#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zjq n ASP 5 N 0.00 0.00 -3.72 0.41 -0.08 -1.26 -5.09 116.55 106.82 2zjq n ASP 5 Ca 0.00 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.16 2zjq n ASP 5 Cb 0.00 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.35 2zjq n ASP 5 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2zjq s LEU 6 N 0.00 0.26 -0.33 -2.67 2.96 -1.26 -5.14 118.68 112.49 2zjq s LEU 6 Ca 0.00 0.78 -0.03 0.00 -0.22 0.00 0.00 54.13 54.66 2zjq s LEU 6 Cb 0.00 1.23 0.19 0.00 0.50 0.00 0.00 46.19 48.11 2zjq s LEU 6 CO 0.00 -0.16 0.87 -1.59 -1.32 0.00 0.00 176.35 174.14 2zjq s LYS 7 N 0.88 0.39 0.61 1.98 0.00 -1.26 -5.00 119.74 117.35 2zjq s LYS 7 Ca -0.06 0.04 0.30 0.00 0.00 0.00 0.00 55.97 56.26 2zjq s LYS 7 Cb -0.06 0.09 1.66 0.00 0.00 0.00 0.00 37.83 39.52 2zjq s LYS 7 CO -0.07 -0.62 1.92 -1.00 0.00 0.00 0.00 175.35 175.59 2zjq h PRO 8 N 6.69 0.00 -2.98 1.78 0.13 -2.08 -3.47 132.00 132.07 2zjq h PRO 8 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2zjq h PRO 8 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2zjq h PRO 8 CO 0.00 0.00 -0.75 0.25 -0.23 0.00 0.00 178.00 177.27 2zjq n THR 9 N -2.80 -3.33 -4.07 1.56 -2.24 -1.26 -5.02 114.28 97.12 2zjq n THR 9 Ca -0.02 1.53 -0.27 0.00 -2.27 0.00 0.00 64.05 63.02 2zjq n THR 9 Cb 0.30 -2.28 -0.05 0.00 -2.10 0.00 0.00 70.33 66.20 2zjq n THR 9 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2zjq s PRO 10 N -4.68 2.94 0.00 -0.78 0.04 -1.26 -4.58 135.00 126.68 2zjq s PRO 10 Ca 0.00 -0.83 0.00 0.00 0.04 0.00 0.00 61.00 60.21 2zjq s PRO 10 Cb 0.00 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2zjq s PRO 10 CO 0.00 0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.95 2zjq n GLY 11 N -0.28 0.45 0.18 0.56 0.00 -1.26 -4.80 105.19 100.05 2zjq n GLY 11 Ca -0.08 -1.50 0.01 0.00 0.00 0.00 0.00 46.02 44.45 2zjq n GLY 11 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2zjq n SER 12 N 0.00 -0.27 0.11 1.61 2.88 -1.26 0.27 113.62 116.96 2zjq n SER 12 Ca 0.00 0.84 -0.04 0.00 -1.33 0.00 0.00 58.87 58.34 2zjq n SER 12 Cb 0.00 -0.21 0.06 0.00 -0.75 0.00 0.00 64.21 63.31 2zjq n SER 12 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2zjq h ARG 13 N 0.00 0.04 0.00 -1.46 0.11 -1.90 -3.14 114.38 108.03 2zjq h ARG 13 Ca 0.19 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.22 2zjq h ARG 13 Cb 0.31 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.40 2zjq h ARG 13 CO -0.48 0.78 0.00 1.17 0.10 0.00 0.00 179.97 181.53 2zjq n LYS 14 N -3.67 0.56 -2.54 0.08 3.00 0.78 -4.74 118.16 111.64 2zjq n LYS 14 Ca -0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.87 2zjq n LYS 14 Cb 0.73 -1.33 -0.02 0.00 0.00 0.00 0.00 35.03 34.41 2zjq n LYS 14 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2zjq s ASP 15 N -1.81 6.52 0.40 3.14 2.15 -1.00 -4.74 116.67 121.33 2zjq s ASP 15 Ca 0.18 0.47 -0.06 0.00 0.43 0.00 0.00 52.55 53.57 2zjq s ASP 15 Cb 0.08 -2.55 -0.05 0.00 -0.30 0.00 0.00 42.92 40.11 2zjq s ASP 15 CO 0.14 -1.35 0.70 -0.13 -0.17 0.00 0.00 175.17 174.35 2zjq s ARG 16 N 4.69 3.61 0.00 4.34 0.52 -1.26 -5.08 118.95 125.77 2zjq s ARG 16 Ca 0.50 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.85 2zjq s ARG 16 Cb -0.09 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 32.90 2zjq s ARG 16 CO 0.31 -0.02 0.00 1.63 0.02 0.00 0.00 175.30 177.24 2zjq n LYS 17 N -1.66 0.00 0.00 3.54 5.02 -1.26 -5.02 118.16 118.77 2zjq n LYS 17 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2zjq n LYS 17 Cb 0.55 -0.09 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 2zjq n LYS 17 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2zjq n ARG 18 N 0.00 0.00 -2.08 1.97 1.74 -1.26 -4.94 116.66 112.09 2zjq n ARG 18 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2zjq n ARG 18 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2zjq n ARG 18 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2zjq n VAL 19 N 0.00 0.00 0.00 1.55 0.31 -1.26 -4.59 118.33 114.34 2zjq n VAL 19 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2zjq n VAL 19 Cb 0.00 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 30.68 2zjq n VAL 19 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2zjq n GLY 20 N -0.88 0.34 0.24 2.92 0.00 -1.26 -5.01 105.19 101.55 2zjq n GLY 20 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2zjq n GLY 20 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2zjq h ARG 21 N 0.00 0.09 -0.85 1.61 2.43 -1.92 -3.42 114.38 112.31 2zjq h ARG 21 Ca 0.00 -0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.33 2zjq h ARG 21 Cb 0.00 -0.02 -0.22 0.00 -0.42 0.00 0.00 29.97 29.31 2zjq h ARG 21 CO 0.00 0.06 0.03 0.20 -1.51 0.00 0.00 179.97 178.74 2zjq s GLY 22 N -3.47 -0.51 0.50 2.80 0.00 -1.26 -5.06 107.32 100.33 2zjq s GLY 22 Ca -0.14 2.57 -0.18 0.00 0.00 0.00 0.00 44.72 46.97 2zjq s GLY 22 CO 0.74 3.47 1.00 2.56 0.00 0.00 0.00 173.10 180.86 2zjq s PRO 23 N 2.78 3.88 0.33 2.90 0.04 -1.26 -5.04 135.00 138.62 2zjq s PRO 23 Ca 0.04 1.10 -0.29 0.00 0.04 0.00 0.00 61.00 61.90 2zjq s PRO 23 Cb -0.11 -2.12 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 2zjq s PRO 23 CO -0.16 -0.34 1.40 0.20 0.04 0.00 0.00 177.00 178.14 2zjq s GLY 24 N -2.63 2.81 0.00 0.56 0.00 -1.26 -5.02 107.32 101.78 2zjq s GLY 24 Ca 0.62 1.38 0.00 0.00 0.00 0.00 0.00 44.72 46.72 2zjq s GLY 24 CO 0.26 2.11 0.00 0.61 0.00 0.00 0.00 173.10 176.08 2zjq n GLY 25 N 1.04 -1.85 2.69 0.20 0.00 -1.26 -5.01 105.19 100.99 2zjq n GLY 25 Ca 0.02 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 2zjq n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zjq s THR 26 N -0.05 -0.20 -0.25 2.61 2.01 -1.26 -5.12 115.64 113.39 2zjq s THR 26 Ca 0.00 -0.08 -0.10 0.00 0.31 0.00 0.00 61.69 61.82 2zjq s THR 26 Cb 0.00 -0.58 -0.05 0.00 0.01 0.00 0.00 72.50 71.89 2zjq s THR 26 CO 0.00 -0.20 0.15 -1.81 -0.69 0.00 0.00 174.62 172.08 2zjq s ASP 27 N 2.23 5.95 -0.94 3.53 1.01 -1.26 -5.01 116.67 122.18 2zjq s ASP 27 Ca 0.04 0.04 -0.25 0.00 0.71 0.00 0.00 52.55 53.09 2zjq s ASP 27 Cb -0.15 -2.08 -0.11 0.00 1.01 0.00 0.00 42.92 41.58 2zjq s ASP 27 CO -0.10 0.02 2.13 -0.54 0.21 0.00 0.00 175.17 176.89 2zjq s LYS 28 N 1.30 2.01 -0.32 8.23 -0.14 -1.26 -4.46 119.74 125.11 2zjq s LYS 28 Ca 0.07 -0.18 -0.03 0.00 -1.36 0.00 0.00 55.97 54.46 2zjq s LYS 28 Cb -0.14 -4.98 0.28 0.00 -1.68 0.00 0.00 37.83 31.30 2zjq s LYS 28 CO 0.06 -4.16 1.27 2.41 -0.76 0.00 0.00 175.35 174.17 2zjq n THR 29 N 8.35 0.00 -2.94 2.17 -1.04 -1.26 -4.85 114.28 114.72 2zjq n THR 29 Ca 0.43 -0.58 -0.44 0.00 -2.04 0.00 0.00 64.05 61.42 2zjq n THR 29 Cb 0.46 1.04 -0.00 0.00 -1.82 0.00 0.00 70.33 70.01 2zjq n THR 29 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2zjq s ALA 30 N 0.06 3.98 0.00 2.41 0.00 -1.26 -4.86 121.76 122.09 2zjq s ALA 30 Ca 0.26 -3.34 0.00 0.00 0.00 0.00 0.00 51.96 48.87 2zjq s ALA 30 Cb 0.20 -4.13 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2zjq s ALA 30 CO -0.07 -2.79 0.00 0.41 0.00 0.00 0.00 175.76 173.32 2zjq n GLY 31 N 4.15 -0.29 3.70 0.00 0.00 -1.26 -4.68 105.19 106.81 2zjq n GLY 31 Ca 0.37 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 2zjq n GLY 31 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2zjq s ARG 32 N -1.22 4.47 0.00 1.61 3.00 -1.26 -4.12 118.95 121.43 2zjq s ARG 32 Ca 0.00 1.44 0.00 0.00 -1.00 0.00 0.00 55.73 56.17 2zjq s ARG 32 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 34.95 31.44 2zjq s ARG 32 CO 0.00 -0.23 0.00 0.41 0.00 0.00 0.00 175.30 175.48 2zjq n GLY 33 N 3.05 0.34 3.57 8.12 0.00 -1.26 -5.15 105.19 113.85 2zjq n GLY 33 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 2zjq n GLY 33 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2zjq s HIS 34 N -0.34 3.02 -0.47 1.61 3.76 -1.26 -4.94 115.29 116.68 2zjq s HIS 34 Ca 0.00 -0.06 0.05 0.00 -0.15 0.00 0.00 55.06 54.90 2zjq s HIS 34 Cb 0.00 -1.82 0.26 0.00 1.11 0.00 0.00 32.58 32.13 2zjq s HIS 34 CO 0.00 0.23 0.98 1.63 -0.85 0.00 0.00 174.74 176.73 2zjq n LYS 35 N 2.68 0.75 -0.89 1.40 5.02 -1.26 -4.92 118.16 120.94 2zjq n LYS 35 Ca -0.18 -1.65 -0.33 0.00 -2.02 0.00 0.00 58.31 54.14 2zjq n LYS 35 Cb 0.53 -1.24 0.03 0.00 -0.02 0.00 0.00 35.03 34.34 2zjq n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zjq n GLY 36 N 1.36 -3.69 3.13 0.72 0.00 -1.26 -4.86 105.19 100.58 2zjq n GLY 36 Ca 0.07 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2zjq n GLY 36 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2zjq n GLN 37 N 2.23 0.00 0.00 1.61 1.13 -1.26 -4.80 117.38 116.29 2zjq n GLN 37 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 2zjq n GLN 37 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.90 2zjq n GLN 37 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2zjq n LYS 38 N 0.00 0.00 0.00 -1.09 5.02 -1.26 -5.00 118.16 115.83 2zjq n LYS 38 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2zjq n LYS 38 Cb 0.00 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 2zjq n LYS 38 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2zjq n SER 39 N -0.28 0.00 0.00 4.39 2.88 -1.26 -5.14 113.62 114.21 2zjq n SER 39 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2zjq n SER 39 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2zjq n SER 39 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2zjq n ARG 40 N 0.00 0.00 -1.12 -1.46 1.74 -1.26 -4.98 116.66 109.59 2zjq n ARG 40 Ca 0.00 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.04 2zjq n ARG 40 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 2zjq n ARG 40 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2zjq n SER 41 N -0.81 -4.81 -3.51 0.55 3.41 -1.26 -4.98 113.62 102.23 2zjq n SER 41 Ca 0.00 0.10 -0.09 0.00 -0.26 0.00 0.00 58.87 58.62 2zjq n SER 41 Cb 0.00 -2.66 -0.09 0.00 -0.26 0.00 0.00 64.21 61.20 2zjq n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2zjq s GLY 42 N -2.26 -0.38 0.00 5.00 0.00 -1.26 -5.11 107.32 103.31 2zjq s GLY 42 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 44.72 45.92 2zjq s GLY 42 CO 0.00 2.52 0.00 0.00 0.00 0.00 0.00 173.10 175.62 2zjq n ALA 43 N 5.38 0.00 -1.48 3.20 0.00 -1.26 -4.61 120.51 121.73 2zjq n ALA 43 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2zjq n ALA 43 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2zjq n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zjq n GLY 44 N -0.41 0.00 2.97 0.00 0.00 -1.26 -4.68 105.19 101.81 2zjq n GLY 44 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2zjq n GLY 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2zjq n LYS 45 N -0.55 0.06 -3.15 1.61 0.00 -1.26 -5.15 118.16 109.71 2zjq n LYS 45 Ca 0.00 -0.45 0.04 0.00 0.00 0.00 0.00 58.31 57.90 2zjq n LYS 45 Cb 0.00 0.82 -0.01 0.00 0.00 0.00 0.00 35.03 35.85 2zjq n LYS 45 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2zjq s GLY 46 N -3.66 -1.10 0.00 3.14 0.00 -1.26 -5.02 107.32 99.42 2zjq s GLY 46 Ca 0.23 1.53 0.00 0.00 0.00 0.00 0.00 44.72 46.48 2zjq s GLY 46 CO -0.01 3.56 0.00 0.00 0.00 0.00 0.00 173.10 176.64 2zjq n ALA 47 N 5.42 0.00 0.28 3.20 0.00 -1.26 -4.91 120.51 123.24 2zjq n ALA 47 Ca 0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.63 2zjq n ALA 47 Cb 0.53 0.00 0.93 0.00 0.00 0.00 0.00 19.45 20.91 2zjq n ALA 47 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2zjq h PHE 48 N 0.00 0.00 -1.50 0.00 -1.00 -2.01 -3.46 116.94 108.97 2zjq h PHE 48 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2zjq h PHE 48 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 2zjq h PHE 48 CO 0.00 0.00 0.00 1.19 -1.61 0.00 0.00 178.31 177.89 2zjq n PHE 49 N -2.77 -1.64 -0.11 -0.55 0.99 -1.26 -4.83 117.46 107.30 2zjq n PHE 49 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 2zjq n PHE 49 Cb 0.13 0.23 0.00 0.00 -1.00 0.00 0.00 39.48 38.85 2zjq n PHE 49 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2zjq n GLU 50 N -1.34 2.12 0.00 -1.08 1.02 -1.26 -5.05 120.64 115.06 2zjq n GLU 50 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2zjq n GLU 50 Cb 0.00 -0.18 0.00 0.00 -0.02 0.00 0.00 31.44 31.24 2zjq n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2zjq n GLY 51 N 0.00 0.93 0.00 0.62 0.00 -1.26 -5.11 105.19 100.37 2zjq n GLY 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2zjq n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjq n GLY 52 N 5.00 2.26 2.42 -0.02 0.00 -1.26 -4.93 105.19 108.66 2zjq n GLY 52 Ca 0.00 -1.79 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 2zjq n GLY 52 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2zjq n ARG 53 N 1.85 2.38 0.00 1.61 -4.01 -1.26 -4.57 116.66 112.66 2zjq n ARG 53 Ca 0.00 -4.53 0.00 0.00 -1.04 0.00 0.00 57.85 52.28 2zjq n ARG 53 Cb 0.00 -2.15 0.00 0.00 -3.04 0.00 0.00 32.46 27.27 2zjq n ARG 53 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 2zjq n SER 54 N 0.84 0.00 -3.88 2.89 2.88 -1.26 -4.62 113.62 110.47 2zjq n SER 54 Ca 0.29 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.41 2zjq n SER 54 Cb 0.42 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.87 2zjq n SER 54 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2zjq n ARG 55 N -0.20 2.57 0.00 -1.46 1.74 -1.26 -4.50 116.66 113.55 2zjq n ARG 55 Ca 0.00 -2.55 0.00 0.00 -0.77 0.00 0.00 57.85 54.53 2zjq n ARG 55 Cb 0.00 -3.27 0.00 0.00 -1.02 0.00 0.00 32.46 28.17 2zjq n ARG 55 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2zjq n LEU 56 N 7.11 0.00 -0.36 0.55 4.77 -1.26 -4.65 117.00 123.16 2zjq n LEU 56 Ca 0.51 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.41 2zjq n LEU 56 Cb 0.41 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 2zjq n LEU 56 CO 0.90 0.00 0.53 0.40 -1.33 0.00 0.00 177.39 177.89 2zjq h ILE 57 N 0.00 0.01 -4.03 -0.08 1.08 -1.86 -3.15 117.51 109.48 2zjq h ILE 57 Ca 0.00 0.00 -0.31 0.00 -0.39 0.00 0.00 64.86 64.16 2zjq h ILE 57 Cb 0.00 0.01 0.09 0.00 -3.07 0.00 0.00 36.82 33.85 2zjq h ILE 57 CO 0.00 0.00 0.18 0.00 -0.69 0.00 0.00 178.15 177.64 2zjq n ALA 58 N -3.30 -0.46 0.00 1.87 0.00 -1.26 -3.79 120.51 113.58 2zjq n ALA 58 Ca 0.04 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.22 2zjq n ALA 58 Cb 0.32 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2zjq n ALA 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2zjq n ARG 59 N -2.59 0.00 -3.61 0.00 3.00 -1.26 -4.79 116.66 107.40 2zjq n ARG 59 Ca 0.11 0.00 -0.37 0.00 -0.01 0.00 0.00 57.85 57.58 2zjq n ARG 59 Cb 0.40 -2.23 -0.09 0.00 0.00 0.00 0.00 32.46 30.54 2zjq n ARG 59 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2zjq s LEU 60 N 0.00 4.11 0.35 0.55 2.96 -1.19 -5.08 118.68 120.38 2zjq s LEU 60 Ca 0.00 0.15 -0.25 0.00 -0.22 0.00 0.00 54.13 53.81 2zjq s LEU 60 Cb 0.00 -2.17 -0.10 0.00 0.50 0.00 0.00 46.19 44.43 2zjq s LEU 60 CO 0.00 0.02 0.99 -2.16 -1.32 0.00 0.00 176.35 173.88 2zjq s PRO 61 N 1.21 4.45 0.00 0.98 0.04 -1.26 -5.03 135.00 135.39 2zjq s PRO 61 Ca 0.09 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.54 2zjq s PRO 61 Cb -0.14 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.67 2zjq s PRO 61 CO 0.06 0.14 0.00 1.17 0.04 0.00 0.00 177.00 178.41 2zjq n LYS 62 N 0.37 0.00 0.00 4.56 4.81 -1.26 -5.03 118.16 121.61 2zjq n LYS 62 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 2zjq n LYS 62 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 2zjq n LYS 62 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2zjq n ARG 63 N -0.92 2.36 0.00 1.64 0.63 -1.26 -5.07 116.66 114.03 2zjq n ARG 63 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2zjq n ARG 63 Cb 0.00 -0.20 0.00 0.00 0.45 0.00 0.00 32.46 32.71 2zjq n ARG 63 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2zjq n GLY 64 N 0.00 0.00 0.00 5.14 0.00 -1.26 -4.74 105.19 104.33 2zjq n GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2zjq n GLY 64 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2zjq n PHE 65 N 0.00 0.00 -3.09 1.61 7.35 -1.26 -5.15 117.46 116.92 2zjq n PHE 65 Ca 0.00 0.00 -0.36 0.00 -0.76 0.00 0.00 57.45 56.33 2zjq n PHE 65 Cb 0.00 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 39.77 2zjq n PHE 65 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2zjq s ASN 66 N 0.00 7.09 0.05 -2.13 3.84 -1.26 -4.97 114.94 117.56 2zjq s ASN 66 Ca 0.00 1.44 0.00 0.00 0.21 0.00 0.00 52.86 54.51 2zjq s ASN 66 Cb 0.00 -2.43 0.00 0.00 -0.55 0.00 0.00 41.25 38.27 2zjq s ASN 66 CO 0.00 0.05 0.00 -3.20 -2.79 0.00 0.00 177.10 171.16 2zjq n ASN 67 N 0.81 0.04 -0.94 -4.21 2.85 -1.26 -5.09 115.26 107.46 2zjq n ASN 67 Ca -0.03 0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 2zjq n ASN 67 Cb 0.51 0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.57 2zjq n ASN 67 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 2zjq n VAL 68 N -2.69 -0.20 0.00 3.44 0.31 -1.26 -5.08 118.33 112.85 2zjq n VAL 68 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2zjq n VAL 68 Cb 0.00 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 30.74 2zjq n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2zjq n GLY 69 N -0.94 -2.44 3.93 2.92 0.00 -1.26 -4.92 105.19 102.49 2zjq n GLY 69 Ca 0.00 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.44 2zjq n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zjq s THR 70 N 0.00 5.25 -0.24 2.61 2.01 -1.26 -5.08 115.64 118.93 2zjq s THR 70 Ca 0.00 -0.45 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 2zjq s THR 70 Cb 0.00 -3.73 0.07 0.00 0.01 0.00 0.00 72.50 68.85 2zjq s THR 70 CO 0.00 -0.13 0.00 -0.89 -0.69 0.00 0.00 174.62 172.91 2zjq s THR 71 N -1.81 1.10 0.43 -0.82 2.01 -1.26 -5.13 115.64 110.17 2zjq s THR 71 Ca 0.37 -1.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.14 2zjq s THR 71 Cb -0.11 -1.54 -0.10 0.00 0.01 0.00 0.00 72.50 70.76 2zjq s THR 71 CO 0.29 -0.24 0.91 -0.31 -0.69 0.00 0.00 174.62 174.57 2zjq s TYR 72 N 1.57 3.37 -0.25 4.92 1.51 -1.26 -4.19 117.35 123.02 2zjq s TYR 72 Ca -0.01 1.46 -0.17 0.00 -1.01 0.00 0.00 57.07 57.34 2zjq s TYR 72 Cb -0.18 -2.75 -0.03 0.00 -0.11 0.00 0.00 41.96 38.89 2zjq s TYR 72 CO -0.10 -0.14 0.47 -1.21 -1.11 0.00 0.00 175.55 173.47 2zjq s GLU 73 N -3.41 4.07 -0.33 -0.62 8.01 -1.26 -4.79 118.70 120.37 2zjq s GLU 73 Ca 0.59 0.25 -0.27 0.00 0.01 0.00 0.00 54.97 55.54 2zjq s GLU 73 Cb -0.10 -3.64 0.01 0.00 -4.31 0.00 0.00 34.13 26.10 2zjq s GLU 73 CO 0.20 -0.29 0.99 0.08 0.01 0.00 0.00 175.26 176.24 2zjq s VAL 74 N 2.13 4.58 -0.55 2.63 1.01 -1.26 0.19 120.40 129.12 2zjq s VAL 74 Ca 0.20 1.52 -0.05 0.00 0.00 0.00 0.00 61.98 63.65 2zjq s VAL 74 Cb -0.16 -4.34 0.14 0.00 0.00 0.00 0.00 36.38 32.02 2zjq s VAL 74 CO 0.09 -0.44 0.38 -0.69 0.00 0.00 0.00 175.10 174.45 2zjq s VAL 75 N 3.47 3.83 0.73 2.92 1.01 -0.29 -4.98 120.40 127.10 2zjq s VAL 75 Ca 0.41 -2.47 -0.16 0.00 0.00 0.00 0.00 61.98 59.77 2zjq s VAL 75 Cb -0.13 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.75 2zjq s VAL 75 CO 0.15 -0.82 1.00 1.17 0.00 0.00 0.00 175.10 176.60 2zjq n LYS 76 N 4.08 0.49 -0.17 2.72 4.81 -1.26 -2.83 118.16 126.00 2zjq n LYS 76 Ca 0.03 0.23 -0.08 0.00 -0.87 0.00 0.00 58.31 57.61 2zjq n LYS 76 Cb 0.40 -2.26 0.01 0.00 0.02 0.00 0.00 35.03 33.20 2zjq n LYS 76 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 2zjq h LEU 77 N -0.30 0.65 -2.37 3.14 5.85 -1.52 -1.86 115.31 118.90 2zjq h LEU 77 Ca -0.47 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.09 2zjq h LEU 77 Cb 1.33 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 2zjq h LEU 77 CO 0.47 0.62 -0.02 0.77 -0.34 0.00 0.00 178.44 179.94 2zjq h SER 78 N 0.65 0.00 -0.47 1.25 4.64 -1.85 -0.39 113.55 117.37 2zjq h SER 78 Ca 0.17 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.55 2zjq h SER 78 Cb 0.15 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.22 2zjq h SER 78 CO -0.02 0.02 0.32 1.56 -0.87 0.00 0.00 176.83 177.85 2zjq h GLN 79 N 0.00 0.36 0.00 4.77 1.08 -1.69 -3.31 115.11 116.33 2zjq h GLN 79 Ca -0.00 -0.02 -0.19 0.00 -1.45 0.00 0.00 58.65 56.99 2zjq h GLN 79 Cb 0.06 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.38 2zjq h GLN 79 CO 0.00 0.24 -1.63 1.28 -0.95 0.00 0.00 178.83 177.78 2zjq n LEU 80 N -4.47 1.93 0.00 1.46 4.77 -0.26 -4.89 117.00 115.54 2zjq n LEU 80 Ca 0.06 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2zjq n LEU 80 Cb 0.27 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 2zjq n LEU 80 CO 0.35 0.07 0.00 0.00 -1.33 0.00 0.00 177.39 176.48 2zjq n GLN 81 N -4.36 0.29 0.00 3.23 6.02 -0.60 -4.24 117.38 117.72 2zjq n GLN 81 Ca -0.31 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.68 2zjq n GLN 81 Cb 0.67 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.93 2zjq n GLN 81 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2zjq n ASP 82 N -1.02 0.00 -4.11 1.08 2.03 -1.26 -4.56 116.55 108.70 2zjq n ASP 82 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 2zjq n ASP 82 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 2zjq n ASP 82 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2zjq n LEU 83 N 0.00 0.00 -1.03 -2.67 4.77 -1.26 -5.02 117.00 111.78 2zjq n LEU 83 Ca 0.00 -2.18 0.00 0.00 -0.03 0.00 0.00 56.01 53.80 2zjq n LEU 83 Cb 0.00 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2zjq n LEU 83 CO 0.00 -0.48 -0.23 -0.62 -1.33 0.00 0.00 177.39 174.73 2zjq n GLU 84 N -1.40 -2.59 -3.43 3.23 1.02 -1.26 -4.68 120.64 111.53 2zjq n GLU 84 Ca -0.03 1.95 -0.44 0.00 -0.02 0.00 0.00 57.16 58.62 2zjq n GLU 84 Cb 0.47 -2.02 -0.03 0.00 -0.02 0.00 0.00 31.44 29.84 2zjq n GLU 84 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2zjq s ASP 85 N -1.02 6.59 -0.52 1.62 1.01 -1.26 -4.75 116.67 118.34 2zjq s ASP 85 Ca 0.00 -3.08 -0.12 0.00 0.71 0.00 0.00 52.55 50.06 2zjq s ASP 85 Cb 0.00 -2.12 0.02 0.00 1.01 0.00 0.00 42.92 41.83 2zjq s ASP 85 CO 0.00 -0.42 0.23 0.41 0.21 0.00 0.00 175.17 175.60 2zjq n THR 86 N 3.36 -0.94 0.62 -1.27 -1.04 -1.26 -4.60 114.28 109.15 2zjq n THR 86 Ca 0.17 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2zjq n THR 86 Cb 0.42 -0.81 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 2zjq n THR 86 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2zjq n THR 87 N -2.59 0.00 -1.01 12.58 -2.24 -1.26 -4.82 114.28 114.94 2zjq n THR 87 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2zjq n THR 87 Cb 0.24 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 2zjq n THR 87 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2zjq n PHE 88 N -0.48 -1.87 0.00 4.78 0.99 -1.26 -4.85 117.46 114.77 2zjq n PHE 88 Ca 0.00 1.10 0.00 0.00 -0.00 0.00 0.00 57.45 58.55 2zjq n PHE 88 Cb 0.00 -2.58 0.00 0.00 -1.00 0.00 0.00 39.48 35.90 2zjq n PHE 88 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 2zjq n ASP 89 N 0.54 0.00 0.00 4.37 9.92 -1.26 -3.73 116.55 126.39 2zjq n ASP 89 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2zjq n ASP 89 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2zjq n ASP 89 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2zjq n ARG 90 N -0.19 0.00 0.00 -1.24 1.74 -1.26 -3.56 116.66 112.16 2zjq n ARG 90 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2zjq n ARG 90 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2zjq n ARG 90 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2zjq n ASP 91 N 4.58 0.00 0.00 0.55 5.75 -1.26 -4.53 116.55 121.64 2zjq n ASP 91 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2zjq n ASP 91 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2zjq n ASP 91 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2zjq n THR 92 N 0.00 0.00 0.04 2.12 -1.04 -1.23 -4.84 114.28 109.33 2zjq n THR 92 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 2zjq n THR 92 Cb 0.00 -0.21 0.05 0.00 -1.82 0.00 0.00 70.33 68.34 2zjq n THR 92 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2zjq n LEU 93 N -0.87 0.00 0.09 -4.42 4.77 -1.26 0.19 117.00 115.50 2zjq n LEU 93 Ca 0.00 0.17 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 2zjq n LEU 93 Cb 0.00 -0.03 0.38 0.00 -2.33 0.00 0.00 43.42 41.44 2zjq n LEU 93 CO 0.00 -0.17 0.92 1.05 -1.33 0.00 0.00 177.39 177.86 2zjq h GLU 94 N 0.00 0.32 0.00 3.23 4.11 -1.65 -2.73 114.58 117.86 2zjq h GLU 94 Ca 0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2zjq h GLU 94 Cb 0.68 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2zjq h GLU 94 CO -0.00 0.41 0.00 0.00 0.07 0.00 0.00 179.01 179.49 2zjq n ALA 95 N -2.49 -0.07 0.33 1.06 0.00 0.49 -1.04 120.51 118.79 2zjq n ALA 95 Ca -0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 2zjq n ALA 95 Cb 0.25 0.22 1.05 0.00 0.00 0.00 0.00 19.45 20.97 2zjq n ALA 95 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2zjq h TYR 96 N 0.00 0.00 0.00 0.00 -1.99 -1.78 1.96 116.97 115.16 2zjq h TYR 96 Ca 0.00 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.68 2zjq h TYR 96 Cb 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 2zjq h TYR 96 CO -0.20 0.00 -0.24 0.00 -0.00 0.00 0.00 178.16 177.73 2zjq h ARG 97 N 0.00 0.00 -0.85 4.88 3.08 -0.90 -3.47 114.38 117.11 2zjq h ARG 97 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2zjq h ARG 97 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2zjq h ARG 97 CO -0.00 0.24 0.00 -0.11 -1.07 0.00 0.00 179.97 179.03 2zjq n LEU 98 N -3.88 -0.57 0.00 3.04 7.94 0.67 -5.05 117.00 119.15 2zjq n LEU 98 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2zjq n LEU 98 Cb 0.32 -0.28 0.00 0.00 0.53 0.00 0.00 43.42 43.99 2zjq n LEU 98 CO 0.35 0.00 0.00 1.33 -1.11 0.00 0.00 177.39 177.96 2zjq n VAL 99 N 0.50 0.00 -2.53 1.96 0.24 -1.21 -4.97 118.33 112.32 2zjq n VAL 99 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 2zjq n VAL 99 Cb 0.00 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 2zjq n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2zjq s ARG 100 N 0.00 3.76 0.01 7.34 1.70 -1.26 -4.79 118.95 125.70 2zjq s ARG 100 Ca 0.00 0.79 0.00 0.00 -0.47 0.00 0.00 55.73 56.05 2zjq s ARG 100 Cb 0.00 -3.91 0.00 0.00 -0.57 0.00 0.00 34.95 30.47 2zjq s ARG 100 CO 0.00 -1.33 0.00 0.54 -1.08 0.00 0.00 175.30 173.43 2zjq n ARG 101 N 7.71 0.00 -1.21 3.89 5.12 -1.26 -5.15 116.66 125.77 2zjq n ARG 101 Ca 0.13 0.00 0.16 0.00 -1.93 0.00 0.00 57.85 56.21 2zjq n ARG 101 Cb 0.48 -0.40 -0.05 0.00 -1.16 0.00 0.00 32.46 31.33 2zjq n ARG 101 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2zjq n LYS 102 N -2.93 -2.58 0.00 5.56 5.02 -1.26 -4.73 118.16 117.24 2zjq n LYS 102 Ca 0.00 1.89 0.00 0.00 -2.02 0.00 0.00 58.31 58.18 2zjq n LYS 102 Cb 0.38 -3.09 0.00 0.00 -0.02 0.00 0.00 35.03 32.30 2zjq n LYS 102 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2zjq n ASN 103 N -3.96 0.00 -4.94 4.39 5.15 -1.26 -4.83 115.26 109.81 2zjq n ASN 103 Ca -0.02 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.73 2zjq n ASN 103 Cb 0.56 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.82 2zjq n ASN 103 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2zjq s ARG 104 N 0.00 2.38 0.00 1.20 0.52 -1.26 -5.10 118.95 116.69 2zjq s ARG 104 Ca 0.00 -1.73 0.00 0.00 -0.52 0.00 0.00 55.73 53.48 2zjq s ARG 104 Cb 0.00 -2.38 0.00 0.00 0.52 0.00 0.00 34.95 33.09 2zjq s ARG 104 CO 0.00 -0.55 0.00 -0.35 0.02 0.00 0.00 175.30 174.42 2zjq n PRO 105 N -1.85 0.00 -3.19 3.54 -0.04 -1.26 -4.92 135.00 127.28 2zjq n PRO 105 Ca 0.06 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.55 2zjq n PRO 105 Cb 0.62 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 34.05 2zjq n PRO 105 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2zjq s VAL 106 N 0.00 -0.08 0.25 0.52 1.01 -1.26 -4.49 120.40 116.36 2zjq s VAL 106 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.09 2zjq s VAL 106 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2zjq s VAL 106 CO 0.00 0.00 -0.17 -0.75 0.00 0.00 0.00 175.10 174.18 2zjq s LYS 107 N 2.16 1.78 -0.11 2.72 2.20 0.50 -1.57 119.74 127.42 2zjq s LYS 107 Ca -0.00 -1.62 0.02 0.00 -0.36 0.00 0.00 55.97 54.00 2zjq s LYS 107 Cb -0.02 -1.88 -0.01 0.00 -1.51 0.00 0.00 37.83 34.41 2zjq s LYS 107 CO -0.15 0.36 -0.18 -1.17 -0.36 0.00 0.00 175.35 173.84 2zjq s LEU 108 N -3.31 2.44 0.06 5.43 2.96 0.16 -1.14 118.68 125.27 2zjq s LEU 108 Ca 0.28 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.83 2zjq s LEU 108 Cb -0.06 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 2zjq s LEU 108 CO 0.15 0.19 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.44 2zjq s LEU 109 N 0.20 2.22 -0.66 -0.68 1.43 -1.13 -2.25 118.68 117.80 2zjq s LEU 109 Ca -0.11 -0.54 -0.24 0.00 -1.03 0.00 0.00 54.13 52.21 2zjq s LEU 109 Cb -0.16 -0.68 0.05 0.00 0.03 0.00 0.00 46.19 45.43 2zjq s LEU 109 CO 0.06 0.03 1.06 0.00 0.23 0.00 0.00 176.35 177.73 2zjq s ALA 110 N -0.99 3.02 0.00 4.21 0.00 -1.26 -1.39 121.76 125.34 2zjq s ALA 110 Ca 0.02 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 50.41 2zjq s ALA 110 Cb -0.09 -3.95 0.00 0.00 0.00 0.00 0.00 23.12 19.08 2zjq s ALA 110 CO 0.02 -2.85 0.00 0.43 0.00 0.00 0.00 175.76 173.36 2zjq n SER 111 N 8.15 0.00 -4.59 0.00 7.64 -1.26 -4.89 113.62 118.67 2zjq n SER 111 Ca -0.01 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.48 2zjq n SER 111 Cb 0.47 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.70 2zjq n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2zjq n GLY 112 N 2.99 -0.45 2.83 0.23 0.00 -1.26 -4.75 105.19 104.78 2zjq n GLY 112 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 2zjq n GLY 112 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zjq s GLU 113 N -2.38 0.22 0.00 1.61 2.02 -1.26 -4.31 118.70 114.60 2zjq s GLU 113 Ca 0.70 0.36 0.00 0.00 0.02 0.00 0.00 54.97 56.05 2zjq s GLU 113 Cb -0.47 -0.86 0.00 0.00 0.10 0.00 0.00 34.13 32.90 2zjq s GLU 113 CO 0.52 -0.59 0.00 1.51 0.02 0.00 0.00 175.26 176.71 2zjq n ILE 114 N 5.33 0.00 -0.42 -1.63 3.06 -1.26 -4.97 119.36 119.47 2zjq n ILE 114 Ca -0.05 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.20 2zjq n ILE 114 Cb 0.50 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.68 2zjq n ILE 114 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 2zjq n SER 115 N -0.54 -3.42 0.00 9.51 2.88 -1.26 -5.00 113.62 115.79 2zjq n SER 115 Ca 0.00 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 2zjq n SER 115 Cb 0.00 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 2zjq n SER 115 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2zjq n ARG 116 N -0.54 0.00 -2.14 -1.46 0.63 -1.26 -4.94 116.66 106.96 2zjq n ARG 116 Ca 0.00 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.58 2zjq n ARG 116 Cb 0.00 0.00 0.02 0.00 0.45 0.00 0.00 32.46 32.93 2zjq n ARG 116 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2zjq s ALA 117 N -1.96 2.63 0.00 5.13 0.00 -0.27 -4.26 121.76 123.02 2zjq s ALA 117 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.83 2zjq s ALA 117 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2zjq s ALA 117 CO 0.00 -0.94 0.00 1.33 0.00 0.00 0.00 175.76 176.15 2zjq n VAL 118 N -1.47 0.00 -3.76 0.00 0.24 -0.10 -4.84 118.33 108.40 2zjq n VAL 118 Ca 0.12 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 62.06 2zjq n VAL 118 Cb 0.51 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.76 2zjq n VAL 118 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2zjq s THR 119 N 0.00 4.78 -0.04 3.34 2.01 -1.26 -3.85 115.64 120.62 2zjq s THR 119 Ca 0.00 -0.02 -0.03 0.00 0.31 0.00 0.00 61.69 61.95 2zjq s THR 119 Cb 0.00 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.24 2zjq s THR 119 CO 0.00 0.34 0.14 -0.69 -0.69 0.00 0.00 174.62 173.72 2zjq s VAL 120 N 1.35 5.26 -0.12 3.82 1.01 -1.03 -4.41 120.40 126.27 2zjq s VAL 120 Ca 0.06 -0.12 0.16 0.00 0.00 0.00 0.00 61.98 62.09 2zjq s VAL 120 Cb -0.15 -3.40 0.26 0.00 0.00 0.00 0.00 36.38 33.10 2zjq s VAL 120 CO 0.05 0.42 1.14 1.41 0.00 0.00 0.00 175.10 178.13 2zjq n HIS 121 N 1.32 0.04 -1.45 5.22 8.25 -1.26 -1.03 115.22 126.31 2zjq n HIS 121 Ca -0.14 -0.93 -0.50 0.00 -0.26 0.00 0.00 57.72 55.89 2zjq n HIS 121 Cb 0.53 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.46 2zjq n HIS 121 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2zjq n VAL 122 N -1.27 1.44 0.20 1.59 0.24 -1.26 -4.74 118.33 114.54 2zjq n VAL 122 Ca 0.14 -0.36 0.02 0.00 -2.04 0.00 0.00 64.34 62.10 2zjq n VAL 122 Cb 0.60 -0.13 0.10 0.00 -1.47 0.00 0.00 33.84 32.94 2zjq n VAL 122 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2zjq n ASP 123 N 1.83 0.00 0.00 -1.34 -0.08 -0.94 -4.47 116.55 111.55 2zjq n ASP 123 Ca 0.18 0.02 0.00 0.00 -1.51 0.00 0.00 54.79 53.47 2zjq n ASP 123 Cb 0.21 -0.11 0.00 0.00 2.34 0.00 0.00 41.12 43.57 2zjq n ASP 123 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2zjq n ALA 124 N -1.11 0.00 -3.48 -1.67 0.00 -0.61 -4.59 120.51 109.06 2zjq n ALA 124 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.35 2zjq n ALA 124 Cb 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.47 2zjq n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjq s ALA 125 N -2.00 -0.21 0.60 0.00 0.00 -1.26 -0.67 121.76 118.22 2zjq s ALA 125 Ca 0.00 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.01 2zjq s ALA 125 Cb 0.00 0.85 0.09 0.00 0.00 0.00 0.00 23.12 24.06 2zjq s ALA 125 CO 0.00 -0.92 0.83 -1.54 0.00 0.00 0.00 175.76 174.13 2zjq s SER 126 N -3.13 4.93 0.00 0.00 1.04 -0.96 -4.85 113.70 110.74 2zjq s SER 126 Ca 0.21 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.99 2zjq s SER 126 Cb -0.03 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2zjq s SER 126 CO 0.14 -1.44 0.33 0.00 0.98 0.00 0.00 173.24 173.25 2zjq n ALA 127 N -2.38 0.00 0.00 5.32 0.00 -1.26 -0.47 120.51 121.72 2zjq n ALA 127 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2zjq n ALA 127 Cb 0.61 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.11 2zjq n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjq n ALA 128 N -1.48 1.08 -0.04 0.00 0.00 -1.26 0.31 120.51 119.12 2zjq n ALA 128 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2zjq n ALA 128 Cb 0.00 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.42 2zjq n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjq h ALA 129 N 1.89 0.20 0.11 0.00 0.00 -1.74 -3.21 119.26 116.51 2zjq h ALA 129 Ca 0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2zjq h ALA 129 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2zjq h ALA 129 CO 0.00 0.29 -0.05 0.82 0.00 0.00 0.00 179.25 180.31 2zjq h ILE 130 N 0.05 0.00 0.00 0.00 2.04 0.26 -3.32 117.51 116.53 2zjq h ILE 130 Ca -0.01 -0.62 -0.20 0.00 1.00 0.00 0.00 64.86 65.03 2zjq h ILE 130 Cb 1.01 0.00 0.04 0.00 -0.74 0.00 0.00 36.82 37.13 2zjq h ILE 130 CO 0.08 0.00 1.28 0.29 0.00 0.00 0.00 178.15 179.80 2zjq n LYS 131 N -4.11 0.24 0.00 2.37 5.02 0.97 -0.87 118.16 121.78 2zjq n LYS 131 Ca -0.02 -0.75 0.00 0.00 -2.02 0.00 0.00 58.31 55.52 2zjq n LYS 131 Cb 0.06 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 32.87 2zjq n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2zjq n ALA 132 N 5.98 0.00 -0.76 7.82 0.00 -1.21 -4.58 120.51 127.75 2zjq n ALA 132 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2zjq n ALA 132 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2zjq n ALA 132 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2zjq n VAL 133 N -1.33 0.00 -0.30 0.00 0.31 -0.05 -3.96 118.33 113.01 2zjq n VAL 133 Ca 0.00 0.68 0.13 0.00 -0.01 0.00 0.00 64.34 65.14 2zjq n VAL 133 Cb 0.00 -1.35 0.28 0.00 -0.91 0.00 0.00 33.84 31.87 2zjq n VAL 133 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2zjq h GLU 134 N 0.00 0.19 -0.18 5.55 5.08 -1.65 0.82 114.58 124.38 2zjq h GLU 134 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2zjq h GLU 134 Cb 0.00 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2zjq h GLU 134 CO 0.00 0.12 0.00 0.00 -1.00 0.00 0.00 179.01 178.13 2zjq n ALA 135 N -2.73 1.30 -0.54 3.43 0.00 -1.26 0.22 120.51 120.94 2zjq n ALA 135 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2zjq n ALA 135 Cb 0.68 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.13 2zjq n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjq n ALA 136 N 0.37 0.00 0.00 0.00 0.00 0.26 -4.96 120.51 116.18 2zjq n ALA 136 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2zjq n ALA 136 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 2zjq n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zjq n GLY 137 N 0.00 3.84 0.00 0.00 0.00 0.13 -1.12 105.19 108.05 2zjq n GLY 137 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2zjq n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjq n GLY 138 N -0.14 2.77 2.84 -0.02 0.00 -1.25 -0.93 105.19 108.47 2zjq n GLY 138 Ca 0.00 -1.99 -0.27 0.00 0.00 0.00 0.00 46.02 43.76 2zjq n GLY 138 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2zjq s ARG 139 N -2.76 1.16 0.25 1.61 3.52 -1.25 -3.29 118.95 118.18 2zjq s ARG 139 Ca 0.00 -0.33 -0.30 0.00 -0.13 0.00 0.00 55.73 54.97 2zjq s ARG 139 Cb 0.00 -1.74 -0.09 0.00 -1.56 0.00 0.00 34.95 31.56 2zjq s ARG 139 CO 0.00 -0.41 1.13 0.08 -0.81 0.00 0.00 175.30 175.29 2zjq s VAL 140 N 1.75 3.51 -0.12 7.11 1.01 -1.25 -2.48 120.40 129.93 2zjq s VAL 140 Ca 0.02 1.43 -0.00 0.00 0.00 0.00 0.00 61.98 63.43 2zjq s VAL 140 Cb -0.14 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.35 2zjq s VAL 140 CO -0.07 0.30 -0.08 -0.69 0.00 0.00 0.00 175.10 174.56 2zjq s VAL 141 N -0.79 1.09 -0.02 2.92 1.01 -0.20 -4.96 120.40 119.45 2zjq s VAL 141 Ca 0.47 -0.35 -0.00 0.00 0.00 0.00 0.00 61.98 62.09 2zjq s VAL 141 Cb -0.32 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2zjq s VAL 141 CO 0.40 0.36 0.05 -0.76 0.00 0.00 0.00 175.10 175.15 2zjq s LEU 142 N 1.68 3.75 0.73 3.92 1.43 -1.26 -4.16 118.68 124.77 2zjq s LEU 142 Ca 0.05 0.11 -0.16 0.00 -1.03 0.00 0.00 54.13 53.10 2zjq s LEU 142 Cb -0.13 -2.12 -0.01 0.00 0.03 0.00 0.00 46.19 43.96 2zjq s LEU 142 CO -0.08 0.30 0.74 -2.65 0.23 0.00 0.00 176.35 174.89 2zjq n PRO 143 N 1.42 0.37 0.00 1.29 -0.02 -1.26 -5.10 135.00 131.69 2zjq n PRO 143 Ca -0.15 0.17 0.07 0.00 -2.02 0.00 0.00 63.50 61.58 2zjq n PRO 143 Cb 0.53 -2.02 0.42 0.00 -0.02 0.00 0.00 33.50 32.40 2zjq n PRO 143 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87