#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fjf s VAL 2 N 0.00 2.81 0.07 6.31 1.01 -1.26 -4.28 120.40 125.05 2fjf s VAL 2 Ca 0.00 0.59 -0.26 0.00 0.00 0.00 0.00 61.98 62.30 2fjf s VAL 2 Cb 0.00 -3.37 0.07 0.00 0.00 0.00 0.00 36.38 33.07 2fjf s VAL 2 CO 0.00 0.05 0.63 0.00 0.00 0.00 0.00 175.10 175.78 2fjf s GLN 3 N 1.05 1.17 -0.22 2.72 -2.07 -1.01 -4.99 119.66 116.32 2fjf s GLN 3 Ca 0.68 -0.15 0.01 0.00 -1.82 0.00 0.00 55.36 54.08 2fjf s GLN 3 Cb -0.42 0.55 0.05 0.00 -1.09 0.00 0.00 33.01 32.10 2fjf s GLN 3 CO 0.32 -0.45 -0.10 -0.51 -1.32 0.00 0.00 175.29 173.22 2fjf s LEU 4 N -2.05 2.58 -0.28 2.60 1.02 -1.26 -1.15 118.68 120.14 2fjf s LEU 4 Ca -0.04 -1.04 -0.02 0.00 0.02 0.00 0.00 54.13 53.05 2fjf s LEU 4 Cb -0.01 -1.31 0.04 0.00 0.02 0.00 0.00 46.19 44.93 2fjf s LEU 4 CO -0.03 -0.16 -0.02 -0.69 0.02 0.00 0.00 176.35 175.46 2fjf s VAL 5 N 1.32 2.97 0.44 -1.59 1.01 -0.12 -3.90 120.40 120.54 2fjf s VAL 5 Ca -0.03 -1.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.73 2fjf s VAL 5 Cb -0.17 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 2fjf s VAL 5 CO -0.07 0.04 0.68 -1.61 0.00 0.00 0.00 175.10 174.14 2fjf s GLU 6 N 1.29 3.35 0.37 2.72 2.02 -1.26 -1.30 118.70 125.89 2fjf s GLU 6 Ca -0.03 -0.18 -0.14 0.00 0.02 0.00 0.00 54.97 54.65 2fjf s GLU 6 Cb -0.18 -2.51 0.04 0.00 0.10 0.00 0.00 34.13 31.58 2fjf s GLU 6 CO -0.02 -0.14 0.73 -1.54 0.02 0.00 0.00 175.26 174.31 2fjf s SER 7 N -4.13 0.12 0.00 -0.19 1.04 -1.07 -4.93 113.70 104.54 2fjf s SER 7 Ca 0.46 -1.15 0.00 0.00 0.48 0.00 0.00 55.95 55.73 2fjf s SER 7 Cb -0.10 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.83 2fjf s SER 7 CO 0.40 -1.60 0.00 0.61 0.98 0.00 0.00 173.24 173.63 2fjf n GLY 8 N -0.53 2.87 3.76 7.32 0.00 -1.26 -0.21 105.19 117.15 2fjf n GLY 8 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2fjf n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fjf s GLY 9 N -2.57 2.90 0.00 -0.02 0.00 -1.26 -4.68 107.32 101.69 2fjf s GLY 9 Ca 0.00 1.29 0.00 0.00 0.00 0.00 0.00 44.72 46.01 2fjf s GLY 9 CO 0.00 1.86 0.00 0.61 0.00 0.00 0.00 173.10 175.57 2fjf n GLY 10 N 0.63 1.67 3.46 0.20 0.00 -0.80 -4.81 105.19 105.54 2fjf n GLY 10 Ca 0.06 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 2fjf n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fjf s LEU 11 N 0.00 3.31 0.05 0.99 0.20 -1.26 -1.29 118.68 120.68 2fjf s LEU 11 Ca 0.00 -0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.67 2fjf s LEU 11 Cb 0.00 -1.84 -0.03 0.00 -0.43 0.00 0.00 46.19 43.89 2fjf s LEU 11 CO 0.00 0.07 -0.09 0.68 -0.29 0.00 0.00 176.35 176.72 2fjf s VAL 12 N 0.98 0.63 0.64 1.68 -7.23 -0.87 -5.01 120.40 111.21 2fjf s VAL 12 Ca 0.02 -1.18 -0.18 0.00 -1.81 0.00 0.00 61.98 58.83 2fjf s VAL 12 Cb -0.14 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 36.01 2fjf s VAL 12 CO 0.02 -0.40 1.03 0.00 -0.31 0.00 0.00 175.10 175.44 2fjf n GLN 13 N 1.32 0.86 -1.68 4.82 1.13 -1.20 -0.94 117.38 121.68 2fjf n GLN 13 Ca -0.22 0.34 -0.44 0.00 -1.94 0.00 0.00 57.00 54.74 2fjf n GLN 13 Cb 0.55 -2.25 -0.02 0.00 0.11 0.00 0.00 30.24 28.63 2fjf n GLN 13 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 2fjf n PRO 14 N -1.36 2.11 0.00 -1.09 -0.02 -1.26 -1.20 135.00 132.17 2fjf n PRO 14 Ca 0.14 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2fjf n PRO 14 Cb 0.48 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2fjf n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fjf n GLY 15 N 2.06 2.13 0.00 -1.23 0.00 0.15 -4.93 105.19 103.38 2fjf n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2fjf n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fjf n GLY 16 N -2.00 -1.32 2.96 -0.02 0.00 -0.34 -4.06 105.19 100.41 2fjf n GLY 16 Ca 0.00 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 2fjf n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fjf s SER 17 N -1.11 0.15 0.01 1.61 0.01 -1.26 -2.67 113.70 110.45 2fjf s SER 17 Ca 0.00 -0.33 -0.00 0.00 1.31 0.00 0.00 55.95 56.92 2fjf s SER 17 Cb 0.00 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.30 2fjf s SER 17 CO 0.00 -0.22 -0.01 -0.76 0.41 0.00 0.00 173.24 172.66 2fjf s LEU 18 N -1.03 2.14 -0.19 2.44 1.43 -0.79 -4.99 118.68 117.69 2fjf s LEU 18 Ca -0.11 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2fjf s LEU 18 Cb -0.07 0.11 0.03 0.00 0.03 0.00 0.00 46.19 46.29 2fjf s LEU 18 CO -0.01 -0.23 -0.15 -0.60 0.23 0.00 0.00 176.35 175.59 2fjf s ARG 19 N -1.10 2.47 0.00 1.70 3.52 -1.26 -0.84 118.95 123.43 2fjf s ARG 19 Ca -0.12 -0.85 -0.17 0.00 -0.13 0.00 0.00 55.73 54.46 2fjf s ARG 19 Cb -0.08 -2.47 -0.06 0.00 -1.56 0.00 0.00 34.95 30.79 2fjf s ARG 19 CO -0.01 -0.33 0.49 -0.51 -0.81 0.00 0.00 175.30 174.14 2fjf s LEU 20 N 1.34 4.45 0.28 -0.88 1.02 -1.02 -4.58 118.68 119.29 2fjf s LEU 20 Ca 0.01 1.06 0.08 0.00 0.02 0.00 0.00 54.13 55.30 2fjf s LEU 20 Cb -0.15 -2.74 -0.04 0.00 0.02 0.00 0.00 46.19 43.28 2fjf s LEU 20 CO -0.10 0.23 0.17 -0.44 0.02 0.00 0.00 176.35 176.23 2fjf s SER 21 N -0.70 5.19 -0.37 2.29 0.01 0.71 -1.60 113.70 119.24 2fjf s SER 21 Ca 0.27 -0.43 0.05 0.00 1.31 0.00 0.00 55.95 57.14 2fjf s SER 21 Cb -0.18 -1.13 0.17 0.00 0.21 0.00 0.00 66.02 65.09 2fjf s SER 21 CO 0.15 -0.12 0.47 0.00 0.41 0.00 0.00 173.24 174.15 2fjf s ALA 23 N 1.75 3.49 0.03 0.00 0.00 -0.42 -0.42 121.76 126.19 2fjf s ALA 23 Ca 0.15 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.29 2fjf s ALA 23 Cb -0.11 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 2fjf s ALA 23 CO -0.09 0.24 -0.03 0.00 0.00 0.00 0.00 175.76 175.88 2fjf s ALA 24 N -0.62 3.15 0.07 0.00 0.00 -0.73 -0.94 121.76 122.70 2fjf s ALA 24 Ca 0.33 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 51.29 2fjf s ALA 24 Cb -0.20 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 2fjf s ALA 24 CO 0.20 0.65 -0.13 -1.12 0.00 0.00 0.00 175.76 175.36 2fjf s SER 25 N -1.73 1.52 0.00 0.00 0.01 -0.30 -4.82 113.70 108.38 2fjf s SER 25 Ca 0.20 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2fjf s SER 25 Cb -0.11 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.08 2fjf s SER 25 CO 0.11 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.27 2fjf n GLY 26 N 1.28 0.31 3.79 3.44 0.00 -1.26 -2.41 105.19 110.34 2fjf n GLY 26 Ca -0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.75 2fjf n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fjf s PHE 27 N -1.74 -0.19 -0.32 1.61 -0.71 -1.26 -4.72 117.98 110.65 2fjf s PHE 27 Ca 0.00 -0.20 -0.10 0.00 -1.04 0.00 0.00 56.93 55.59 2fjf s PHE 27 Cb 0.00 0.67 -0.01 0.00 -1.21 0.00 0.00 43.02 42.47 2fjf s PHE 27 CO 0.00 -1.05 0.18 0.99 -1.34 0.00 0.00 175.22 174.00 2fjf s THR 28 N -3.65 4.75 0.29 -4.49 2.01 -1.26 -4.91 115.64 108.39 2fjf s THR 28 Ca 0.11 -0.40 0.04 0.00 0.31 0.00 0.00 61.69 61.75 2fjf s THR 28 Cb -0.04 -3.44 0.28 0.00 0.01 0.00 0.00 72.50 69.31 2fjf s THR 28 CO 0.04 0.03 1.76 0.16 -0.69 0.00 0.00 174.62 175.92 2fjf h ILE 29 N 5.63 0.68 0.00 1.82 -0.00 -1.95 -1.28 117.51 122.42 2fjf h ILE 29 Ca -0.32 -0.23 0.00 0.00 -0.00 0.00 0.00 64.86 64.31 2fjf h ILE 29 Cb 1.15 -0.05 0.00 0.00 -0.00 0.00 0.00 36.82 37.91 2fjf h ILE 29 CO 0.62 0.12 0.00 -1.54 -0.00 0.00 0.00 178.15 177.36 2fjf n SER 30 N -4.83 0.00 0.03 2.16 3.41 -1.26 -0.13 113.62 113.01 2fjf n SER 30 Ca 0.21 0.43 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 2fjf n SER 30 Cb 0.54 -0.46 0.49 0.00 -0.26 0.00 0.00 64.21 64.52 2fjf n SER 30 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2fjf n ASP 31 N -1.46 0.23 -4.42 4.04 8.00 -0.48 -0.36 116.55 122.10 2fjf n ASP 31 Ca 0.04 0.53 -0.20 0.00 0.71 0.00 0.00 54.79 55.87 2fjf n ASP 31 Cb 0.16 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 40.57 2fjf n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2fjf s TYR 32 N -3.05 1.87 0.21 1.24 1.51 0.82 -4.82 117.35 115.12 2fjf s TYR 32 Ca 0.11 -0.92 -0.30 0.00 -1.01 0.00 0.00 57.07 54.95 2fjf s TYR 32 Cb 0.14 -1.17 -0.08 0.00 -0.11 0.00 0.00 41.96 40.74 2fjf s TYR 32 CO 0.46 0.03 0.99 -1.58 -1.11 0.00 0.00 175.55 174.34 2fjf s TRP 33 N -3.29 3.84 -0.21 2.71 0.52 0.76 -2.83 118.94 120.44 2fjf s TRP 33 Ca 0.34 1.82 -0.05 0.00 0.02 0.00 0.00 56.10 58.23 2fjf s TRP 33 Cb 0.07 -3.08 -0.02 0.00 -1.15 0.00 0.00 33.47 29.30 2fjf s TRP 33 CO 0.14 0.12 -0.00 0.42 0.02 0.00 0.00 176.95 177.65 2fjf s ILE 34 N -0.76 3.82 0.02 2.03 -1.09 -0.75 -1.51 121.20 122.95 2fjf s ILE 34 Ca 0.44 -0.35 -0.03 0.00 -2.23 0.00 0.00 60.65 58.49 2fjf s ILE 34 Cb -0.27 -2.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.83 2fjf s ILE 34 CO 0.33 0.41 0.21 -1.00 -1.23 0.00 0.00 174.94 173.66 2fjf s HIS 35 N 1.26 3.54 -0.20 3.97 3.76 -0.11 -1.42 115.29 126.08 2fjf s HIS 35 Ca 0.04 0.37 -0.06 0.00 -0.15 0.00 0.00 55.06 55.25 2fjf s HIS 35 Cb -0.15 -1.84 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 2fjf s HIS 35 CO 0.01 0.61 0.03 -1.58 -0.85 0.00 0.00 174.74 172.96 2fjf s TRP 36 N -1.39 3.10 -0.09 1.40 0.52 0.55 -1.35 118.94 121.67 2fjf s TRP 36 Ca 0.30 -0.30 0.02 0.00 0.02 0.00 0.00 56.10 56.14 2fjf s TRP 36 Cb -0.13 -2.11 0.02 0.00 -1.15 0.00 0.00 33.47 30.10 2fjf s TRP 36 CO 0.21 -0.15 -0.13 0.08 0.02 0.00 0.00 176.95 176.98 2fjf s VAL 37 N 0.94 1.30 0.26 4.03 1.01 0.98 -0.61 120.40 128.31 2fjf s VAL 37 Ca 0.02 -0.53 0.09 0.00 0.00 0.00 0.00 61.98 61.57 2fjf s VAL 37 Cb -0.14 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 2fjf s VAL 37 CO 0.02 0.40 0.02 0.00 0.00 0.00 0.00 175.10 175.55 2fjf s ARG 38 N 1.01 2.38 -0.21 2.72 1.70 0.81 0.41 118.95 127.77 2fjf s ARG 38 Ca -0.07 -1.36 -0.04 0.00 -0.47 0.00 0.00 55.73 53.79 2fjf s ARG 38 Cb -0.15 -2.22 0.09 0.00 -0.57 0.00 0.00 34.95 32.10 2fjf s ARG 38 CO -0.01 0.37 0.20 -1.14 -1.08 0.00 0.00 175.30 173.64 2fjf s GLN 39 N -3.67 0.18 0.58 3.89 0.74 -0.23 -0.34 119.66 120.81 2fjf s GLN 39 Ca 0.31 0.07 -0.16 0.00 0.05 0.00 0.00 55.36 55.64 2fjf s GLN 39 Cb -0.07 -1.27 -0.05 0.00 1.10 0.00 0.00 33.01 32.73 2fjf s GLN 39 CO 0.21 -0.72 1.04 0.00 -0.55 0.00 0.00 175.29 175.27 2fjf s ALA 40 N 2.28 2.83 -0.20 1.58 0.00 -1.26 -1.44 121.76 125.55 2fjf s ALA 40 Ca 0.06 0.31 -0.37 0.00 0.00 0.00 0.00 51.96 51.96 2fjf s ALA 40 Cb -0.16 -3.19 -0.14 0.00 0.00 0.00 0.00 23.12 19.63 2fjf s ALA 40 CO -0.15 -0.67 1.83 -2.30 0.00 0.00 0.00 175.76 174.47 2fjf n PRO 41 N -1.98 1.60 -0.48 0.00 -0.02 -1.26 -0.54 135.00 132.32 2fjf n PRO 41 Ca 0.08 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2fjf n PRO 41 Cb 0.53 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2fjf n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fjf n GLY 42 N 4.43 1.68 2.44 -1.23 0.00 -1.26 -5.01 105.19 106.24 2fjf n GLY 42 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.15 2fjf n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fjf n LYS 43 N -2.00 0.70 -0.24 1.61 4.76 0.30 -5.14 118.16 118.15 2fjf n LYS 43 Ca 0.00 -1.93 0.00 0.00 -2.87 0.00 0.00 58.31 53.51 2fjf n LYS 43 Cb 0.00 -0.17 0.00 0.00 -1.84 0.00 0.00 35.03 33.02 2fjf n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fjf n GLY 44 N 0.56 0.10 3.56 0.72 0.00 -1.26 -4.66 105.19 104.20 2fjf n GLY 44 Ca 0.10 -1.82 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 2fjf n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fjf s LEU 45 N 0.00 4.36 -0.23 0.99 1.43 -1.26 -4.24 118.68 119.74 2fjf s LEU 45 Ca 0.00 -0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2fjf s LEU 45 Cb 0.00 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 2fjf s LEU 45 CO 0.00 -0.45 0.06 -0.70 0.23 0.00 0.00 176.35 175.49 2fjf s GLU 46 N 2.32 3.74 0.19 1.70 2.12 0.54 -4.96 118.70 124.35 2fjf s GLU 46 Ca 0.17 -0.44 -0.30 0.00 0.36 0.00 0.00 54.97 54.76 2fjf s GLU 46 Cb -0.16 -3.27 -0.08 0.00 0.26 0.00 0.00 34.13 30.88 2fjf s GLU 46 CO 0.13 -0.04 1.23 -0.46 -0.54 0.00 0.00 175.26 175.58 2fjf s TRP 47 N 1.21 3.38 -0.09 5.30 -0.00 -1.26 -0.14 118.94 127.34 2fjf s TRP 47 Ca 0.04 1.37 -0.06 0.00 -0.00 0.00 0.00 56.10 57.46 2fjf s TRP 47 Cb -0.14 -3.48 -0.04 0.00 -0.00 0.00 0.00 33.47 29.80 2fjf s TRP 47 CO 0.03 -1.39 -0.14 0.28 -0.00 0.00 0.00 176.95 175.73 2fjf n VAL 48 N 2.53 0.69 -3.54 5.86 0.31 0.22 -4.66 118.33 119.75 2fjf n VAL 48 Ca 0.05 -0.09 -0.13 0.00 -0.01 0.00 0.00 64.34 64.17 2fjf n VAL 48 Cb 0.44 -1.68 -0.04 0.00 -0.91 0.00 0.00 33.84 31.65 2fjf n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fjf s ALA 49 N -2.22 -1.33 -0.02 3.52 0.00 -1.15 -0.44 121.76 120.12 2fjf s ALA 49 Ca -0.14 0.43 -0.06 0.00 0.00 0.00 0.00 51.96 52.18 2fjf s ALA 49 Cb 0.05 0.60 0.01 0.00 0.00 0.00 0.00 23.12 23.78 2fjf s ALA 49 CO 0.18 -0.62 0.13 0.20 0.00 0.00 0.00 175.76 175.66 2fjf s GLY 50 N -2.39 -0.00 -0.12 0.00 0.00 -0.40 -0.33 107.32 104.08 2fjf s GLY 50 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.77 2fjf s GLY 50 CO -0.07 -0.05 -0.16 -1.50 0.00 0.00 0.00 173.10 171.32 2fjf s ILE 51 N -0.83 1.57 0.64 0.90 2.07 -0.51 -1.31 121.20 123.73 2fjf s ILE 51 Ca -0.09 -0.67 -0.17 0.00 -1.41 0.00 0.00 60.65 58.31 2fjf s ILE 51 Cb -0.05 -1.43 -0.06 0.00 0.13 0.00 0.00 42.46 41.04 2fjf s ILE 51 CO 0.01 0.45 0.55 0.41 -1.91 0.00 0.00 174.94 174.46 2fjf n THR 52 N 4.31 2.17 -1.51 4.00 -1.04 -0.36 -1.81 114.28 120.04 2fjf n THR 52 Ca -0.19 -0.46 -0.38 0.00 -2.04 0.00 0.00 64.05 60.99 2fjf n THR 52 Cb 0.51 -0.74 0.04 0.00 -1.82 0.00 0.00 70.33 68.32 2fjf n THR 52 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2fjf n PRO 53 N -0.42 0.62 -0.34 -2.82 -0.02 -1.13 -2.19 135.00 128.71 2fjf n PRO 53 Ca 0.11 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2fjf n PRO 53 Cb 0.49 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2fjf n PRO 53 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fjf n ALA 54 N -1.68 0.00 -2.28 3.55 0.00 0.51 -2.64 120.51 117.96 2fjf n ALA 54 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 2fjf n ALA 54 Cb 0.47 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.26 2fjf n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fjf n GLY 55 N -2.00 0.54 0.27 0.00 0.00 -0.93 -4.99 105.19 98.08 2fjf n GLY 55 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 2fjf n GLY 55 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2fjf h GLY 56 N -0.10 1.04 -4.10 -0.02 0.00 -1.66 -3.47 103.07 94.76 2fjf h GLY 56 Ca -0.04 -1.02 -0.09 0.00 0.00 0.00 0.00 47.33 46.18 2fjf h GLY 56 CO 0.05 0.93 -0.07 -0.47 0.00 0.00 0.00 176.54 176.97 2fjf s TYR 57 N -4.47 -0.36 0.10 5.60 5.04 -1.26 -5.02 117.35 116.98 2fjf s TYR 57 Ca -0.11 0.52 0.07 0.00 -2.44 0.00 0.00 57.07 55.12 2fjf s TYR 57 Cb 0.11 0.24 -0.03 0.00 0.35 0.00 0.00 41.96 42.63 2fjf s TYR 57 CO 0.88 -0.52 -0.19 0.95 -1.34 0.00 0.00 175.55 175.33 2fjf s THR 58 N -1.67 1.57 0.02 4.34 -4.23 -1.26 -1.22 115.64 113.19 2fjf s THR 58 Ca -0.10 -1.51 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2fjf s THR 58 Cb -0.02 -1.46 -0.02 0.00 1.34 0.00 0.00 72.50 72.34 2fjf s THR 58 CO 0.04 -0.12 -0.05 -0.31 -0.54 0.00 0.00 174.62 173.64 2fjf s TYR 59 N -1.26 0.41 -0.01 3.99 1.51 -0.43 -5.00 117.35 116.57 2fjf s TYR 59 Ca 0.05 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2fjf s TYR 59 Cb -0.10 -0.26 -0.00 0.00 -0.11 0.00 0.00 41.96 41.49 2fjf s TYR 59 CO 0.04 -0.10 -0.05 0.71 -1.11 0.00 0.00 175.55 175.04 2fjf s TYR 60 N -1.05 0.48 0.45 2.71 1.51 -1.26 -1.27 117.35 118.91 2fjf s TYR 60 Ca -0.09 -0.09 -0.25 0.00 -1.01 0.00 0.00 57.07 55.63 2fjf s TYR 60 Cb -0.08 -0.32 -0.09 0.00 -0.11 0.00 0.00 41.96 41.36 2fjf s TYR 60 CO -0.00 -0.02 1.36 0.00 -1.11 0.00 0.00 175.55 175.78 2fjf n ALA 61 N 3.05 1.71 -0.34 3.71 0.00 0.41 -4.76 120.51 124.29 2fjf n ALA 61 Ca -0.14 0.24 0.18 0.00 0.00 0.00 0.00 53.44 53.72 2fjf n ALA 61 Cb 0.58 -2.34 0.38 0.00 0.00 0.00 0.00 19.45 18.07 2fjf n ALA 61 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2fjf h ASP 62 N 2.13 0.62 0.31 0.00 3.45 -1.94 -1.07 116.42 119.91 2fjf h ASP 62 Ca -0.50 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.11 2fjf h ASP 62 Cb 1.28 0.06 0.00 0.00 -0.56 0.00 0.00 39.33 40.11 2fjf h ASP 62 CO 0.60 0.07 0.00 -1.54 -1.57 0.00 0.00 179.24 176.80 2fjf n SER 63 N -4.92 0.00 0.00 6.45 3.41 -1.26 -3.09 113.62 114.21 2fjf n SER 63 Ca 0.27 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 2fjf n SER 63 Cb 0.76 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2fjf n SER 63 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2fjf n VAL 64 N -1.46 0.00 -1.75 -3.33 0.31 -0.51 -5.03 118.33 106.55 2fjf n VAL 64 Ca 0.03 -0.15 -0.42 0.00 -0.01 0.00 0.00 64.34 63.78 2fjf n VAL 64 Cb 0.11 0.70 -0.03 0.00 -0.91 0.00 0.00 33.84 33.71 2fjf n VAL 64 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2fjf s LYS 65 N -0.72 4.13 0.00 5.55 2.20 -0.58 -2.08 119.74 128.24 2fjf s LYS 65 Ca 0.00 2.59 0.00 0.00 -0.36 0.00 0.00 55.97 58.20 2fjf s LYS 65 Cb 0.00 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.25 2fjf s LYS 65 CO 0.00 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 174.69 2fjf n GLY 66 N 3.50 0.93 0.00 5.54 0.00 -1.26 -4.80 105.19 109.10 2fjf n GLY 66 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2fjf n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fjf n ARG 67 N -2.00 3.01 -4.44 1.61 1.74 -0.88 -5.06 116.66 110.64 2fjf n ARG 67 Ca 0.00 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 2fjf n ARG 67 Cb 0.00 -0.94 -0.11 0.00 -1.02 0.00 0.00 32.46 30.39 2fjf n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2fjf s PHE 68 N -1.88 2.62 -0.09 -1.55 0.40 -0.92 -0.90 117.98 115.66 2fjf s PHE 68 Ca 0.00 -0.22 0.03 0.00 -0.60 0.00 0.00 56.93 56.14 2fjf s PHE 68 Cb 0.00 -1.43 0.01 0.00 0.51 0.00 0.00 43.02 42.10 2fjf s PHE 68 CO 0.00 0.34 -0.19 0.99 0.70 0.00 0.00 175.22 177.06 2fjf s THR 69 N -1.06 1.67 -0.14 0.64 2.01 0.61 -4.91 115.64 114.47 2fjf s THR 69 Ca 0.17 -0.78 -0.06 0.00 0.31 0.00 0.00 61.69 61.33 2fjf s THR 69 Cb -0.11 -1.47 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 2fjf s THR 69 CO 0.09 0.47 0.09 -0.51 -0.69 0.00 0.00 174.62 174.07 2fjf s ILE 70 N 0.53 5.05 0.02 1.82 2.07 -1.26 -0.01 121.20 129.41 2fjf s ILE 70 Ca -0.16 0.04 -0.00 0.00 -1.41 0.00 0.00 60.65 59.12 2fjf s ILE 70 Cb -0.17 -3.21 0.00 0.00 0.13 0.00 0.00 42.46 39.21 2fjf s ILE 70 CO 0.06 0.56 0.03 -0.24 -1.91 0.00 0.00 174.94 173.44 2fjf n SER 71 N 2.56 -0.09 -3.62 4.50 2.88 -0.73 -4.98 113.62 114.14 2fjf n SER 71 Ca -0.18 -1.08 -0.09 0.00 -1.33 0.00 0.00 58.87 56.18 2fjf n SER 71 Cb 0.54 0.16 -0.02 0.00 -0.75 0.00 0.00 64.21 64.14 2fjf n SER 71 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fjf s ALA 72 N -1.27 -1.48 -0.20 -1.46 0.00 -1.26 -0.41 121.76 115.67 2fjf s ALA 72 Ca 0.01 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.19 2fjf s ALA 72 Cb -0.00 0.81 0.04 0.00 0.00 0.00 0.00 23.12 23.97 2fjf s ALA 72 CO 0.01 -0.88 -0.12 0.34 0.00 0.00 0.00 175.76 175.10 2fjf s ASP 73 N -2.80 3.50 0.24 0.00 -1.08 0.03 -4.93 116.67 111.62 2fjf s ASP 73 Ca 0.06 -0.92 0.05 0.00 -0.52 0.00 0.00 52.55 51.22 2fjf s ASP 73 Cb -0.03 -1.33 0.28 0.00 -1.46 0.00 0.00 42.92 40.38 2fjf s ASP 73 CO -0.04 -0.12 1.58 0.71 0.52 0.00 0.00 175.17 177.81 2fjf h THR 74 N 6.36 1.38 0.00 1.71 1.35 -1.96 -1.70 112.91 120.05 2fjf h THR 74 Ca -0.30 -1.93 -0.01 0.00 -0.55 0.00 0.00 66.41 63.62 2fjf h THR 74 Cb 1.10 1.97 -0.00 0.00 -1.73 0.00 0.00 68.15 69.48 2fjf h THR 74 CO 0.50 0.57 -0.06 0.77 -0.25 0.00 0.00 175.52 177.05 2fjf h SER 75 N 0.17 0.00 -0.22 5.36 4.64 -1.95 -0.74 113.55 120.80 2fjf h SER 75 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fjf h SER 75 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2fjf h SER 75 CO 0.09 0.06 0.00 0.29 -0.87 0.00 0.00 176.83 176.40 2fjf n LYS 76 N -3.66 1.89 -4.23 4.77 5.02 -1.11 -4.99 118.16 115.85 2fjf n LYS 76 Ca -0.02 -1.74 -0.35 0.00 -2.02 0.00 0.00 58.31 54.17 2fjf n LYS 76 Cb 0.17 -1.29 -0.04 0.00 -0.02 0.00 0.00 35.03 33.85 2fjf n LYS 76 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2fjf n ASN 77 N 0.73 -2.33 -4.02 4.39 5.15 -0.29 -4.75 115.26 114.15 2fjf n ASN 77 Ca 0.11 -1.06 -0.19 0.00 -0.60 0.00 0.00 54.58 52.84 2fjf n ASN 77 Cb 0.40 -2.57 -0.15 0.00 -0.53 0.00 0.00 39.78 36.93 2fjf n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2fjf s THR 78 N -3.47 0.72 0.10 -0.44 2.01 -0.91 -1.77 115.64 111.88 2fjf s THR 78 Ca 0.58 -0.38 0.03 0.00 0.31 0.00 0.00 61.69 62.23 2fjf s THR 78 Cb -0.32 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.54 2fjf s THR 78 CO 0.94 0.21 0.14 0.00 -0.69 0.00 0.00 174.62 175.22 2fjf s ALA 79 N -0.13 3.70 0.13 7.40 0.00 0.44 -0.79 121.76 132.51 2fjf s ALA 79 Ca 0.02 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.02 2fjf s ALA 79 Cb -0.04 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 2fjf s ALA 79 CO -0.00 0.70 -0.12 0.71 0.00 0.00 0.00 175.76 177.05 2fjf s TYR 80 N -1.51 1.32 -0.28 0.00 2.02 0.45 -0.52 117.35 118.83 2fjf s TYR 80 Ca 0.31 -0.64 -0.02 0.00 -0.37 0.00 0.00 57.07 56.36 2fjf s TYR 80 Cb -0.12 -0.68 0.09 0.00 -0.40 0.00 0.00 41.96 40.85 2fjf s TYR 80 CO 0.24 0.12 0.09 -1.17 -1.57 0.00 0.00 175.55 173.27 2fjf s LEU 81 N -2.75 1.60 -0.24 -1.29 2.96 -0.62 -1.77 118.68 116.56 2fjf s LEU 81 Ca 0.12 -1.40 -0.25 0.00 -0.22 0.00 0.00 54.13 52.38 2fjf s LEU 81 Cb -0.02 -0.68 -0.00 0.00 0.50 0.00 0.00 46.19 45.99 2fjf s LEU 81 CO 0.02 -0.40 0.84 -1.58 -1.32 0.00 0.00 176.35 173.91 2fjf s GLN 82 N 1.79 4.20 -0.26 1.98 2.00 0.98 -2.43 119.66 127.92 2fjf s GLN 82 Ca 0.08 0.98 -0.05 0.00 -2.00 0.00 0.00 55.36 54.37 2fjf s GLN 82 Cb -0.17 -3.64 0.01 0.00 0.80 0.00 0.00 33.01 30.01 2fjf s GLN 82 CO -0.25 -0.51 0.01 -1.64 -0.50 0.00 0.00 175.29 172.40 2fjf s MET 83 N 2.81 3.12 0.33 1.67 -1.94 -0.02 -0.28 119.30 124.98 2fjf s MET 83 Ca 0.36 -0.81 0.08 0.00 -1.71 0.00 0.00 55.69 53.61 2fjf s MET 83 Cb -0.15 -3.18 -0.04 0.00 2.01 0.00 0.00 34.83 33.47 2fjf s MET 83 CO 0.08 -0.36 0.19 -0.80 -0.01 0.00 0.00 175.02 174.12 2fjf s ASN 84 N 1.45 4.94 -1.45 3.03 0.01 -0.08 -1.88 114.94 120.95 2fjf s ASN 84 Ca 0.03 -0.64 -0.01 0.00 -0.71 0.00 0.00 52.86 51.53 2fjf s ASN 84 Cb -0.16 -0.86 0.01 0.00 0.41 0.00 0.00 41.25 40.64 2fjf s ASN 84 CO -0.01 -0.29 0.32 -1.20 -1.51 0.00 0.00 177.10 174.42 2fjf n SER 85 N -1.22 -0.07 -4.77 -1.22 7.64 -1.11 -4.72 113.62 108.15 2fjf n SER 85 Ca -0.03 -1.08 -0.41 0.00 1.01 0.00 0.00 58.87 58.37 2fjf n SER 85 Cb 0.60 -2.67 -0.01 0.00 -1.01 0.00 0.00 64.21 61.12 2fjf n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2fjf s LEU 86 N -7.08 4.36 0.34 -3.43 1.43 -1.09 -4.62 118.68 108.59 2fjf s LEU 86 Ca 0.02 2.79 0.09 0.00 -1.03 0.00 0.00 54.13 56.00 2fjf s LEU 86 Cb -0.01 -3.70 -0.05 0.00 0.03 0.00 0.00 46.19 42.46 2fjf s LEU 86 CO 0.92 -0.69 0.08 -0.13 0.23 0.00 0.00 176.35 176.75 2fjf s ARG 87 N -1.97 2.23 0.28 1.70 0.52 -1.26 0.31 118.95 120.76 2fjf s ARG 87 Ca 0.52 -1.64 0.02 0.00 -0.52 0.00 0.00 55.73 54.11 2fjf s ARG 87 Cb -0.41 -2.06 0.67 0.00 0.52 0.00 0.00 34.95 33.67 2fjf s ARG 87 CO 0.55 0.13 1.72 0.00 0.02 0.00 0.00 175.30 177.72 2fjf h ALA 88 N 1.68 1.39 0.00 2.13 0.00 -1.97 -1.56 119.26 120.93 2fjf h ALA 88 Ca -0.43 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2fjf h ALA 88 Cb 1.25 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2fjf h ALA 88 CO 0.65 -0.26 0.00 -0.85 0.00 0.00 0.00 179.25 178.79 2fjf n GLU 89 N -4.98 0.00 0.00 0.00 0.28 -1.26 -1.18 120.64 113.50 2fjf n GLU 89 Ca 0.21 0.33 0.14 0.00 -0.16 0.00 0.00 57.16 57.68 2fjf n GLU 89 Cb 0.58 -1.50 0.59 0.00 1.43 0.00 0.00 31.44 32.54 2fjf n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2fjf n ASP 90 N -1.50 0.05 -4.60 -1.84 8.00 -0.59 -4.83 116.55 111.24 2fjf n ASP 90 Ca 0.02 0.43 -0.44 0.00 0.71 0.00 0.00 54.79 55.51 2fjf n ASP 90 Cb 0.11 -0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 40.75 2fjf n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2fjf n THR 91 N -1.50 0.44 -3.61 -3.53 -1.04 -0.32 -4.88 114.28 99.84 2fjf n THR 91 Ca 0.07 -0.35 -0.05 0.00 -2.04 0.00 0.00 64.05 61.68 2fjf n THR 91 Cb 0.34 -2.39 -0.02 0.00 -1.82 0.00 0.00 70.33 66.44 2fjf n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fjf s ALA 92 N 7.12 -1.90 -0.08 2.41 0.00 -0.68 -4.53 121.76 124.10 2fjf s ALA 92 Ca 0.99 0.86 -0.26 0.00 0.00 0.00 0.00 51.96 53.55 2fjf s ALA 92 Cb -0.43 0.35 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2fjf s ALA 92 CO 0.39 -0.82 0.81 0.08 0.00 0.00 0.00 175.76 176.22 2fjf s VAL 93 N -2.90 4.96 -0.22 0.00 1.01 -0.52 -1.41 120.40 121.31 2fjf s VAL 93 Ca 0.09 1.65 -0.07 0.00 0.00 0.00 0.00 61.98 63.65 2fjf s VAL 93 Cb -0.00 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2fjf s VAL 93 CO -0.04 0.17 0.06 -0.31 0.00 0.00 0.00 175.10 174.97 2fjf s TYR 94 N 1.23 3.12 0.04 5.22 1.51 0.02 -1.06 117.35 127.43 2fjf s TYR 94 Ca 0.41 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 56.24 2fjf s TYR 94 Cb -0.18 -2.16 -0.04 0.00 -0.11 0.00 0.00 41.96 39.47 2fjf s TYR 94 CO 0.19 -0.18 0.03 0.71 -1.11 0.00 0.00 175.55 175.19 2fjf s TYR 95 N 1.12 3.10 0.03 2.71 1.51 0.17 -1.88 117.35 124.10 2fjf s TYR 95 Ca 0.04 0.06 0.03 0.00 -1.01 0.00 0.00 57.07 56.20 2fjf s TYR 95 Cb -0.14 -1.63 -0.04 0.00 -0.11 0.00 0.00 41.96 40.04 2fjf s TYR 95 CO 0.03 0.49 -0.04 0.00 -1.11 0.00 0.00 175.55 174.92 2fjf s ALA 97 N -1.10 0.63 0.13 0.00 0.00 -0.46 -0.41 121.76 120.55 2fjf s ALA 97 Ca 0.20 -0.95 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 2fjf s ALA 97 Cb -0.11 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 2fjf s ALA 97 CO 0.11 -0.13 0.34 -0.98 0.00 0.00 0.00 175.76 175.10 2fjf s ARG 98 N -2.40 3.56 -0.08 0.00 1.70 -0.95 -0.94 118.95 119.85 2fjf s ARG 98 Ca -0.03 -0.21 -0.27 0.00 -0.47 0.00 0.00 55.73 54.75 2fjf s ARG 98 Cb -0.04 -2.89 0.06 0.00 -0.57 0.00 0.00 34.95 31.51 2fjf s ARG 98 CO -0.02 0.49 0.61 0.12 -1.08 0.00 0.00 175.30 175.42 2fjf s PHE 99 N -1.66 -0.58 0.02 5.89 5.36 -0.57 -4.05 117.98 122.38 2fjf s PHE 99 Ca 0.39 1.08 -0.19 0.00 -0.96 0.00 0.00 56.93 57.25 2fjf s PHE 99 Cb -0.12 0.33 0.04 0.00 -0.34 0.00 0.00 43.02 42.92 2fjf s PHE 99 CO 0.26 -0.53 0.42 0.54 -1.46 0.00 0.00 175.22 174.45 2fjf s VAL 100 N -0.96 0.05 -0.99 3.12 0.11 -1.26 -0.17 120.40 120.31 2fjf s VAL 100 Ca -0.10 -0.40 0.25 0.00 -2.93 0.00 0.00 61.98 58.80 2fjf s VAL 100 Cb -0.02 -0.87 0.21 0.00 -1.53 0.00 0.00 36.38 34.17 2fjf s VAL 100 CO 0.07 -0.22 1.78 0.49 -3.33 0.00 0.00 175.10 173.90 2fjf n PHE 101 N 0.76 0.04 -1.43 1.54 3.72 -1.26 -3.75 117.46 117.08 2fjf n PHE 101 Ca -0.19 0.01 -0.32 0.00 -0.05 0.00 0.00 57.45 56.90 2fjf n PHE 101 Cb 0.58 -0.52 0.08 0.00 -0.94 0.00 0.00 39.48 38.68 2fjf n PHE 101 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2fjf s PHE 102 N -3.01 2.59 0.31 1.38 2.99 -1.26 -4.59 117.98 116.40 2fjf s PHE 102 Ca 0.12 1.55 -0.29 0.00 0.00 0.00 0.00 56.93 58.31 2fjf s PHE 102 Cb 0.16 -3.09 -0.13 0.00 0.00 0.00 0.00 43.02 39.96 2fjf s PHE 102 CO 0.45 -1.76 1.29 1.28 -0.00 0.00 0.00 175.22 176.48 2fjf n LEU 103 N -3.15 3.27 -1.10 -0.37 4.77 -1.26 0.20 117.00 119.36 2fjf n LEU 103 Ca 0.09 1.19 0.04 0.00 -0.03 0.00 0.00 56.01 57.31 2fjf n LEU 103 Cb 0.53 -1.45 0.20 0.00 -2.33 0.00 0.00 43.42 40.37 2fjf n LEU 103 CO 0.52 -0.58 0.59 -0.81 -1.33 0.00 0.00 177.39 175.78 2fjf n PRO 104 N 0.91 2.76 -3.82 3.23 -0.04 -1.26 -5.00 135.00 131.79 2fjf n PRO 104 Ca 0.07 -1.58 -0.18 0.00 -0.04 0.00 0.00 63.50 61.77 2fjf n PRO 104 Cb 0.35 -1.76 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 2fjf n PRO 104 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2fjf n TYR 105 N 0.40 -0.53 -4.08 0.54 0.18 0.13 -4.93 117.16 108.86 2fjf n TYR 105 Ca 0.14 0.04 -0.11 0.00 1.88 0.00 0.00 57.90 59.85 2fjf n TYR 105 Cb 0.64 -1.09 -0.07 0.00 -0.38 0.00 0.00 39.34 38.44 2fjf n TYR 105 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2fjf s ALA 106 N -4.34 0.37 -0.76 -3.48 0.00 -1.26 -4.99 121.76 107.29 2fjf s ALA 106 Ca 0.18 -1.24 -0.20 0.00 0.00 0.00 0.00 51.96 50.70 2fjf s ALA 106 Cb -0.10 1.20 0.10 0.00 0.00 0.00 0.00 23.12 24.32 2fjf s ALA 106 CO 0.39 -0.75 0.99 -1.64 0.00 0.00 0.00 175.76 174.75 2fjf s MET 107 N -4.03 3.31 0.04 0.00 -1.94 -1.26 -4.63 119.30 110.79 2fjf s MET 107 Ca 0.29 -1.32 0.12 0.00 -1.71 0.00 0.00 55.69 53.08 2fjf s MET 107 Cb 0.02 -4.52 -0.19 0.00 2.01 0.00 0.00 34.83 32.15 2fjf s MET 107 CO 0.11 -1.75 0.90 0.38 -0.01 0.00 0.00 175.02 174.64 2fjf h ASP 108 N 9.18 0.00 -3.35 3.03 3.04 -2.00 -3.45 116.42 122.87 2fjf h ASP 108 Ca -0.10 0.00 -0.62 0.00 -3.24 0.00 0.00 57.03 53.07 2fjf h ASP 108 Cb 1.05 0.00 -0.33 0.00 -1.04 0.00 0.00 39.33 39.01 2fjf h ASP 108 CO 1.13 0.88 -0.86 -0.31 -2.04 0.00 0.00 179.24 178.05 2fjf s TYR 109 N -2.71 2.18 0.26 4.15 1.51 -1.26 -5.08 117.35 116.39 2fjf s TYR 109 Ca -0.02 -0.90 0.11 0.00 -1.01 0.00 0.00 57.07 55.25 2fjf s TYR 109 Cb 0.09 -1.49 -0.05 0.00 -0.11 0.00 0.00 41.96 40.39 2fjf s TYR 109 CO 0.82 -0.39 -0.19 -1.58 -1.11 0.00 0.00 175.55 173.09 2fjf s TRP 110 N 0.52 2.18 0.93 2.71 0.52 -1.26 -2.25 118.94 122.29 2fjf s TRP 110 Ca -0.16 -0.38 -0.14 0.00 0.02 0.00 0.00 56.10 55.44 2fjf s TRP 110 Cb -0.17 -0.96 0.16 0.00 -1.15 0.00 0.00 33.47 31.34 2fjf s TRP 110 CO 0.06 0.64 1.22 0.20 0.02 0.00 0.00 176.95 179.08 2fjf s GLY 111 N -3.41 1.66 0.24 0.98 0.00 0.45 -4.29 107.32 102.95 2fjf s GLY 111 Ca 0.28 -0.85 0.24 0.00 0.00 0.00 0.00 44.72 44.38 2fjf s GLY 111 CO 0.13 -0.21 1.46 0.06 0.00 0.00 0.00 173.10 174.55 2fjf h GLN 112 N -1.52 0.00 0.00 2.90 -0.00 -1.91 -3.44 115.11 111.14 2fjf h GLN 112 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 2fjf h GLN 112 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 2fjf h GLN 112 CO 0.52 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.76 2fjf n GLY 113 N 1.24 2.31 3.34 0.06 0.00 -1.26 -5.02 105.19 105.85 2fjf n GLY 113 Ca 0.03 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 2fjf n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fjf s THR 114 N -1.24 2.09 -0.20 2.61 -4.23 -0.79 -4.92 115.64 108.96 2fjf s THR 114 Ca 0.00 -1.39 -0.26 0.00 -1.18 0.00 0.00 61.69 58.86 2fjf s THR 114 Cb 0.00 -1.79 -0.01 0.00 1.34 0.00 0.00 72.50 72.04 2fjf s THR 114 CO 0.00 0.33 0.88 -0.22 -0.54 0.00 0.00 174.62 175.07 2fjf s LEU 115 N -1.28 4.14 -0.20 4.79 0.20 -1.26 -0.80 118.68 124.26 2fjf s LEU 115 Ca 0.11 1.20 -0.07 0.00 0.69 0.00 0.00 54.13 56.06 2fjf s LEU 115 Cb -0.10 -3.30 -0.03 0.00 -0.43 0.00 0.00 46.19 42.33 2fjf s LEU 115 CO 0.02 -0.49 0.05 -0.69 -0.29 0.00 0.00 176.35 174.95 2fjf s VAL 116 N 2.55 4.47 -0.12 1.68 1.01 -0.50 -1.90 120.40 127.59 2fjf s VAL 116 Ca 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.22 2fjf s VAL 116 Cb -0.16 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.22 2fjf s VAL 116 CO 0.10 0.42 -0.05 0.28 0.00 0.00 0.00 175.10 175.85 2fjf s THR 117 N 0.79 0.91 -0.39 3.92 -1.32 -0.41 -1.69 115.64 117.45 2fjf s THR 117 Ca 0.03 -0.29 -0.13 0.00 -1.21 0.00 0.00 61.69 60.08 2fjf s THR 117 Cb -0.14 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.87 2fjf s THR 117 CO 0.02 0.29 0.25 -0.69 -2.21 0.00 0.00 174.62 172.28 2fjf s VAL 118 N 1.74 4.94 0.10 5.08 1.01 -1.26 -2.06 120.40 129.95 2fjf s VAL 118 Ca 0.04 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.07 2fjf s VAL 118 Cb -0.13 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.55 2fjf s VAL 118 CO -0.08 -0.27 0.49 -0.55 0.00 0.00 0.00 175.10 174.70 2fjf s SER 119 N 1.62 -0.39 0.00 3.32 0.15 -0.12 -4.39 113.70 113.89 2fjf s SER 119 Ca 0.04 -0.05 0.22 0.00 0.70 0.00 0.00 55.95 56.85 2fjf s SER 119 Cb -0.19 0.51 -0.05 0.00 -1.71 0.00 0.00 66.02 64.58 2fjf s SER 119 CO 0.08 -0.82 1.03 -1.54 1.20 0.00 0.00 173.24 173.19 2fjf n SER 120 N -0.00 1.08 -4.77 5.45 3.41 -1.26 -3.20 113.62 114.32 2fjf n SER 120 Ca -0.17 -0.96 -0.34 0.00 -0.26 0.00 0.00 58.87 57.14 2fjf n SER 120 Cb 0.63 0.77 0.02 0.00 -0.26 0.00 0.00 64.21 65.37 2fjf n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fjf s ALA 121 N -2.90 2.59 0.52 7.33 0.00 -1.26 -5.01 121.76 123.03 2fjf s ALA 121 Ca 0.11 0.72 0.04 0.00 0.00 0.00 0.00 51.96 52.83 2fjf s ALA 121 Cb 0.17 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 19.98 2fjf s ALA 121 CO 0.79 -1.00 0.72 -1.54 0.00 0.00 0.00 175.76 174.73 2fjf s SER 122 N -2.09 5.31 0.07 0.00 1.04 -1.26 -4.99 113.70 111.78 2fjf s SER 122 Ca 0.71 -0.29 -0.31 0.00 0.48 0.00 0.00 55.95 56.54 2fjf s SER 122 Cb -0.23 -0.59 -0.06 0.00 0.10 0.00 0.00 66.02 65.24 2fjf s SER 122 CO 0.33 -1.09 1.24 -0.89 0.98 0.00 0.00 173.24 173.82 2fjf s THR 123 N -2.63 3.87 -0.06 2.02 2.01 -1.26 -4.74 115.64 114.85 2fjf s THR 123 Ca 0.58 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.92 2fjf s THR 123 Cb -0.09 -3.86 0.02 0.00 0.01 0.00 0.00 72.50 68.58 2fjf s THR 123 CO 0.37 0.10 -0.05 -0.75 -0.69 0.00 0.00 174.62 173.60 2fjf s LYS 124 N 1.13 0.99 0.51 4.92 2.20 0.64 -4.95 119.74 125.19 2fjf s LYS 124 Ca 0.60 -0.12 -0.18 0.00 -0.36 0.00 0.00 55.97 55.92 2fjf s LYS 124 Cb -0.31 -1.05 -0.08 0.00 -1.51 0.00 0.00 37.83 34.88 2fjf s LYS 124 CO 0.29 -0.15 1.00 0.20 -0.36 0.00 0.00 175.35 176.34 2fjf s GLY 125 N 1.25 2.20 0.67 5.54 0.00 -1.26 -0.57 107.32 115.15 2fjf s GLY 125 Ca -0.05 0.33 -0.09 0.00 0.00 0.00 0.00 44.72 44.91 2fjf s GLY 125 CO -0.02 0.62 1.02 2.56 0.00 0.00 0.00 173.10 177.29 2fjf s PRO 126 N -3.78 2.78 0.01 2.90 0.04 -1.26 -4.56 135.00 131.13 2fjf s PRO 126 Ca 0.62 0.22 -0.00 0.00 0.04 0.00 0.00 61.00 61.87 2fjf s PRO 126 Cb -0.12 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 2fjf s PRO 126 CO 0.27 -0.96 0.12 -1.12 0.04 0.00 0.00 177.00 175.35 2fjf s SER 127 N -4.36 5.90 -0.16 6.66 0.01 0.45 -4.91 113.70 117.29 2fjf s SER 127 Ca 0.57 0.19 0.01 0.00 1.31 0.00 0.00 55.95 58.02 2fjf s SER 127 Cb -0.11 -1.74 0.02 0.00 0.21 0.00 0.00 66.02 64.41 2fjf s SER 127 CO 0.49 0.25 -0.16 -0.69 0.41 0.00 0.00 173.24 173.53 2fjf s VAL 128 N -1.28 1.76 0.02 3.43 1.01 -1.26 -0.81 120.40 123.27 2fjf s VAL 128 Ca 0.26 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.54 2fjf s VAL 128 Cb -0.12 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 2fjf s VAL 128 CO 0.18 0.46 -0.24 -0.36 0.00 0.00 0.00 175.10 175.14 2fjf s PHE 129 N 1.41 2.40 0.37 5.22 0.08 -0.19 -4.96 117.98 122.30 2fjf s PHE 129 Ca 0.04 -0.37 -0.26 0.00 0.12 0.00 0.00 56.93 56.47 2fjf s PHE 129 Cb -0.13 -1.46 -0.09 0.00 -0.57 0.00 0.00 43.02 40.77 2fjf s PHE 129 CO -0.11 0.10 1.10 -1.25 -0.10 0.00 0.00 175.22 174.96 2fjf s PRO 130 N -1.04 4.24 -0.62 0.24 0.04 -1.26 0.39 135.00 136.98 2fjf s PRO 130 Ca 0.12 1.68 -0.10 0.00 0.04 0.00 0.00 61.00 62.74 2fjf s PRO 130 Cb -0.10 -2.73 0.16 0.00 0.04 0.00 0.00 34.50 31.87 2fjf s PRO 130 CO 0.02 -0.11 0.51 -0.51 0.04 0.00 0.00 177.00 176.94 2fjf s LEU 131 N -2.32 5.95 0.23 -3.56 1.43 0.88 -4.75 118.68 116.54 2fjf s LEU 131 Ca 0.54 -2.37 -0.30 0.00 -1.03 0.00 0.00 54.13 50.98 2fjf s LEU 131 Cb -0.27 -2.05 -0.09 0.00 0.03 0.00 0.00 46.19 43.82 2fjf s LEU 131 CO 0.34 -0.59 1.06 0.00 0.23 0.00 0.00 176.35 177.39 2fjf s ALA 132 N 0.67 3.37 0.52 4.21 0.00 -1.26 -1.00 121.76 128.27 2fjf s ALA 132 Ca 0.12 0.80 -0.22 0.00 0.00 0.00 0.00 51.96 52.65 2fjf s ALA 132 Cb -0.20 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.55 2fjf s ALA 132 CO -0.03 -0.10 1.35 -1.25 0.00 0.00 0.00 175.76 175.72 2fjf s PRO 133 N -0.93 3.28 0.42 0.00 0.04 -1.26 -4.93 135.00 131.63 2fjf s PRO 133 Ca 0.46 2.21 0.06 0.00 0.04 0.00 0.00 61.00 63.77 2fjf s PRO 133 Cb -0.29 -2.33 -0.07 0.00 0.04 0.00 0.00 34.50 31.85 2fjf s PRO 133 CO 0.36 -1.07 0.01 -1.54 0.04 0.00 0.00 177.00 174.81 2fjf s SER 134 N -0.94 3.93 0.35 6.66 1.04 -1.26 -4.62 113.70 118.86 2fjf s SER 134 Ca 0.69 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.72 2fjf s SER 134 Cb -0.40 -0.28 0.00 0.00 0.10 0.00 0.00 66.02 65.44 2fjf s SER 134 CO 0.48 -0.51 0.00 -1.20 0.98 0.00 0.00 173.24 172.99 2fjf n SER 135 N -1.02 0.00 -0.22 7.02 7.64 -1.26 -5.06 113.62 120.73 2fjf n SER 135 Ca -0.07 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.84 2fjf n SER 135 Cb 0.67 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.94 2fjf n SER 135 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fjf n GLY 141 N 0.00 -1.06 2.96 0.23 0.00 -1.26 -5.26 105.19 100.80 2fjf n GLY 141 Ca 0.00 0.65 -0.11 0.00 0.00 0.00 0.00 46.02 46.56 2fjf n GLY 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fjf s THR 142 N -5.71 0.15 0.26 2.61 -4.23 -1.26 -3.43 115.64 104.02 2fjf s THR 142 Ca -0.09 -0.63 0.09 0.00 -1.18 0.00 0.00 61.69 59.88 2fjf s THR 142 Cb 0.15 -0.24 -0.04 0.00 1.34 0.00 0.00 72.50 73.71 2fjf s THR 142 CO 0.46 -0.31 0.01 0.00 -0.54 0.00 0.00 174.62 174.24 2fjf s ALA 143 N -0.96 3.19 0.05 3.99 0.00 0.17 -4.80 121.76 123.41 2fjf s ALA 143 Ca -0.10 -1.61 0.07 0.00 0.00 0.00 0.00 51.96 50.33 2fjf s ALA 143 Cb -0.07 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 2fjf s ALA 143 CO -0.01 0.29 -0.18 0.00 0.00 0.00 0.00 175.76 175.86 2fjf s ALA 144 N -2.24 2.61 0.29 0.00 0.00 -1.26 -1.27 121.76 119.88 2fjf s ALA 144 Ca 0.31 -1.21 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 2fjf s ALA 144 Cb -0.07 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.33 2fjf s ALA 144 CO 0.20 0.58 0.51 -0.48 0.00 0.00 0.00 175.76 176.56 2fjf s LEU 145 N -1.53 0.47 0.00 0.00 0.05 -0.36 -4.11 118.68 113.20 2fjf s LEU 145 Ca 0.15 -1.10 0.00 0.00 0.05 0.00 0.00 54.13 53.23 2fjf s LEU 145 Cb -0.10 1.80 0.00 0.00 -2.05 0.00 0.00 46.19 45.83 2fjf s LEU 145 CO 0.06 -1.24 0.00 0.61 -0.55 0.00 0.00 176.35 175.23 2fjf n GLY 146 N -0.45 0.90 2.82 -3.48 0.00 -0.17 0.29 105.19 105.10 2fjf n GLY 146 Ca -0.02 -0.62 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 2fjf n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fjf s LEU 148 N 0.60 4.18 -0.36 0.00 2.96 0.16 -1.04 118.68 125.18 2fjf s LEU 148 Ca -0.05 0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 54.39 2fjf s LEU 148 Cb -0.07 -2.51 0.09 0.00 0.50 0.00 0.00 46.19 44.19 2fjf s LEU 148 CO -0.02 -0.05 0.10 -0.69 -1.32 0.00 0.00 176.35 174.38 2fjf s VAL 149 N 1.13 2.93 -0.06 1.68 1.01 0.86 -1.03 120.40 126.94 2fjf s VAL 149 Ca 0.19 -1.94 0.05 0.00 0.00 0.00 0.00 61.98 60.29 2fjf s VAL 149 Cb -0.15 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 2fjf s VAL 149 CO 0.08 -0.50 -0.21 -0.75 0.00 0.00 0.00 175.10 173.72 2fjf s LYS 150 N 1.11 2.59 -0.40 2.72 2.20 0.01 -0.72 119.74 127.25 2fjf s LYS 150 Ca 0.05 -0.83 -0.00 0.00 -0.36 0.00 0.00 55.97 54.82 2fjf s LYS 150 Cb -0.21 -2.25 -0.01 0.00 -1.51 0.00 0.00 37.83 33.85 2fjf s LYS 150 CO -0.04 0.44 0.37 -0.25 -0.36 0.00 0.00 175.35 175.51 2fjf n ASP 151 N 2.81 -4.85 -4.19 1.43 8.00 -0.08 -0.41 116.55 119.25 2fjf n ASP 151 Ca -0.17 -0.09 -0.12 0.00 0.71 0.00 0.00 54.79 55.12 2fjf n ASP 151 Cb 0.52 -3.14 -0.10 0.00 -0.02 0.00 0.00 41.12 38.37 2fjf n ASP 151 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2fjf s TYR 152 N -3.03 1.03 -0.25 1.24 1.13 -0.43 -4.01 117.35 113.03 2fjf s TYR 152 Ca 0.04 -0.82 -0.22 0.00 -1.41 0.00 0.00 57.07 54.66 2fjf s TYR 152 Cb -0.00 -0.56 0.07 0.00 -1.10 0.00 0.00 41.96 40.36 2fjf s TYR 152 CO 0.38 -0.05 0.66 0.12 -2.51 0.00 0.00 175.55 174.14 2fjf s PHE 153 N -3.32 -0.75 0.00 -3.49 2.19 0.26 -0.32 117.98 112.55 2fjf s PHE 153 Ca 0.12 1.78 0.00 0.00 0.33 0.00 0.00 56.93 59.16 2fjf s PHE 153 Cb 0.03 0.28 0.00 0.00 -1.31 0.00 0.00 43.02 42.02 2fjf s PHE 153 CO -0.02 -0.36 0.00 -0.35 1.83 0.00 0.00 175.22 176.32 2fjf n PRO 154 N 2.87 1.24 -1.18 10.12 -0.04 -1.26 -0.26 135.00 146.49 2fjf n PRO 154 Ca -0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.01 2fjf n PRO 154 Cb 0.56 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.13 2fjf n PRO 154 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2fjf s GLU 155 N -0.56 1.82 0.46 0.54 0.41 -1.26 -4.82 118.70 115.30 2fjf s GLU 155 Ca 0.00 1.11 0.06 0.00 -0.41 0.00 0.00 54.97 55.73 2fjf s GLU 155 Cb 0.00 -1.85 -0.01 0.00 -1.78 0.00 0.00 34.13 30.49 2fjf s GLU 155 CO 0.00 -1.93 0.29 -1.25 -0.49 0.00 0.00 175.26 171.88 2fjf s PRO 156 N -4.88 2.30 0.14 0.39 0.04 -1.26 -4.95 135.00 126.78 2fjf s PRO 156 Ca 0.62 -1.87 0.08 0.00 0.04 0.00 0.00 61.00 59.87 2fjf s PRO 156 Cb -0.18 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 2fjf s PRO 156 CO 0.57 -0.32 -0.12 0.08 0.04 0.00 0.00 177.00 177.25 2fjf s VAL 157 N -2.65 3.14 -0.06 -0.36 1.01 -1.26 -4.51 120.40 115.71 2fjf s VAL 157 Ca 0.38 -1.52 0.05 0.00 0.00 0.00 0.00 61.98 60.90 2fjf s VAL 157 Cb 0.00 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 2fjf s VAL 157 CO 0.22 0.01 -0.23 -0.89 0.00 0.00 0.00 175.10 174.21 2fjf s THR 158 N -1.42 2.28 -0.05 3.92 2.01 -0.51 -4.98 115.64 116.89 2fjf s THR 158 Ca 0.22 -0.99 -0.00 0.00 0.31 0.00 0.00 61.69 61.23 2fjf s THR 158 Cb -0.10 -1.84 0.03 0.00 0.01 0.00 0.00 72.50 70.59 2fjf s THR 158 CO 0.13 0.57 0.00 -0.69 -0.69 0.00 0.00 174.62 173.94 2fjf s VAL 159 N -0.24 0.28 0.39 3.82 1.01 -1.26 -1.54 120.40 122.86 2fjf s VAL 159 Ca -0.01 0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.15 2fjf s VAL 159 Cb -0.13 -0.40 -0.07 0.00 0.00 0.00 0.00 36.38 35.77 2fjf s VAL 159 CO 0.03 0.21 -0.02 -0.94 0.00 0.00 0.00 175.10 174.38 2fjf s SER 160 N 1.49 3.76 -0.06 3.32 1.04 -0.36 -4.97 113.70 117.92 2fjf s SER 160 Ca -0.03 -1.32 0.04 0.00 0.48 0.00 0.00 55.95 55.12 2fjf s SER 160 Cb -0.13 -0.37 0.00 0.00 0.10 0.00 0.00 66.02 65.62 2fjf s SER 160 CO -0.03 -0.39 -0.16 0.26 0.98 0.00 0.00 173.24 173.90 2fjf s TRP 161 N -2.71 1.75 -1.26 5.02 0.52 -1.26 -0.44 118.94 120.57 2fjf s TRP 161 Ca 0.34 -0.59 -0.24 0.00 0.02 0.00 0.00 56.10 55.64 2fjf s TRP 161 Cb 0.08 -1.20 0.02 0.00 -1.15 0.00 0.00 33.47 31.22 2fjf s TRP 161 CO 0.17 -0.24 0.60 0.09 0.02 0.00 0.00 176.95 177.60 2fjf n ASN 162 N 3.42 -3.44 -4.33 2.95 4.13 0.42 -1.38 115.26 117.03 2fjf n ASN 162 Ca -0.20 -1.20 -0.39 0.00 1.68 0.00 0.00 54.58 54.47 2fjf n ASN 162 Cb 0.53 -2.21 -0.05 0.00 -1.54 0.00 0.00 39.78 36.51 2fjf n ASN 162 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2fjf n SER 163 N -2.45 -2.78 0.00 6.41 7.64 -1.26 -0.58 113.62 120.60 2fjf n SER 163 Ca -0.15 -1.08 0.00 0.00 1.01 0.00 0.00 58.87 58.65 2fjf n SER 163 Cb 0.60 -2.31 0.00 0.00 -1.01 0.00 0.00 64.21 61.49 2fjf n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fjf n GLY 164 N -1.25 1.91 0.27 0.23 0.00 -0.48 -4.89 105.19 100.99 2fjf n GLY 164 Ca 0.10 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.30 2fjf n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fjf h ALA 165 N 0.00 1.00 -3.62 4.61 0.00 -0.73 -3.38 119.26 117.14 2fjf h ALA 165 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 2fjf h ALA 165 Cb 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 17.43 2fjf h ALA 165 CO 0.00 0.00 -0.72 -1.17 0.00 0.00 0.00 179.25 177.36 2fjf s LEU 166 N -5.88 4.17 -0.08 0.00 2.96 -0.88 -4.92 118.68 114.04 2fjf s LEU 166 Ca -0.01 -1.66 0.07 0.00 -0.22 0.00 0.00 54.13 52.32 2fjf s LEU 166 Cb 0.10 -1.65 -0.10 0.00 0.50 0.00 0.00 46.19 45.04 2fjf s LEU 166 CO 0.47 -0.31 0.02 0.35 -1.32 0.00 0.00 176.35 175.56 2fjf n THR 167 N 4.46 0.57 -2.35 3.68 -2.24 -1.26 -4.17 114.28 112.96 2fjf n THR 167 Ca -0.07 -0.34 -0.43 0.00 -2.27 0.00 0.00 64.05 60.94 2fjf n THR 167 Cb 0.42 -0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 67.84 2fjf n THR 167 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2fjf s SER 168 N -4.08 6.92 -0.01 3.42 0.15 -1.26 -3.27 113.70 115.58 2fjf s SER 168 Ca -0.05 1.85 0.00 0.00 0.70 0.00 0.00 55.95 58.46 2fjf s SER 168 Cb 0.03 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2fjf s SER 168 CO 0.33 -0.73 0.00 0.61 1.20 0.00 0.00 173.24 174.65 2fjf n GLY 169 N 3.62 0.45 3.74 9.45 0.00 -1.26 -4.78 105.19 116.41 2fjf n GLY 169 Ca 0.13 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 2fjf n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fjf s VAL 170 N -2.00 4.57 -0.30 1.61 1.01 -1.20 -3.25 120.40 120.84 2fjf s VAL 170 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 61.98 63.81 2fjf s VAL 170 Cb 0.00 -4.21 0.09 0.00 0.00 0.00 0.00 36.38 32.27 2fjf s VAL 170 CO 0.00 0.37 0.07 -1.00 0.00 0.00 0.00 175.10 174.54 2fjf s HIS 171 N -0.21 2.15 -0.30 5.22 3.76 0.15 -4.99 115.29 121.07 2fjf s HIS 171 Ca 0.41 -1.95 -0.17 0.00 -0.15 0.00 0.00 55.06 53.21 2fjf s HIS 171 Cb -0.22 -1.91 -0.02 0.00 1.11 0.00 0.00 32.58 31.54 2fjf s HIS 171 CO 0.26 -0.87 0.47 0.99 -0.85 0.00 0.00 174.74 174.75 2fjf s THR 172 N 1.47 5.08 0.33 1.30 2.01 -1.26 -0.51 115.64 124.05 2fjf s THR 172 Ca 0.08 0.57 -0.21 0.00 0.31 0.00 0.00 61.69 62.44 2fjf s THR 172 Cb -0.18 -3.85 -0.10 0.00 0.01 0.00 0.00 72.50 68.39 2fjf s THR 172 CO -0.19 -0.02 0.87 -0.36 -0.69 0.00 0.00 174.62 174.23 2fjf s PHE 173 N 2.27 3.52 0.23 4.92 0.40 -0.34 -5.00 117.98 123.98 2fjf s PHE 173 Ca 0.18 1.56 -0.32 0.00 -0.60 0.00 0.00 56.93 57.76 2fjf s PHE 173 Cb -0.16 -2.78 -0.13 0.00 0.51 0.00 0.00 43.02 40.47 2fjf s PHE 173 CO 0.11 0.12 1.52 -2.30 0.70 0.00 0.00 175.22 175.38 2fjf n PRO 174 N 0.09 2.28 -1.64 0.24 -0.02 -1.26 -4.57 135.00 130.12 2fjf n PRO 174 Ca 0.03 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.91 2fjf n PRO 174 Cb 0.52 -2.55 0.01 0.00 -0.02 0.00 0.00 33.50 31.46 2fjf n PRO 174 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fjf n ALA 175 N 2.56 0.48 -2.55 3.55 0.00 -1.26 -4.88 120.51 118.41 2fjf n ALA 175 Ca 0.13 0.27 -0.32 0.00 0.00 0.00 0.00 53.44 53.52 2fjf n ALA 175 Cb 0.32 -2.13 -0.11 0.00 0.00 0.00 0.00 19.45 17.53 2fjf n ALA 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fjf s VAL 176 N -1.22 3.39 -0.45 0.00 0.11 -0.64 -4.96 120.40 116.63 2fjf s VAL 176 Ca 0.61 -0.86 -0.21 0.00 -2.93 0.00 0.00 61.98 58.60 2fjf s VAL 176 Cb -0.56 -2.45 0.03 0.00 -1.53 0.00 0.00 36.38 31.87 2fjf s VAL 176 CO 0.58 0.41 0.65 -0.22 -3.33 0.00 0.00 175.10 173.19 2fjf s LEU 177 N -1.33 4.54 0.58 2.54 0.20 -1.26 -2.44 118.68 121.50 2fjf s LEU 177 Ca 0.16 -0.41 -0.17 0.00 0.69 0.00 0.00 54.13 54.40 2fjf s LEU 177 Cb -0.11 -2.70 -0.04 0.00 -0.43 0.00 0.00 46.19 42.91 2fjf s LEU 177 CO 0.06 -0.81 1.09 -1.10 -0.29 0.00 0.00 176.35 175.30 2fjf s GLN 178 N 2.85 3.25 0.00 1.98 -0.21 -0.54 -4.88 119.66 122.11 2fjf s GLN 178 Ca 0.22 1.40 0.06 0.00 0.02 0.00 0.00 55.36 57.05 2fjf s GLN 178 Cb -0.15 -2.01 0.35 0.00 1.00 0.00 0.00 33.01 32.20 2fjf s GLN 178 CO 0.18 -0.89 0.75 -1.13 -2.12 0.00 0.00 175.29 172.09 2fjf n SER 179 N -1.77 0.00 0.02 5.90 3.41 -1.26 -0.74 113.62 119.18 2fjf n SER 179 Ca 0.10 -0.30 0.12 0.00 -0.26 0.00 0.00 58.87 58.53 2fjf n SER 179 Cb 0.52 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.68 2fjf n SER 179 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fjf n SER 180 N -0.88 0.56 0.00 4.04 3.41 -1.26 -4.95 113.62 114.55 2fjf n SER 180 Ca 0.04 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2fjf n SER 180 Cb 0.02 0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 2fjf n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fjf n GLY 181 N 1.43 0.77 3.92 5.00 0.00 0.08 -5.06 105.19 111.34 2fjf n GLY 181 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2fjf n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fjf s LEU 182 N 0.00 4.36 0.43 0.99 1.02 -1.26 -4.89 118.68 119.33 2fjf s LEU 182 Ca 0.00 0.26 -0.03 0.00 0.02 0.00 0.00 54.13 54.39 2fjf s LEU 182 Cb 0.00 -2.96 -0.03 0.00 0.02 0.00 0.00 46.19 43.22 2fjf s LEU 182 CO 0.00 0.16 0.69 -0.31 0.02 0.00 0.00 176.35 176.91 2fjf s TYR 183 N -1.53 3.52 -0.15 0.29 2.02 0.56 -1.47 117.35 120.59 2fjf s TYR 183 Ca 0.35 0.61 -0.27 0.00 -0.37 0.00 0.00 57.07 57.39 2fjf s TYR 183 Cb -0.13 -2.16 0.07 0.00 -0.40 0.00 0.00 41.96 39.34 2fjf s TYR 183 CO 0.28 -0.14 0.67 -1.54 -1.57 0.00 0.00 175.55 173.25 2fjf s SER 184 N -4.09 -0.67 0.22 2.29 1.04 -1.02 -0.90 113.70 110.57 2fjf s SER 184 Ca 0.45 1.02 -0.03 0.00 0.48 0.00 0.00 55.95 57.87 2fjf s SER 184 Cb -0.10 0.96 -0.03 0.00 0.10 0.00 0.00 66.02 66.95 2fjf s SER 184 CO 0.41 -0.42 0.21 -1.48 0.98 0.00 0.00 173.24 172.94 2fjf s LEU 185 N -0.42 1.03 0.07 2.42 0.05 0.10 -1.63 118.68 120.30 2fjf s LEU 185 Ca -0.06 -1.33 0.09 0.00 0.05 0.00 0.00 54.13 52.88 2fjf s LEU 185 Cb -0.03 0.67 -0.03 0.00 -2.05 0.00 0.00 46.19 44.76 2fjf s LEU 185 CO 0.05 -0.92 -0.24 -0.44 -0.55 0.00 0.00 176.35 174.25 2fjf s SER 186 N -3.15 2.91 -0.07 1.48 0.01 -1.26 -0.10 113.70 113.52 2fjf s SER 186 Ca 0.36 -0.61 0.05 0.00 1.31 0.00 0.00 55.95 57.05 2fjf s SER 186 Cb 0.05 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 66.04 2fjf s SER 186 CO 0.13 0.19 -0.22 -0.55 0.41 0.00 0.00 173.24 173.19 2fjf s SER 187 N -1.47 3.32 0.04 2.44 0.15 -0.21 -1.20 113.70 116.78 2fjf s SER 187 Ca 0.10 -0.45 0.04 0.00 0.70 0.00 0.00 55.95 56.35 2fjf s SER 187 Cb -0.10 -0.98 -0.02 0.00 -1.71 0.00 0.00 66.02 63.21 2fjf s SER 187 CO 0.03 0.24 -0.13 -0.69 1.20 0.00 0.00 173.24 173.90 2fjf s VAL 188 N -0.14 0.98 -0.06 4.45 1.01 0.33 0.06 120.40 127.03 2fjf s VAL 188 Ca -0.04 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 2fjf s VAL 188 Cb -0.14 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.35 2fjf s VAL 188 CO 0.04 -0.05 0.16 0.54 0.00 0.00 0.00 175.10 175.78 2fjf s VAL 189 N -0.89 -0.00 -0.15 2.92 0.11 0.14 0.31 120.40 122.84 2fjf s VAL 189 Ca -0.00 0.02 -0.09 0.00 -2.93 0.00 0.00 61.98 58.97 2fjf s VAL 189 Cb -0.08 -0.23 -0.05 0.00 -1.53 0.00 0.00 36.38 34.50 2fjf s VAL 189 CO 0.01 0.01 0.16 0.42 -3.33 0.00 0.00 175.10 172.36 2fjf s THR 190 N 0.19 5.43 0.09 5.04 -4.23 -1.20 -1.23 115.64 119.73 2fjf s THR 190 Ca -0.01 0.25 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 2fjf s THR 190 Cb -0.02 -3.46 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 2fjf s THR 190 CO -0.00 0.52 -0.06 0.68 -0.54 0.00 0.00 174.62 175.21 2fjf s VAL 191 N -0.30 0.62 0.18 2.29 -7.23 -0.40 -4.83 120.40 110.72 2fjf s VAL 191 Ca 0.12 -1.81 -0.33 0.00 -1.81 0.00 0.00 61.98 58.15 2fjf s VAL 191 Cb -0.12 -1.53 -0.15 0.00 0.56 0.00 0.00 36.38 35.15 2fjf s VAL 191 CO 0.02 -0.83 1.40 -0.81 -0.31 0.00 0.00 175.10 174.57 2fjf n PRO 192 N 0.16 1.75 0.28 4.82 -0.04 -1.26 -0.65 135.00 140.06 2fjf n PRO 192 Ca -0.14 0.63 0.14 0.00 -0.04 0.00 0.00 63.50 64.09 2fjf n PRO 192 Cb 0.60 -2.29 0.81 0.00 -0.04 0.00 0.00 33.50 32.58 2fjf n PRO 192 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2fjf h SER 193 N 4.64 0.00 0.48 3.54 0.02 -1.86 -1.99 113.55 118.37 2fjf h SER 193 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2fjf h SER 193 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2fjf h SER 193 CO 0.79 0.08 0.00 -1.54 -1.14 0.00 0.00 176.83 175.02 2fjf n SER 194 N -3.66 0.00 -1.11 3.07 3.41 -1.26 -3.63 113.62 110.44 2fjf n SER 194 Ca -0.02 -0.15 0.12 0.00 -0.26 0.00 0.00 58.87 58.56 2fjf n SER 194 Cb 0.18 -0.27 0.20 0.00 -0.26 0.00 0.00 64.21 64.07 2fjf n SER 194 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fjf n SER 195 N -1.27 3.35 -4.81 4.04 3.41 -0.75 -4.91 113.62 112.69 2fjf n SER 195 Ca 0.13 -1.99 -0.34 0.00 -0.26 0.00 0.00 58.87 56.41 2fjf n SER 195 Cb 0.21 -0.20 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 2fjf n SER 195 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2fjf s LEU 196 N -1.59 3.96 0.00 1.04 1.43 -1.24 -2.48 118.68 119.79 2fjf s LEU 196 Ca 0.37 1.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 2fjf s LEU 196 Cb 0.22 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.97 2fjf s LEU 196 CO 0.31 -0.49 0.00 0.61 0.23 0.00 0.00 176.35 177.01 2fjf n GLY 197 N -0.33 2.96 0.38 -3.19 0.00 -1.26 -4.71 105.19 99.03 2fjf n GLY 197 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 2fjf n GLY 197 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fjf n THR 198 N -2.00 0.70 -2.35 2.61 -1.04 -1.24 -4.95 114.28 106.01 2fjf n THR 198 Ca 0.00 0.28 -0.43 0.00 -2.04 0.00 0.00 64.05 61.86 2fjf n THR 198 Cb 0.00 -1.71 -0.02 0.00 -1.82 0.00 0.00 70.33 66.78 2fjf n THR 198 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2fjf s GLN 199 N -1.79 3.97 -0.17 -2.82 2.00 -1.04 -5.00 119.66 114.81 2fjf s GLN 199 Ca -0.09 1.44 -0.21 0.00 -2.00 0.00 0.00 55.36 54.50 2fjf s GLN 199 Cb 0.01 -3.89 -0.03 0.00 0.80 0.00 0.00 33.01 29.90 2fjf s GLN 199 CO 0.14 -1.06 0.63 0.95 -0.50 0.00 0.00 175.29 175.45 2fjf s THR 200 N 4.35 5.04 -0.22 -0.34 -4.23 -1.26 -4.73 115.64 114.25 2fjf s THR 200 Ca 0.59 1.21 -0.09 0.00 -1.18 0.00 0.00 61.69 62.23 2fjf s THR 200 Cb -0.20 -3.95 -0.05 0.00 1.34 0.00 0.00 72.50 69.65 2fjf s THR 200 CO 0.23 0.16 0.12 -0.31 -0.54 0.00 0.00 174.62 174.27 2fjf s TYR 201 N 1.59 3.30 -0.08 3.99 2.02 -1.26 -4.98 117.35 121.92 2fjf s TYR 201 Ca 0.30 0.15 0.03 0.00 -0.37 0.00 0.00 57.07 57.18 2fjf s TYR 201 Cb -0.16 -2.19 0.01 0.00 -0.40 0.00 0.00 41.96 39.22 2fjf s TYR 201 CO 0.12 0.10 -0.18 0.42 -1.57 0.00 0.00 175.55 174.44 2fjf s ILE 202 N 0.77 1.56 -0.17 2.71 1.01 -1.26 0.50 121.20 126.32 2fjf s ILE 202 Ca 0.06 -0.73 -0.08 0.00 0.00 0.00 0.00 60.65 59.90 2fjf s ILE 202 Cb -0.13 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2fjf s ILE 202 CO 0.02 0.45 0.11 0.00 0.00 0.00 0.00 174.94 175.52 2fjf s ASN 204 N -0.05 5.74 -0.10 0.00 -0.87 0.42 -0.31 114.94 119.76 2fjf s ASN 204 Ca 0.09 -0.21 0.04 0.00 -1.57 0.00 0.00 52.86 51.20 2fjf s ASN 204 Cb -0.12 -2.06 0.00 0.00 -0.02 0.00 0.00 41.25 39.06 2fjf s ASN 204 CO 0.00 -0.10 -0.23 -0.69 -2.57 0.00 0.00 177.10 173.51 2fjf s VAL 205 N 1.69 1.96 -0.08 1.60 1.01 0.44 -1.23 120.40 125.79 2fjf s VAL 205 Ca 0.06 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.11 2fjf s VAL 205 Cb -0.16 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.53 2fjf s VAL 205 CO 0.08 0.54 -0.15 0.20 0.00 0.00 0.00 175.10 175.77 2fjf s ASN 206 N 0.43 2.15 -0.61 3.32 0.01 -0.59 -0.82 114.94 118.82 2fjf s ASN 206 Ca -0.17 -0.37 0.05 0.00 -0.71 0.00 0.00 52.86 51.65 2fjf s ASN 206 Cb -0.18 -0.98 0.17 0.00 0.41 0.00 0.00 41.25 40.67 2fjf s ASN 206 CO 0.07 0.05 0.44 -2.28 -1.51 0.00 0.00 177.10 173.87 2fjf s HIS 207 N 0.71 2.83 0.26 2.20 5.65 0.12 -1.42 115.29 125.65 2fjf s HIS 207 Ca -0.13 -3.03 -0.02 0.00 0.25 0.00 0.00 55.06 52.13 2fjf s HIS 207 Cb -0.16 -2.19 0.46 0.00 -1.18 0.00 0.00 32.58 29.51 2fjf s HIS 207 CO 0.03 -0.63 1.83 0.87 -0.65 0.00 0.00 174.74 176.19 2fjf h LYS 208 N 5.53 0.90 -0.49 2.88 1.57 -1.79 -1.17 116.57 124.01 2fjf h LYS 208 Ca 0.17 -0.05 0.14 0.00 -1.87 0.00 0.00 60.65 59.04 2fjf h LYS 208 Cb 0.80 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 2fjf h LYS 208 CO 0.61 0.60 0.46 -1.35 -0.57 0.00 0.00 179.45 179.20 2fjf h PRO 209 N 0.93 0.00 -0.17 3.15 0.11 -1.93 -1.61 132.00 132.49 2fjf h PRO 209 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 2fjf h PRO 209 Cb 0.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.49 2fjf h PRO 209 CO -0.24 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.42 2fjf n SER 210 N -3.88 2.36 -3.78 -2.05 3.41 -0.62 -4.99 113.62 104.07 2fjf n SER 210 Ca 0.09 -1.85 -0.27 0.00 -0.26 0.00 0.00 58.87 56.58 2fjf n SER 210 Cb 0.66 -0.11 0.05 0.00 -0.26 0.00 0.00 64.21 64.54 2fjf n SER 210 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2fjf n ASN 211 N 0.17 -4.84 -4.41 4.04 5.15 -0.61 -4.87 115.26 109.90 2fjf n ASN 211 Ca 0.06 -0.70 -0.37 0.00 -0.60 0.00 0.00 54.58 52.97 2fjf n ASN 211 Cb 0.32 -4.32 -0.13 0.00 -0.53 0.00 0.00 39.78 35.13 2fjf n ASN 211 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2fjf s THR 212 N -3.35 4.22 -0.14 -0.44 2.01 -0.54 -4.98 115.64 112.42 2fjf s THR 212 Ca 0.55 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 62.23 2fjf s THR 212 Cb -0.26 -3.03 0.02 0.00 0.01 0.00 0.00 72.50 69.23 2fjf s THR 212 CO 0.79 0.26 -0.18 -0.75 -0.69 0.00 0.00 174.62 174.05 2fjf s LYS 213 N 1.58 2.59 -0.10 4.92 2.20 -1.26 0.12 119.74 129.78 2fjf s LYS 213 Ca 0.05 -0.69 0.01 0.00 -0.36 0.00 0.00 55.97 54.98 2fjf s LYS 213 Cb -0.16 -2.19 0.02 0.00 -1.51 0.00 0.00 37.83 33.99 2fjf s LYS 213 CO 0.03 -0.10 -0.11 0.08 -0.36 0.00 0.00 175.35 174.89 2fjf s VAL 214 N 1.07 1.23 -0.38 4.02 1.01 -0.00 -4.99 120.40 122.36 2fjf s VAL 214 Ca -0.03 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 2fjf s VAL 214 Cb -0.14 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.07 2fjf s VAL 214 CO -0.05 0.39 0.26 -1.81 0.00 0.00 0.00 175.10 173.89 2fjf s ASP 215 N 1.25 5.99 -0.24 3.32 1.01 -1.26 -0.42 116.67 126.31 2fjf s ASP 215 Ca -0.03 -0.80 -0.05 0.00 0.71 0.00 0.00 52.55 52.38 2fjf s ASP 215 Cb -0.14 -2.12 -0.00 0.00 1.01 0.00 0.00 42.92 41.67 2fjf s ASP 215 CO -0.04 -0.38 0.00 -0.75 0.21 0.00 0.00 175.17 174.21 2fjf s LYS 216 N 1.66 3.31 -0.17 8.23 2.47 0.57 -4.90 119.74 130.92 2fjf s LYS 216 Ca 0.05 -0.68 -0.29 0.00 -1.56 0.00 0.00 55.97 53.48 2fjf s LYS 216 Cb -0.19 -3.15 -0.01 0.00 -1.46 0.00 0.00 37.83 33.03 2fjf s LYS 216 CO 0.09 -0.27 1.25 0.21 0.16 0.00 0.00 175.35 176.79 2fjf s LYS 217 N 1.49 4.23 -0.27 4.03 2.47 -1.26 -0.35 119.74 130.09 2fjf s LYS 217 Ca 0.05 1.64 -0.08 0.00 -1.56 0.00 0.00 55.97 56.02 2fjf s LYS 217 Cb -0.15 -3.75 -0.02 0.00 -1.46 0.00 0.00 37.83 32.45 2fjf s LYS 217 CO -0.01 -0.70 0.10 0.08 0.16 0.00 0.00 175.35 174.98 2fjf s VAL 218 N 3.47 4.35 0.12 4.02 1.01 0.18 -4.92 120.40 128.63 2fjf s VAL 218 Ca 0.54 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 62.17 2fjf s VAL 218 Cb -0.21 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2fjf s VAL 218 CO 0.14 0.22 0.11 -1.83 0.00 0.00 0.00 175.10 173.74 2fjf s GLU 219 N 1.60 0.92 0.28 2.72 -1.05 -1.26 -4.13 118.70 117.78 2fjf s GLU 219 Ca 0.05 -1.29 -0.29 0.00 -0.15 0.00 0.00 54.97 53.29 2fjf s GLU 219 Cb -0.16 0.28 -0.10 0.00 -0.44 0.00 0.00 34.13 33.71 2fjf s GLU 219 CO 0.04 -0.28 1.26 -2.14 0.95 0.00 0.00 175.26 175.10 2fjf s PRO 220 N -3.99 4.43 0.00 -4.83 0.02 -1.26 -4.61 135.00 124.76 2fjf s PRO 220 Ca 0.18 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.27 2fjf s PRO 220 Cb 0.06 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.45 2fjf s PRO 220 CO -0.02 -0.13 0.00 1.63 -0.33 0.00 0.00 177.00 178.16 2fjf n LYS 221 N 1.51 2.33 0.06 5.54 5.02 -1.26 -5.00 118.16 126.35 2fjf n LYS 221 Ca 0.02 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.29 2fjf n LYS 221 Cb 0.43 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.43 2fjf n LYS 221 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 2fjf h SER 222 N 0.00 -0.12 0.00 4.39 0.02 -2.00 -3.54 113.55 112.30 2fjf h SER 222 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2fjf h SER 222 Cb 0.00 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2fjf h SER 222 CO 0.00 -0.08 0.00 0.00 -1.14 0.00 0.00 176.83 175.61