb9 h PRO 149 N -1.86 0.55 0.00 4.02 0.13 -1.97 -1.13 132.00 131.75 2qb9 h PRO 149 Ca -0.49 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2qb9 h PRO 149 Cb 1.28 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2qb9 h PRO 149 CO 0.49 0.46 -0.01 1.05 -0.23 0.00 0.00 178.00 179.75 2qb9 h GLU 150 N 0.51 0.00 0.00 0.86 9.09 -1.98 0.17 114.58 123.23 2qb9 h GLU 150 Ca 0.14 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.38 2qb9 h GLU 150 Cb 0.07 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.14 2qb9 h GLU 150 CO -0.02 0.01 -0.81 0.52 0.05 0.00 0.00 179.01 178.76 2qb9 h MET 151 N 0.00 0.00 0.14 1.06 2.86 -1.56 -2.80 114.93 114.63 2qb9 h MET 151 Ca -0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 2qb9 h MET 151 Cb 0.05 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.73 2qb9 h MET 151 CO 0.00 0.81 -0.86 0.28 1.06 0.00 0.00 176.91 178.20 2qb9 h VAL 152 N 0.00 1.48 0.00 -2.22 2.07 -0.31 -2.71 116.25 114.56 2qb9 h VAL 152 Ca -0.01 -2.52 0.00 0.00 0.82 0.00 0.00 66.70 64.99 2qb9 h VAL 152 Cb 1.44 3.14 0.00 0.00 -1.52 0.00 0.00 31.29 34.35 2qb9 h VAL 152 CO 0.11 0.72 0.00 0.00 0.02 0.00 0.00 177.57 178.41 2qb9 n ALA 153 N -2.67 1.14 0.01 1.67 0.00 -0.07 -1.03 120.51 119.56 2qb9 n ALA 153 Ca -0.14 0.18 -0.20 0.00 0.00 0.00 0.00 53.44 53.29 2qb9 n ALA 153 Cb 0.84 -1.33 -0.14 0.00 0.00 0.00 0.00 19.45 18.82 2qb9 n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qb9 h ALA 154 N 2.04 0.45 -0.74 0.00 0.00 -1.46 -3.36 119.26 116.19 2qb9 h ALA 154 Ca 0.00 -1.38 0.03 0.00 0.00 0.00 0.00 54.91 53.56 2qb9 h ALA 154 Cb 0.06 0.65 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2qb9 h ALA 154 CO 0.00 1.32 0.49 0.87 0.00 0.00 0.00 179.25 181.93 2qb9 h LYS 155 N 0.07 0.90 -5.24 0.00 1.57 -0.75 -3.44 116.57 109.67 2qb9 h LYS 155 Ca -0.40 -0.05 -0.44 0.00 -1.87 0.00 0.00 60.65 57.89 2qb9 h LYS 155 Cb 2.04 -0.20 -0.14 0.00 0.08 0.00 0.00 32.23 34.00 2qb9 h LYS 155 CO 0.10 0.60 -0.64 -0.98 -0.57 0.00 0.00 179.45 177.95 2qb9 s ARG 156 N -5.79 1.51 0.10 3.15 1.70 -0.93 -4.97 118.95 113.72 2qb9 s ARG 156 Ca -0.11 -1.79 0.00 0.00 -0.47 0.00 0.00 55.73 53.36 2qb9 s ARG 156 Cb 0.18 -0.84 0.00 0.00 -0.57 0.00 0.00 34.95 33.72 2qb9 s ARG 156 CO 0.78 -0.10 0.00 0.41 -1.08 0.00 0.00 175.30 175.31 2qb9 n GLY 157 N -0.56 0.69 3.58 3.88 0.00 -1.26 -4.65 105.19 106.86 2qb9 n GLY 157 Ca -0.04 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2qb9 n GLY 157 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60