#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 4.45 0.08 6.31 1.01 -1.26 -4.17 120.40 126.82 2fjf s VAL 2 Ca 0.00 1.75 -0.26 0.00 0.00 0.00 0.00 61.98 63.47 2fjf s VAL 2 Cb 0.00 -4.12 0.07 0.00 0.00 0.00 0.00 36.38 32.33 2fjf s VAL 2 CO 0.00 0.09 0.65 0.00 0.00 0.00 0.00 175.10 175.84 2fjf s GLN 3 N 1.38 1.17 -0.19 2.72 -2.07 -1.03 -5.00 119.66 116.65 2fjf s GLN 3 Ca 0.55 -0.23 0.01 0.00 -1.82 0.00 0.00 55.36 53.87 2fjf s GLN 3 Cb -0.24 0.54 0.03 0.00 -1.09 0.00 0.00 33.01 32.26 2fjf s GLN 3 CO 0.26 -0.47 -0.13 -0.51 -1.32 0.00 0.00 175.29 173.12 2fjf s LEU 4 N -2.23 2.22 -0.18 2.60 1.02 -1.26 -0.94 118.68 119.91 2fjf s LEU 4 Ca -0.02 -0.79 0.00 0.00 0.02 0.00 0.00 54.13 53.34 2fjf s LEU 4 Cb -0.01 -1.30 0.01 0.00 0.02 0.00 0.00 46.19 44.92 2fjf s LEU 4 CO -0.06 -0.10 -0.17 -0.69 0.02 0.00 0.00 176.35 175.35 2fjf s VAL 5 N 1.37 2.35 0.36 -1.59 1.01 0.03 -3.92 120.40 120.00 2fjf s VAL 5 Ca 0.01 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.21 2fjf s VAL 5 Cb -0.15 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 2fjf s VAL 5 CO -0.09 0.52 0.43 -1.61 0.00 0.00 0.00 175.10 174.35 2fjf s GLU 6 N 1.20 2.92 0.14 2.72 2.02 -1.26 0.28 118.70 126.72 2fjf s GLU 6 Ca 0.02 -1.17 -0.25 0.00 0.02 0.00 0.00 54.97 53.59 2fjf s GLU 6 Cb -0.14 -2.68 0.07 0.00 0.10 0.00 0.00 34.13 31.48 2fjf s GLU 6 CO -0.08 -0.01 0.97 -1.54 0.02 0.00 0.00 175.26 174.62 2fjf s SER 7 N -4.15 -0.18 0.00 -0.19 1.04 -0.88 -4.97 113.70 104.37 2fjf s SER 7 Ca 0.46 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.51 2fjf s SER 7 Cb -0.08 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2fjf s SER 7 CO 0.30 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 174.26 2fjf n GLY 8 N -0.46 0.75 3.77 7.32 0.00 -1.26 -1.11 105.19 114.19 2fjf n GLY 8 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.45 1.84 0.00 -0.02 0.00 -1.26 -4.65 107.32 101.77 2fjf s GLY 9 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.09 2fjf s GLY 9 CO 0.00 0.72 0.00 0.61 0.00 0.00 0.00 173.10 174.43 2fjf n GLY 10 N -0.94 -0.73 3.73 0.20 0.00 0.08 -4.87 105.19 102.66 2fjf n GLY 10 Ca 0.10 -0.97 -0.38 0.00 0.00 0.00 0.00 46.02 44.76 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 4.29 0.07 0.99 0.20 -1.26 -1.06 118.68 121.92 2fjf s LEU 11 Ca 0.00 0.80 0.03 0.00 0.69 0.00 0.00 54.13 55.65 2fjf s LEU 11 Cb 0.00 -2.66 -0.03 0.00 -0.43 0.00 0.00 46.19 43.07 2fjf s LEU 11 CO 0.00 0.04 -0.09 -0.69 -0.29 0.00 0.00 176.35 175.32 2fjf s VAL 12 N 0.45 0.73 0.55 1.68 1.01 -0.40 -4.98 120.40 119.45 2fjf s VAL 12 Ca 0.25 -1.44 -0.17 0.00 0.00 0.00 0.00 61.98 60.61 2fjf s VAL 12 Cb -0.15 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2fjf s VAL 12 CO 0.10 -0.53 1.05 0.00 0.00 0.00 0.00 175.10 175.72 2fjf s GLN 13 N -2.43 3.51 0.24 2.72 0.00 -1.24 -1.06 119.66 121.40 2fjf s GLN 13 Ca -0.00 1.24 -0.31 0.00 -0.00 0.00 0.00 55.36 56.28 2fjf s GLN 13 Cb -0.05 -2.06 -0.12 0.00 0.00 0.00 0.00 33.01 30.78 2fjf s GLN 13 CO -0.01 -0.66 1.61 -2.30 0.00 0.00 0.00 175.29 173.93 2fjf n PRO 14 N -1.67 2.56 -0.02 9.60 -0.02 -1.26 -0.52 135.00 143.67 2fjf n PRO 14 Ca 0.09 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2fjf n PRO 14 Cb 0.53 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 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 2.89 1.80 0.00 -1.23 0.00 0.17 -4.93 105.19 103.88 2fjf n GLY 15 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.58 2.97 -0.02 0.00 0.32 -3.96 105.19 100.92 2fjf n GLY 16 Ca 0.00 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.21 0.25 -0.10 1.61 0.01 -1.26 -2.43 113.70 110.57 2fjf s SER 17 Ca 0.00 -0.42 -0.17 0.00 1.31 0.00 0.00 55.95 56.67 2fjf s SER 17 Cb 0.00 0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.35 2fjf s SER 17 CO 0.00 -0.24 0.43 -0.76 0.41 0.00 0.00 173.24 173.08 2fjf s LEU 18 N -1.23 0.37 -0.15 2.44 1.43 -0.09 -4.98 118.68 116.47 2fjf s LEU 18 Ca -0.13 0.59 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 2fjf s LEU 18 Cb -0.08 1.57 0.02 0.00 0.03 0.00 0.00 46.19 47.72 2fjf s LEU 18 CO -0.01 -0.32 -0.19 -0.60 0.23 0.00 0.00 176.35 175.46 2fjf s ARG 19 N -0.50 2.80 -0.08 1.70 3.52 -1.26 -0.04 118.95 125.09 2fjf s ARG 19 Ca -0.06 -0.77 -0.11 0.00 -0.13 0.00 0.00 55.73 54.66 2fjf s ARG 19 Cb -0.03 -2.35 -0.05 0.00 -1.56 0.00 0.00 34.95 30.96 2fjf s ARG 19 CO 0.03 -0.11 0.28 -0.51 -0.81 0.00 0.00 175.30 174.18 2fjf s LEU 20 N 1.07 4.40 0.22 -0.88 1.43 -0.38 -4.59 118.68 119.95 2fjf s LEU 20 Ca -0.02 0.68 0.11 0.00 -1.03 0.00 0.00 54.13 53.87 2fjf s LEU 20 Cb -0.14 -2.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.69 2fjf s LEU 20 CO -0.06 0.32 -0.17 -0.94 0.23 0.00 0.00 176.35 175.73 2fjf s SER 21 N -0.79 3.77 -0.34 2.29 1.04 -0.27 -1.21 113.70 118.18 2fjf s SER 21 Ca 0.19 -0.83 -0.01 0.00 0.48 0.00 0.00 55.95 55.78 2fjf s SER 21 Cb -0.14 -0.43 0.13 0.00 0.10 0.00 0.00 66.02 65.68 2fjf s SER 21 CO 0.08 0.08 0.19 0.00 0.98 0.00 0.00 173.24 174.57 2fjf s ALA 23 N 1.25 3.56 0.11 0.00 0.00 0.14 -1.27 121.76 125.55 2fjf s ALA 23 Ca 0.16 0.07 -0.18 0.00 0.00 0.00 0.00 51.96 52.01 2fjf s ALA 23 Cb -0.22 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 2fjf s ALA 23 CO -0.08 -0.77 0.58 0.00 0.00 0.00 0.00 175.76 175.50 2fjf s ALA 24 N 2.44 3.57 -0.03 0.00 0.00 -0.65 -0.79 121.76 126.30 2fjf s ALA 24 Ca 0.40 0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.44 2fjf s ALA 24 Cb -0.16 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.31 2fjf s ALA 24 CO 0.11 0.40 -0.22 -1.12 0.00 0.00 0.00 175.76 174.94 2fjf s SER 25 N -1.31 2.59 -0.56 0.00 0.01 -0.11 -4.83 113.70 109.48 2fjf s SER 25 Ca 0.33 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2fjf s SER 25 Cb -0.18 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.60 2fjf s SER 25 CO 0.19 0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.70 2fjf n GLY 26 N 2.73 0.77 3.64 3.44 0.00 -1.26 -2.47 105.19 112.05 2fjf n GLY 26 Ca -0.16 -0.50 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.09 -0.31 -0.32 1.61 -0.71 -1.26 -4.64 117.98 110.26 2fjf s PHE 27 Ca 0.00 0.01 -0.15 0.00 -1.04 0.00 0.00 56.93 55.76 2fjf s PHE 27 Cb 0.00 0.62 -0.02 0.00 -1.21 0.00 0.00 43.02 42.41 2fjf s PHE 27 CO 0.00 -0.91 0.35 0.99 -1.34 0.00 0.00 175.22 174.32 2fjf s THR 28 N -3.58 5.18 0.41 -4.49 2.01 -1.26 -4.91 115.64 108.99 2fjf s THR 28 Ca 0.07 0.19 0.17 0.00 0.31 0.00 0.00 61.69 62.43 2fjf s THR 28 Cb -0.03 -3.77 0.38 0.00 0.01 0.00 0.00 72.50 69.09 2fjf s THR 28 CO -0.03 -0.00 1.85 0.16 -0.69 0.00 0.00 174.62 175.90 2fjf h ILE 29 N 5.49 0.67 0.00 1.82 -0.00 -1.94 -1.12 117.51 122.44 2fjf h ILE 29 Ca -0.31 -0.15 0.00 0.00 -0.00 0.00 0.00 64.86 64.41 2fjf h ILE 29 Cb 1.15 0.20 0.00 0.00 -0.00 0.00 0.00 36.82 38.18 2fjf h ILE 29 CO 0.67 0.08 0.00 -1.54 -0.00 0.00 0.00 178.15 177.36 2fjf n SER 30 N -4.53 0.00 -0.06 2.16 3.41 -1.26 -1.41 113.62 111.94 2fjf n SER 30 Ca 0.20 0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.95 2fjf n SER 30 Cb 0.70 -0.29 0.43 0.00 -0.26 0.00 0.00 64.21 64.78 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 -1.29 0.45 -4.21 4.04 8.00 -0.42 -0.24 116.55 122.87 2fjf n ASP 31 Ca 0.09 -0.23 -0.15 0.00 0.71 0.00 0.00 54.79 55.22 2fjf n ASP 31 Cb 0.16 -0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.16 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 -2.83 1.18 0.56 1.24 1.51 -0.50 -4.86 117.35 113.66 2fjf s TYR 32 Ca 0.17 -0.68 -0.20 0.00 -1.01 0.00 0.00 57.07 55.35 2fjf s TYR 32 Cb 0.19 -0.63 -0.05 0.00 -0.11 0.00 0.00 41.96 41.37 2fjf s TYR 32 CO 0.59 0.05 1.21 -1.58 -1.11 0.00 0.00 175.55 174.71 2fjf s TRP 33 N -2.74 2.47 -0.12 2.71 0.52 0.11 -3.84 118.94 118.05 2fjf s TRP 33 Ca 0.10 1.50 0.00 0.00 0.02 0.00 0.00 56.10 57.73 2fjf s TRP 33 Cb -0.01 -3.49 -0.01 0.00 -1.15 0.00 0.00 33.47 28.80 2fjf s TRP 33 CO 0.01 -2.15 -0.14 0.42 0.02 0.00 0.00 176.95 175.11 2fjf s ILE 34 N -1.56 2.95 -0.02 2.03 -1.09 -0.84 -2.09 121.20 120.58 2fjf s ILE 34 Ca 0.74 -0.70 0.02 0.00 -2.23 0.00 0.00 60.65 58.48 2fjf s ILE 34 Cb -0.31 -2.23 -0.03 0.00 -1.58 0.00 0.00 42.46 38.31 2fjf s ILE 34 CO 0.35 0.53 -0.06 -1.00 -1.23 0.00 0.00 174.94 173.53 2fjf s HIS 35 N 0.33 2.94 -0.16 3.97 3.76 -0.11 -1.39 115.29 124.61 2fjf s HIS 35 Ca -0.11 0.00 -0.07 0.00 -0.15 0.00 0.00 55.06 54.73 2fjf s HIS 35 Cb -0.16 -1.65 -0.04 0.00 1.11 0.00 0.00 32.58 31.84 2fjf s HIS 35 CO 0.06 0.38 0.06 -1.58 -0.85 0.00 0.00 174.74 172.81 2fjf s TRP 36 N -0.95 3.28 -0.03 1.40 0.52 0.23 -1.34 118.94 122.06 2fjf s TRP 36 Ca 0.16 0.14 0.02 0.00 0.02 0.00 0.00 56.10 56.44 2fjf s TRP 36 Cb -0.11 -2.03 0.00 0.00 -1.15 0.00 0.00 33.47 30.18 2fjf s TRP 36 CO 0.06 0.26 -0.09 0.08 0.02 0.00 0.00 176.95 177.27 2fjf s VAL 37 N 0.07 0.79 0.22 4.03 1.01 0.19 -0.91 120.40 125.80 2fjf s VAL 37 Ca 0.06 -0.36 0.11 0.00 0.00 0.00 0.00 61.98 61.78 2fjf s VAL 37 Cb -0.12 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 2fjf s VAL 37 CO 0.01 0.25 -0.21 0.00 0.00 0.00 0.00 175.10 175.15 2fjf s ARG 38 N 0.21 1.52 -0.32 2.72 1.70 0.07 0.38 118.95 125.23 2fjf s ARG 38 Ca -0.03 -1.59 -0.02 0.00 -0.47 0.00 0.00 55.73 53.61 2fjf s ARG 38 Cb -0.09 -1.68 0.11 0.00 -0.57 0.00 0.00 34.95 32.73 2fjf s ARG 38 CO 0.01 0.34 0.16 -1.14 -1.08 0.00 0.00 175.30 173.58 2fjf s GLN 39 N -3.05 0.46 0.42 3.89 0.74 0.11 -0.79 119.66 121.44 2fjf s GLN 39 Ca 0.23 -0.97 -0.26 0.00 0.05 0.00 0.00 55.36 54.41 2fjf s GLN 39 Cb -0.06 -1.42 -0.09 0.00 1.10 0.00 0.00 33.01 32.54 2fjf s GLN 39 CO 0.11 -1.08 1.41 0.00 -0.55 0.00 0.00 175.29 175.17 2fjf s ALA 40 N 1.58 3.34 -0.46 1.58 0.00 -1.26 -1.41 121.76 125.14 2fjf s ALA 40 Ca 0.12 1.43 -0.44 0.00 0.00 0.00 0.00 51.96 53.07 2fjf s ALA 40 Cb -0.19 -3.57 -0.18 0.00 0.00 0.00 0.00 23.12 19.18 2fjf s ALA 40 CO -0.21 -1.05 1.85 -2.30 0.00 0.00 0.00 175.76 174.05 2fjf n PRO 41 N 0.10 0.23 0.00 0.00 -0.02 -1.26 0.48 135.00 134.52 2fjf n PRO 41 Ca 0.03 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2fjf n PRO 41 Cb 0.42 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 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 5.40 2.51 1.72 -1.23 0.00 -1.26 -5.02 105.19 107.31 2fjf n GLY 42 Ca 0.39 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.32 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 0.44 0.00 1.61 4.01 0.18 -5.13 118.16 117.27 2fjf n LYS 43 Ca 0.00 -1.25 0.00 0.00 -0.51 0.00 0.00 58.31 56.55 2fjf n LYS 43 Cb 0.00 -0.24 0.00 0.00 -0.51 0.00 0.00 35.03 34.28 2fjf n LYS 43 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2fjf n GLY 44 N 1.69 0.14 3.37 0.72 0.00 -1.26 -4.73 105.19 105.11 2fjf n GLY 44 Ca 0.07 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 44.09 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 4.21 -0.30 0.99 1.43 -1.26 -4.32 118.68 119.43 2fjf s LEU 45 Ca 0.00 -0.80 -0.08 0.00 -1.03 0.00 0.00 54.13 52.22 2fjf s LEU 45 Cb 0.00 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.27 2fjf s LEU 45 CO 0.00 -0.26 0.12 -0.70 0.23 0.00 0.00 176.35 175.73 2fjf s GLU 46 N 1.53 3.20 0.35 1.70 2.12 0.03 -4.92 118.70 122.70 2fjf s GLU 46 Ca 0.02 -0.80 -0.29 0.00 0.36 0.00 0.00 54.97 54.27 2fjf s GLU 46 Cb -0.18 -3.47 -0.11 0.00 0.26 0.00 0.00 34.13 30.63 2fjf s GLU 46 CO 0.05 -0.44 1.45 -0.46 -0.54 0.00 0.00 175.26 175.32 2fjf s TRP 47 N 1.55 2.75 -0.02 5.30 -0.00 -1.26 -0.75 118.94 126.50 2fjf s TRP 47 Ca 0.04 1.19 -0.01 0.00 -0.00 0.00 0.00 56.10 57.31 2fjf s TRP 47 Cb -0.17 -3.93 -0.01 0.00 -0.00 0.00 0.00 33.47 29.36 2fjf s TRP 47 CO 0.04 -2.74 -0.03 0.28 -0.00 0.00 0.00 176.95 174.51 2fjf n VAL 48 N 0.83 0.13 -3.51 5.86 0.31 -0.08 -4.68 118.33 117.19 2fjf n VAL 48 Ca 0.02 -0.04 -0.16 0.00 -0.01 0.00 0.00 64.34 64.15 2fjf n VAL 48 Cb 0.40 -1.31 -0.05 0.00 -0.91 0.00 0.00 33.84 31.96 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 -2.04 -1.64 -0.05 3.52 0.00 -1.17 -0.59 121.76 119.80 2fjf s ALA 49 Ca -0.03 0.96 -0.05 0.00 0.00 0.00 0.00 51.96 52.85 2fjf s ALA 49 Cb 0.01 0.30 0.01 0.00 0.00 0.00 0.00 23.12 23.45 2fjf s ALA 49 CO 0.04 -0.50 0.13 0.20 0.00 0.00 0.00 175.76 175.64 2fjf s GLY 50 N -1.74 -0.09 0.00 0.00 0.00 0.04 -0.60 107.32 104.93 2fjf s GLY 50 Ca -0.07 0.34 0.08 0.00 0.00 0.00 0.00 44.72 45.07 2fjf s GLY 50 CO 0.02 0.28 -0.25 -1.50 0.00 0.00 0.00 173.10 171.65 2fjf s ILE 51 N -0.01 2.00 0.63 0.90 2.07 -0.49 -0.84 121.20 125.46 2fjf s ILE 51 Ca -0.01 -1.17 -0.10 0.00 -1.41 0.00 0.00 60.65 57.97 2fjf s ILE 51 Cb -0.01 -1.68 -0.01 0.00 0.13 0.00 0.00 42.46 40.89 2fjf s ILE 51 CO 0.00 0.48 1.00 -0.89 -1.91 0.00 0.00 174.94 173.63 2fjf s THR 52 N -0.66 4.17 0.41 4.00 2.01 -0.29 -1.98 115.64 123.30 2fjf s THR 52 Ca 0.10 0.54 -0.25 0.00 0.31 0.00 0.00 61.69 62.39 2fjf s THR 52 Cb -0.10 -3.68 -0.10 0.00 0.01 0.00 0.00 72.50 68.63 2fjf s THR 52 CO 0.00 -0.84 1.16 -2.65 -0.69 0.00 0.00 174.62 171.60 2fjf n PRO 53 N -2.75 1.68 -0.69 4.92 -0.02 -1.25 -2.03 135.00 134.85 2fjf n PRO 53 Ca 0.05 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2fjf n PRO 53 Cb 0.56 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.29 0.00 -2.36 3.55 0.00 0.67 -2.75 120.51 119.34 2fjf n ALA 54 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 2fjf n ALA 54 Cb 0.39 -0.63 0.01 0.00 0.00 0.00 0.00 19.45 19.21 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 -1.99 0.29 0.23 0.00 0.00 -0.86 -4.97 105.19 97.89 2fjf n GLY 55 Ca 0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.27 0.78 -2.27 -0.02 0.00 -1.67 -3.48 103.07 96.15 2fjf h GLY 56 Ca -0.14 -0.90 -0.00 0.00 0.00 0.00 0.00 47.33 46.28 2fjf h GLY 56 CO 0.16 0.81 0.05 -0.47 0.00 0.00 0.00 176.54 177.08 2fjf s TYR 57 N -4.07 0.03 -0.08 5.60 5.04 -1.26 -5.01 117.35 117.59 2fjf s TYR 57 Ca -0.09 -0.42 -0.06 0.00 -2.44 0.00 0.00 57.07 54.07 2fjf s TYR 57 Cb 0.11 0.43 0.03 0.00 0.35 0.00 0.00 41.96 42.88 2fjf s TYR 57 CO 0.86 -1.06 0.21 -0.08 -1.34 0.00 0.00 175.55 174.15 2fjf s THR 58 N -3.94 -0.02 0.03 4.34 -1.32 -1.26 -1.13 115.64 112.33 2fjf s THR 58 Ca 0.15 0.09 0.03 0.00 -1.21 0.00 0.00 61.69 60.74 2fjf s THR 58 Cb -0.03 -0.31 -0.02 0.00 -1.51 0.00 0.00 72.50 70.63 2fjf s THR 58 CO 0.05 0.04 -0.09 -0.31 -2.21 0.00 0.00 174.62 172.09 2fjf s TYR 59 N 0.73 0.78 0.02 9.09 1.51 -0.02 -5.00 117.35 124.46 2fjf s TYR 59 Ca -0.05 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.67 2fjf s TYR 59 Cb -0.07 -0.47 -0.02 0.00 -0.11 0.00 0.00 41.96 41.30 2fjf s TYR 59 CO -0.04 -0.03 -0.07 0.71 -1.11 0.00 0.00 175.55 175.01 2fjf s TYR 60 N -0.94 0.60 0.59 2.71 1.51 -1.26 -0.78 117.35 119.78 2fjf s TYR 60 Ca -0.04 -0.32 -0.19 0.00 -1.01 0.00 0.00 57.07 55.51 2fjf s TYR 60 Cb -0.08 -0.37 -0.04 0.00 -0.11 0.00 0.00 41.96 41.37 2fjf s TYR 60 CO 0.01 -0.05 1.21 0.00 -1.11 0.00 0.00 175.55 175.61 2fjf s ALA 61 N -0.83 2.55 0.47 3.71 0.00 0.24 -4.79 121.76 123.11 2fjf s ALA 61 Ca -0.05 1.02 0.32 0.00 0.00 0.00 0.00 51.96 53.25 2fjf s ALA 61 Cb -0.07 -3.45 1.73 0.00 0.00 0.00 0.00 23.12 21.33 2fjf s ALA 61 CO 0.00 -1.17 2.17 -0.44 0.00 0.00 0.00 175.76 176.32 2fjf h ASP 62 N 0.90 0.00 0.35 0.00 3.45 -1.95 -0.33 116.42 118.84 2fjf h ASP 62 Ca -0.50 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.96 2fjf h ASP 62 Cb 1.30 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.07 2fjf h ASP 62 CO 0.55 0.06 0.00 -1.54 -1.57 0.00 0.00 179.24 176.74 2fjf n SER 63 N -3.51 0.00 0.00 6.45 3.41 -1.26 -3.79 113.62 114.92 2fjf n SER 63 Ca -0.02 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 2fjf n SER 63 Cb 0.18 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 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 -1.21 0.00 -1.67 -3.33 0.31 -0.81 -5.04 118.33 106.60 2fjf n VAL 64 Ca 0.15 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 64.02 2fjf n VAL 64 Cb 0.18 0.05 -0.03 0.00 -0.91 0.00 0.00 33.84 33.12 2fjf n VAL 64 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2fjf n LYS 65 N -0.16 2.01 -0.53 5.55 4.81 -0.20 -1.67 118.16 127.96 2fjf n LYS 65 Ca 0.00 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.16 2fjf n LYS 65 Cb 0.00 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 32.66 2fjf n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fjf n GLY 66 N 2.38 1.72 0.02 3.14 0.00 -1.26 -4.77 105.19 106.42 2fjf n GLY 66 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 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 1.67 -4.24 1.61 1.74 -0.67 -5.05 116.66 109.72 2fjf n ARG 67 Ca 0.00 0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.79 2fjf n ARG 67 Cb 0.00 -1.11 -0.09 0.00 -1.02 0.00 0.00 32.46 30.24 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 -2.10 2.88 -0.06 -1.55 0.40 -0.87 -1.31 117.98 115.37 2fjf s PHE 68 Ca -0.05 -0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.26 2fjf s PHE 68 Cb 0.02 -1.52 -0.00 0.00 0.51 0.00 0.00 43.02 42.02 2fjf s PHE 68 CO 0.15 0.44 -0.20 0.99 0.70 0.00 0.00 175.22 177.30 2fjf s THR 69 N -1.20 1.66 -0.16 0.64 2.01 0.18 -4.89 115.64 113.87 2fjf s THR 69 Ca 0.22 -0.83 -0.06 0.00 0.31 0.00 0.00 61.69 61.33 2fjf s THR 69 Cb -0.11 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2fjf s THR 69 CO 0.14 0.47 0.04 -0.51 -0.69 0.00 0.00 174.62 174.07 2fjf s ILE 70 N 0.06 4.61 0.00 1.82 2.07 -1.26 -0.02 121.20 128.47 2fjf s ILE 70 Ca -0.06 -0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.07 2fjf s ILE 70 Cb -0.13 -3.04 0.00 0.00 0.13 0.00 0.00 42.46 39.42 2fjf s ILE 70 CO 0.03 0.50 0.00 -1.54 -1.91 0.00 0.00 174.94 172.03 2fjf n SER 71 N 3.18 0.00 -3.45 4.50 3.41 -0.87 -4.97 113.62 115.42 2fjf n SER 71 Ca -0.17 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.31 2fjf n SER 71 Cb 0.53 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 2fjf n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fjf s ALA 72 N -1.24 -1.66 -0.29 7.33 0.00 -1.26 0.37 121.76 124.99 2fjf s ALA 72 Ca 0.00 0.71 0.02 0.00 0.00 0.00 0.00 51.96 52.69 2fjf s ALA 72 Cb 0.00 0.66 0.07 0.00 0.00 0.00 0.00 23.12 23.85 2fjf s ALA 72 CO 0.00 -0.69 -0.04 0.34 0.00 0.00 0.00 175.76 175.37 2fjf s ASP 73 N -2.46 4.63 0.34 0.00 -1.08 -0.01 -4.97 116.67 113.13 2fjf s ASP 73 Ca -0.00 -1.62 0.07 0.00 -0.52 0.00 0.00 52.55 50.48 2fjf s ASP 73 Cb -0.01 -1.60 0.62 0.00 -1.46 0.00 0.00 42.92 40.47 2fjf s ASP 73 CO -0.09 -0.27 1.82 0.71 0.52 0.00 0.00 175.17 177.86 2fjf h THR 74 N 6.67 1.23 0.00 1.71 1.35 -1.96 -1.06 112.91 120.85 2fjf h THR 74 Ca -0.15 -1.08 -0.01 0.00 -0.55 0.00 0.00 66.41 64.62 2fjf h THR 74 Cb 1.04 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2fjf h THR 74 CO 0.50 0.33 -0.05 0.77 -0.25 0.00 0.00 175.52 176.81 2fjf h SER 75 N 0.26 0.00 -0.02 5.36 4.64 -1.95 -0.84 113.55 120.99 2fjf h SER 75 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2fjf h SER 75 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2fjf h SER 75 CO 0.04 0.05 -0.21 0.29 -0.87 0.00 0.00 176.83 176.13 2fjf n LYS 76 N -3.31 1.80 -4.25 4.77 4.01 -0.50 -4.97 118.16 115.72 2fjf n LYS 76 Ca -0.01 -1.49 -0.36 0.00 -0.51 0.00 0.00 58.31 55.94 2fjf n LYS 76 Cb 0.22 -1.46 -0.04 0.00 -0.51 0.00 0.00 35.03 33.24 2fjf n LYS 76 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2fjf n ASN 77 N 0.71 -2.50 -3.92 4.39 4.05 -0.32 -4.82 115.26 112.85 2fjf n ASN 77 Ca 0.12 -1.06 -0.19 0.00 0.45 0.00 0.00 54.58 53.89 2fjf n ASN 77 Cb 0.53 -2.55 -0.16 0.00 1.23 0.00 0.00 39.78 38.83 2fjf n ASN 77 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 2fjf s THR 78 N -3.42 0.56 0.32 -0.44 2.01 -1.07 -1.64 115.64 111.95 2fjf s THR 78 Ca 0.63 -0.17 0.01 0.00 0.31 0.00 0.00 61.69 62.46 2fjf s THR 78 Cb -0.35 -0.56 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 2fjf s THR 78 CO 0.94 0.21 0.51 0.00 -0.69 0.00 0.00 174.62 175.59 2fjf s ALA 79 N 0.66 3.74 0.03 7.40 0.00 -0.40 -0.83 121.76 132.36 2fjf s ALA 79 Ca -0.09 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2fjf s ALA 79 Cb -0.12 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 2fjf s ALA 79 CO 0.00 0.07 -0.06 0.71 0.00 0.00 0.00 175.76 176.48 2fjf s TYR 80 N -2.22 0.55 -0.26 0.00 2.02 0.16 0.01 117.35 117.61 2fjf s TYR 80 Ca 0.39 -0.41 0.02 0.00 -0.37 0.00 0.00 57.07 56.70 2fjf s TYR 80 Cb -0.10 -0.34 0.06 0.00 -0.40 0.00 0.00 41.96 41.18 2fjf s TYR 80 CO 0.34 -0.08 -0.10 -1.17 -1.57 0.00 0.00 175.55 172.97 2fjf s LEU 81 N -1.25 3.44 -0.24 -1.29 2.96 -0.35 -2.05 118.68 119.90 2fjf s LEU 81 Ca -0.08 -1.36 -0.18 0.00 -0.22 0.00 0.00 54.13 52.29 2fjf s LEU 81 Cb -0.08 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2fjf s LEU 81 CO 0.00 -0.19 0.51 -1.58 -1.32 0.00 0.00 176.35 173.77 2fjf s GLN 82 N 1.12 4.12 -0.32 1.98 2.00 0.96 -1.25 119.66 128.28 2fjf s GLN 82 Ca -0.08 0.35 -0.05 0.00 -2.00 0.00 0.00 55.36 53.58 2fjf s GLN 82 Cb -0.20 -3.61 0.03 0.00 0.80 0.00 0.00 33.01 30.03 2fjf s GLN 82 CO -0.05 -0.26 0.07 -1.64 -0.50 0.00 0.00 175.29 172.90 2fjf s MET 83 N 2.01 2.70 0.34 1.67 -1.94 0.94 -0.65 119.30 124.37 2fjf s MET 83 Ca 0.22 -1.11 0.08 0.00 -1.71 0.00 0.00 55.69 53.17 2fjf s MET 83 Cb -0.15 -3.35 -0.04 0.00 2.01 0.00 0.00 34.83 33.30 2fjf s MET 83 CO 0.09 -0.59 0.19 -0.80 -0.01 0.00 0.00 175.02 173.90 2fjf s ASN 84 N 1.39 4.87 -1.60 3.03 0.01 -0.43 -0.91 114.94 121.30 2fjf s ASN 84 Ca -0.01 -0.68 -0.11 0.00 -0.71 0.00 0.00 52.86 51.34 2fjf s ASN 84 Cb -0.19 -0.81 0.10 0.00 0.41 0.00 0.00 41.25 40.76 2fjf s ASN 84 CO 0.01 -0.31 0.60 -1.20 -1.51 0.00 0.00 177.10 174.69 2fjf n SER 85 N -1.21 -1.94 -4.77 -1.22 7.64 -1.02 -4.65 113.62 106.45 2fjf n SER 85 Ca -0.03 -1.04 -0.39 0.00 1.01 0.00 0.00 58.87 58.42 2fjf n SER 85 Cb 0.61 -2.71 0.01 0.00 -1.01 0.00 0.00 64.21 61.10 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 -7.18 4.14 0.23 -3.43 1.43 -1.04 -4.57 118.68 108.25 2fjf s LEU 86 Ca 0.45 2.76 0.10 0.00 -1.03 0.00 0.00 54.13 56.41 2fjf s LEU 86 Cb -0.24 -3.95 -0.05 0.00 0.03 0.00 0.00 46.19 41.98 2fjf s LEU 86 CO 0.93 -1.04 -0.19 -0.13 0.23 0.00 0.00 176.35 176.15 2fjf s ARG 87 N -2.39 1.50 0.20 1.70 0.52 -1.26 0.42 118.95 119.64 2fjf s ARG 87 Ca 0.60 -1.63 -0.07 0.00 -0.52 0.00 0.00 55.73 54.11 2fjf s ARG 87 Cb -0.40 -1.53 0.32 0.00 0.52 0.00 0.00 34.95 33.86 2fjf s ARG 87 CO 0.51 0.29 1.17 0.00 0.02 0.00 0.00 175.30 177.29 2fjf n ALA 88 N -0.29 0.14 0.89 2.13 0.00 -1.26 0.08 120.51 122.21 2fjf n ALA 88 Ca -0.08 0.81 0.07 0.00 0.00 0.00 0.00 53.44 54.24 2fjf n ALA 88 Cb 0.59 -0.47 0.43 0.00 0.00 0.00 0.00 19.45 20.00 2fjf n ALA 88 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2fjf n GLU 89 N -5.20 0.44 0.00 0.00 0.00 -1.26 -1.48 120.64 113.13 2fjf n GLU 89 Ca 0.11 0.01 0.13 0.00 0.00 0.00 0.00 57.16 57.42 2fjf n GLU 89 Cb 0.36 -1.50 0.42 0.00 0.00 0.00 0.00 31.44 30.73 2fjf n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2fjf n ASP 90 N -1.03 0.57 -4.65 -1.84 8.00 0.11 -4.86 116.55 112.86 2fjf n ASP 90 Ca 0.11 -0.41 -0.42 0.00 0.71 0.00 0.00 54.79 54.77 2fjf n ASP 90 Cb 0.06 0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 2fjf n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2fjf s THR 91 N -2.73 3.14 0.06 -3.53 2.01 -0.55 -4.90 115.64 109.15 2fjf s THR 91 Ca 0.20 0.17 -0.28 0.00 0.31 0.00 0.00 61.69 62.09 2fjf s THR 91 Cb 0.19 -3.13 0.09 0.00 0.01 0.00 0.00 72.50 69.66 2fjf s THR 91 CO 0.57 -0.03 1.06 0.00 -0.69 0.00 0.00 174.62 175.53 2fjf s ALA 92 N 5.18 -1.87 0.06 7.40 0.00 -1.00 -4.47 121.76 127.06 2fjf s ALA 92 Ca 0.87 0.51 -0.24 0.00 0.00 0.00 0.00 51.96 53.11 2fjf s ALA 92 Cb -0.38 0.48 -0.06 0.00 0.00 0.00 0.00 23.12 23.15 2fjf s ALA 92 CO 0.38 -0.97 0.72 0.08 0.00 0.00 0.00 175.76 175.97 2fjf s VAL 93 N -2.96 4.68 -0.16 0.00 1.01 -0.50 -1.52 120.40 120.96 2fjf s VAL 93 Ca 0.12 1.54 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 2fjf s VAL 93 Cb 0.00 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 2fjf s VAL 93 CO -0.02 0.43 -0.07 -0.31 0.00 0.00 0.00 175.10 175.13 2fjf s TYR 94 N -0.41 2.93 0.02 5.22 1.51 -0.42 0.09 117.35 126.29 2fjf s TYR 94 Ca 0.36 -0.52 0.05 0.00 -1.01 0.00 0.00 57.07 55.95 2fjf s TYR 94 Cb -0.21 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 2fjf s TYR 94 CO 0.22 -0.18 -0.13 0.71 -1.11 0.00 0.00 175.55 175.07 2fjf s TYR 95 N 0.52 2.71 0.09 2.71 1.51 0.16 -2.26 117.35 122.79 2fjf s TYR 95 Ca -0.05 -0.16 0.05 0.00 -1.01 0.00 0.00 57.07 55.89 2fjf s TYR 95 Cb -0.15 -1.54 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 2fjf s TYR 95 CO 0.03 0.29 0.02 0.00 -1.11 0.00 0.00 175.55 174.78 2fjf s ALA 97 N -1.34 -0.75 0.35 0.00 0.00 -0.45 -0.17 121.76 119.39 2fjf s ALA 97 Ca 0.27 0.72 -0.03 0.00 0.00 0.00 0.00 51.96 52.91 2fjf s ALA 97 Cb -0.12 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2fjf s ALA 97 CO 0.19 -0.17 0.60 -0.98 0.00 0.00 0.00 175.76 175.39 2fjf s ARG 98 N -0.21 3.56 -0.14 0.00 1.70 -0.88 -0.94 118.95 122.04 2fjf s ARG 98 Ca -0.03 -0.08 -0.30 0.00 -0.47 0.00 0.00 55.73 54.85 2fjf s ARG 98 Cb -0.03 -2.60 0.10 0.00 -0.57 0.00 0.00 34.95 31.86 2fjf s ARG 98 CO 0.01 0.11 0.88 0.12 -1.08 0.00 0.00 175.30 175.34 2fjf s PHE 99 N -2.29 -0.50 0.04 5.89 5.36 -0.89 -3.98 117.98 121.61 2fjf s PHE 99 Ca 0.43 0.90 -0.15 0.00 -0.96 0.00 0.00 56.93 57.16 2fjf s PHE 99 Cb -0.10 0.42 0.02 0.00 -0.34 0.00 0.00 43.02 43.02 2fjf s PHE 99 CO 0.35 -0.43 0.32 0.54 -1.46 0.00 0.00 175.22 174.55 2fjf s VAL 100 N -0.96 0.08 -1.59 3.12 0.11 -1.26 0.08 120.40 119.98 2fjf s VAL 100 Ca -0.04 -0.63 0.28 0.00 -2.93 0.00 0.00 61.98 58.65 2fjf s VAL 100 Cb -0.01 -0.93 0.58 0.00 -1.53 0.00 0.00 36.38 34.49 2fjf s VAL 100 CO 0.04 -0.35 1.99 0.49 -3.33 0.00 0.00 175.10 173.94 2fjf n PHE 101 N 0.58 0.00 -1.77 1.54 3.01 -1.26 -3.71 117.46 115.85 2fjf n PHE 101 Ca -0.19 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 57.96 2fjf n PHE 101 Cb 0.59 -0.21 0.03 0.00 -0.01 0.00 0.00 39.48 39.89 2fjf n PHE 101 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2fjf s PHE 102 N -2.41 3.10 0.41 1.38 2.99 -1.26 -4.64 117.98 117.54 2fjf s PHE 102 Ca 0.31 1.45 -0.25 0.00 0.00 0.00 0.00 56.93 58.44 2fjf s PHE 102 Cb 0.19 -2.92 -0.10 0.00 0.00 0.00 0.00 43.02 40.19 2fjf s PHE 102 CO 0.40 -1.15 1.19 1.28 -0.00 0.00 0.00 175.22 176.94 2fjf n LEU 103 N -2.70 3.50 -0.65 -0.37 4.77 -1.26 -0.08 117.00 120.22 2fjf n LEU 103 Ca 0.08 1.10 0.03 0.00 -0.03 0.00 0.00 56.01 57.19 2fjf n LEU 103 Cb 0.53 -1.45 0.12 0.00 -2.33 0.00 0.00 43.42 40.30 2fjf n LEU 103 CO 0.53 -0.89 0.55 -0.81 -1.33 0.00 0.00 177.39 175.43 2fjf n PRO 104 N 0.14 1.85 -3.82 3.23 -0.04 -1.26 -4.98 135.00 130.12 2fjf n PRO 104 Ca 0.07 -0.97 -0.25 0.00 -0.04 0.00 0.00 63.50 62.31 2fjf n PRO 104 Cb 0.39 -1.40 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 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 0.23 -0.86 -4.05 0.54 0.18 0.89 -4.93 117.16 109.16 2fjf n TYR 105 Ca 0.09 0.23 -0.10 0.00 1.88 0.00 0.00 57.90 60.00 2fjf n TYR 105 Cb 0.34 -1.82 -0.06 0.00 -0.38 0.00 0.00 39.34 37.41 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 -3.97 0.14 -0.87 -3.48 0.00 -1.26 -4.98 121.76 107.35 2fjf s ALA 106 Ca 0.15 -1.10 -0.19 0.00 0.00 0.00 0.00 51.96 50.81 2fjf s ALA 106 Cb -0.08 1.15 0.13 0.00 0.00 0.00 0.00 23.12 24.32 2fjf s ALA 106 CO 0.65 -0.79 1.06 -1.64 0.00 0.00 0.00 175.76 175.04 2fjf s MET 107 N -4.03 3.50 0.01 0.00 -1.94 -1.26 -4.68 119.30 110.90 2fjf s MET 107 Ca 0.27 -1.65 -0.16 0.00 -1.71 0.00 0.00 55.69 52.43 2fjf s MET 107 Cb 0.01 -4.76 -0.35 0.00 2.01 0.00 0.00 34.83 31.75 2fjf s MET 107 CO 0.10 -1.74 0.95 0.38 -0.01 0.00 0.00 175.02 174.71 2fjf h ASP 108 N 8.90 0.78 -3.47 3.03 3.04 -1.98 -3.45 116.42 123.26 2fjf h ASP 108 Ca 0.07 -0.93 -0.67 0.00 -3.24 0.00 0.00 57.03 52.26 2fjf h ASP 108 Cb 1.04 -0.25 -0.29 0.00 -1.04 0.00 0.00 39.33 38.78 2fjf h ASP 108 CO 1.10 1.68 -0.82 -0.31 -2.04 0.00 0.00 179.24 178.85 2fjf s TYR 109 N -2.57 2.67 0.12 4.15 1.51 -1.26 -5.06 117.35 116.91 2fjf s TYR 109 Ca -0.10 -0.75 0.09 0.00 -1.01 0.00 0.00 57.07 55.30 2fjf s TYR 109 Cb 0.04 -1.75 -0.04 0.00 -0.11 0.00 0.00 41.96 40.10 2fjf s TYR 109 CO 0.92 -0.25 -0.22 -1.58 -1.11 0.00 0.00 175.55 173.31 2fjf s TRP 110 N 0.20 1.94 0.80 2.71 0.52 -1.26 -2.08 118.94 121.77 2fjf s TRP 110 Ca -0.11 -0.41 -0.11 0.00 0.02 0.00 0.00 56.10 55.48 2fjf s TRP 110 Cb -0.16 -1.04 0.07 0.00 -1.15 0.00 0.00 33.47 31.19 2fjf s TRP 110 CO 0.06 0.27 1.10 0.20 0.02 0.00 0.00 176.95 178.60 2fjf s GLY 111 N -2.08 1.62 0.39 0.98 0.00 0.76 -4.33 107.32 104.66 2fjf s GLY 111 Ca 0.10 -0.21 0.27 0.00 0.00 0.00 0.00 44.72 44.87 2fjf s GLY 111 CO 0.05 0.22 1.77 0.06 0.00 0.00 0.00 173.10 175.19 2fjf h GLN 112 N -1.11 0.00 0.00 2.90 -0.00 -1.90 -3.43 115.11 111.58 2fjf h GLN 112 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.18 2fjf h GLN 112 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 2fjf h GLN 112 CO 0.59 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.83 2fjf n GLY 113 N 0.68 2.21 3.08 0.06 0.00 -1.25 -5.01 105.19 104.95 2fjf n GLY 113 Ca 0.03 -1.71 -0.17 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.82 0.77 -0.15 2.61 -4.23 -0.96 -4.91 115.64 106.94 2fjf s THR 114 Ca 0.00 -0.88 -0.29 0.00 -1.18 0.00 0.00 61.69 59.33 2fjf s THR 114 Cb 0.00 -0.74 -0.01 0.00 1.34 0.00 0.00 72.50 73.10 2fjf s THR 114 CO 0.00 -0.12 1.09 -0.22 -0.54 0.00 0.00 174.62 174.83 2fjf s LEU 115 N -1.12 4.19 -0.24 4.79 0.20 -1.26 -1.30 118.68 123.93 2fjf s LEU 115 Ca -0.03 1.54 -0.05 0.00 0.69 0.00 0.00 54.13 56.28 2fjf s LEU 115 Cb -0.08 -3.55 -0.01 0.00 -0.43 0.00 0.00 46.19 42.13 2fjf s LEU 115 CO 0.01 -0.60 -0.00 -0.69 -0.29 0.00 0.00 176.35 174.77 2fjf s VAL 116 N 2.72 3.64 -0.13 1.68 1.01 -0.58 -0.74 120.40 128.00 2fjf s VAL 116 Ca 0.49 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2fjf s VAL 116 Cb -0.18 -2.71 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 2fjf s VAL 116 CO 0.13 0.35 -0.17 0.28 0.00 0.00 0.00 175.10 175.69 2fjf s THR 117 N 1.51 2.58 -0.33 3.92 -1.32 -0.22 -2.37 115.64 119.41 2fjf s THR 117 Ca 0.05 -0.82 -0.06 0.00 -1.21 0.00 0.00 61.69 59.66 2fjf s THR 117 Cb -0.15 -2.06 0.04 0.00 -1.51 0.00 0.00 72.50 68.82 2fjf s THR 117 CO -0.01 0.53 0.10 -0.69 -2.21 0.00 0.00 174.62 172.34 2fjf s VAL 118 N 0.59 3.75 0.10 5.08 1.01 -1.26 -1.27 120.40 128.39 2fjf s VAL 118 Ca -0.10 -1.10 -0.16 0.00 0.00 0.00 0.00 61.98 60.61 2fjf s VAL 118 Cb -0.16 -3.11 0.03 0.00 0.00 0.00 0.00 36.38 33.15 2fjf s VAL 118 CO 0.03 -0.15 0.39 -0.55 0.00 0.00 0.00 175.10 174.83 2fjf s SER 119 N 1.40 -0.23 0.00 3.32 0.15 -0.22 -4.39 113.70 113.73 2fjf s SER 119 Ca -0.01 -0.23 0.25 0.00 0.70 0.00 0.00 55.95 56.66 2fjf s SER 119 Cb -0.19 0.45 0.68 0.00 -1.71 0.00 0.00 66.02 65.25 2fjf s SER 119 CO 0.03 -0.79 1.53 -1.54 1.20 0.00 0.00 173.24 173.68 2fjf n SER 120 N 0.02 2.17 -4.79 5.45 3.41 -1.26 -3.73 113.62 114.88 2fjf n SER 120 Ca -0.17 -1.73 -0.37 0.00 -0.26 0.00 0.00 58.87 56.34 2fjf n SER 120 Cb 0.62 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.93 3.31 0.70 7.33 0.00 -1.26 -5.06 121.76 124.84 2fjf s ALA 121 Ca 0.34 0.38 -0.11 0.00 0.00 0.00 0.00 51.96 52.57 2fjf s ALA 121 Cb 0.20 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 20.31 2fjf s ALA 121 CO 0.31 0.24 1.06 -1.12 0.00 0.00 0.00 175.76 176.26 2fjf s SER 122 N -1.58 5.38 0.36 0.00 0.01 -1.26 -5.01 113.70 111.60 2fjf s SER 122 Ca 0.46 1.59 -0.28 0.00 1.31 0.00 0.00 55.95 59.02 2fjf s SER 122 Cb -0.18 -2.46 -0.11 0.00 0.21 0.00 0.00 66.02 63.47 2fjf s SER 122 CO 0.23 -1.44 1.46 -0.89 0.41 0.00 0.00 173.24 173.01 2fjf s THR 123 N -3.06 2.18 -0.19 1.44 2.01 -1.26 -4.75 115.64 112.01 2fjf s THR 123 Ca 0.58 0.18 -0.09 0.00 0.31 0.00 0.00 61.69 62.67 2fjf s THR 123 Cb -0.14 -3.12 0.07 0.00 0.01 0.00 0.00 72.50 69.32 2fjf s THR 123 CO 0.55 0.04 0.43 -0.75 -0.69 0.00 0.00 174.62 174.20 2fjf s LYS 124 N -1.95 0.39 0.45 4.92 2.20 0.71 -4.93 119.74 121.52 2fjf s LYS 124 Ca 0.53 0.89 -0.13 0.00 -0.36 0.00 0.00 55.97 56.90 2fjf s LYS 124 Cb -0.45 0.10 -0.07 0.00 -1.51 0.00 0.00 37.83 35.89 2fjf s LYS 124 CO 0.60 -0.19 0.86 0.20 -0.36 0.00 0.00 175.35 176.47 2fjf s GLY 125 N 1.79 2.02 0.65 5.54 0.00 -1.26 -0.42 107.32 115.64 2fjf s GLY 125 Ca -0.07 -0.03 -0.13 0.00 0.00 0.00 0.00 44.72 44.49 2fjf s GLY 125 CO -0.13 0.20 1.05 2.56 0.00 0.00 0.00 173.10 176.78 2fjf s PRO 126 N -3.89 3.16 0.04 2.90 0.04 -1.26 -4.63 135.00 131.36 2fjf s PRO 126 Ca 0.55 1.03 -0.13 0.00 0.04 0.00 0.00 61.00 62.49 2fjf s PRO 126 Cb -0.10 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.36 2fjf s PRO 126 CO 0.30 -0.93 0.41 -1.12 0.04 0.00 0.00 177.00 175.70 2fjf s SER 127 N -3.44 6.74 -0.20 6.66 0.01 0.09 -4.92 113.70 118.65 2fjf s SER 127 Ca 0.60 0.89 -0.01 0.00 1.31 0.00 0.00 55.95 58.74 2fjf s SER 127 Cb -0.14 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2fjf s SER 127 CO 0.48 0.25 -0.12 -0.69 0.41 0.00 0.00 173.24 173.57 2fjf s VAL 128 N -1.23 2.75 -0.04 3.43 1.01 -1.26 -0.66 120.40 124.39 2fjf s VAL 128 Ca 0.28 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.62 2fjf s VAL 128 Cb -0.15 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2fjf s VAL 128 CO 0.15 0.48 -0.23 -0.36 0.00 0.00 0.00 175.10 175.14 2fjf s PHE 129 N 1.37 2.17 0.46 5.22 0.08 -0.14 -4.98 117.98 122.16 2fjf s PHE 129 Ca 0.05 -0.54 -0.23 0.00 0.12 0.00 0.00 56.93 56.33 2fjf s PHE 129 Cb -0.14 -1.42 -0.07 0.00 -0.57 0.00 0.00 43.02 40.82 2fjf s PHE 129 CO -0.08 -0.13 1.16 -1.25 -0.10 0.00 0.00 175.22 174.82 2fjf s PRO 130 N -0.31 3.77 -0.49 0.24 0.04 -1.26 0.05 135.00 137.04 2fjf s PRO 130 Ca 0.02 1.75 -0.13 0.00 0.04 0.00 0.00 61.00 62.68 2fjf s PRO 130 Cb -0.11 -2.40 0.11 0.00 0.04 0.00 0.00 34.50 32.13 2fjf s PRO 130 CO 0.01 -0.53 0.40 -0.51 0.04 0.00 0.00 177.00 176.41 2fjf s LEU 131 N -3.02 5.80 0.03 -3.56 1.43 0.28 -4.78 118.68 114.87 2fjf s LEU 131 Ca 0.63 -1.71 -0.30 0.00 -1.03 0.00 0.00 54.13 51.72 2fjf s LEU 131 Cb -0.28 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 2fjf s LEU 131 CO 0.34 -0.73 1.05 0.00 0.23 0.00 0.00 176.35 177.24 2fjf s ALA 132 N 1.51 3.24 0.12 4.21 0.00 -1.26 -2.55 121.76 127.03 2fjf s ALA 132 Ca 0.04 0.65 -0.33 0.00 0.00 0.00 0.00 51.96 52.31 2fjf s ALA 132 Cb -0.27 -3.37 -0.13 0.00 0.00 0.00 0.00 23.12 19.35 2fjf s ALA 132 CO 0.02 -0.28 1.67 -0.35 0.00 0.00 0.00 175.76 176.83 2fjf n PRO 133 N 3.76 2.31 -1.11 0.00 -0.04 -1.26 -4.92 135.00 133.75 2fjf n PRO 133 Ca 0.06 0.84 -0.30 0.00 -0.04 0.00 0.00 63.50 64.06 2fjf n PRO 133 Cb 0.49 -2.64 0.23 0.00 -0.04 0.00 0.00 33.50 31.54 2fjf n PRO 133 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2fjf s SER 134 N 1.65 1.08 1.89 3.54 0.15 -1.26 -4.58 113.70 116.17 2fjf s SER 134 Ca 0.81 0.66 0.00 0.00 0.70 0.00 0.00 55.95 58.12 2fjf s SER 134 Cb -0.64 -0.93 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 2fjf s SER 134 CO 0.39 -4.02 0.00 -1.20 1.20 0.00 0.00 173.24 169.61 2fjf n SER 135 N -4.70 0.00 0.00 5.45 7.64 -1.26 -5.02 113.62 115.73 2fjf n SER 135 Ca 0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2fjf n SER 135 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 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 2.06 3.01 0.23 0.00 -1.26 -5.17 105.19 104.06 2fjf n GLY 141 Ca 0.00 0.35 -0.13 0.00 0.00 0.00 0.00 46.02 46.24 2fjf n GLY 141 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fjf s THR 142 N 0.00 -0.03 0.45 2.61 2.01 -1.26 -3.54 115.64 115.88 2fjf s THR 142 Ca 0.00 0.12 0.05 0.00 0.31 0.00 0.00 61.69 62.17 2fjf s THR 142 Cb 0.00 -0.29 -0.06 0.00 0.01 0.00 0.00 72.50 72.16 2fjf s THR 142 CO 0.00 0.05 0.01 0.00 -0.69 0.00 0.00 174.62 173.99 2fjf s ALA 143 N 0.88 3.51 0.13 7.40 0.00 -0.77 -4.90 121.76 128.01 2fjf s ALA 143 Ca -0.06 -1.62 0.10 0.00 0.00 0.00 0.00 51.96 50.37 2fjf s ALA 143 Cb -0.08 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 2fjf s ALA 143 CO -0.05 -0.09 -0.24 0.00 0.00 0.00 0.00 175.76 175.39 2fjf s ALA 144 N -2.77 2.16 0.29 0.00 0.00 -1.26 -0.48 121.76 119.69 2fjf s ALA 144 Ca 0.25 -1.41 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 2fjf s ALA 144 Cb 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.87 2fjf s ALA 144 CO 0.13 0.44 0.44 -0.48 0.00 0.00 0.00 175.76 176.29 2fjf s LEU 145 N -2.10 0.75 0.00 0.00 0.05 -0.65 -4.10 118.68 112.62 2fjf s LEU 145 Ca 0.12 -1.26 0.00 0.00 0.05 0.00 0.00 54.13 53.04 2fjf s LEU 145 Cb -0.10 1.47 0.00 0.00 -2.05 0.00 0.00 46.19 45.52 2fjf s LEU 145 CO 0.06 -1.19 0.00 0.61 -0.55 0.00 0.00 176.35 175.28 2fjf n GLY 146 N -0.46 -0.70 2.91 -3.48 0.00 -1.06 -0.84 105.19 101.56 2fjf n GLY 146 Ca -0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 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 0.47 3.92 -0.52 0.00 2.96 0.11 -0.64 118.68 124.97 2fjf s LEU 148 Ca -0.05 0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 53.84 2fjf s LEU 148 Cb -0.09 -2.05 0.14 0.00 0.50 0.00 0.00 46.19 44.69 2fjf s LEU 148 CO -0.00 0.04 0.33 -0.69 -1.32 0.00 0.00 176.35 174.71 2fjf s VAL 149 N 1.22 3.61 -0.08 1.68 1.01 0.28 -0.97 120.40 127.15 2fjf s VAL 149 Ca 0.06 -2.44 0.00 0.00 0.00 0.00 0.00 61.98 59.61 2fjf s VAL 149 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2fjf s VAL 149 CO 0.05 -0.79 -0.07 -0.75 0.00 0.00 0.00 175.10 173.55 2fjf s LYS 150 N 0.61 2.92 -0.37 2.72 2.20 0.17 -0.87 119.74 127.11 2fjf s LYS 150 Ca 0.12 -0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 55.17 2fjf s LYS 150 Cb -0.22 -2.64 -0.01 0.00 -1.51 0.00 0.00 37.83 33.45 2fjf s LYS 150 CO -0.04 0.58 0.33 -0.25 -0.36 0.00 0.00 175.35 175.62 2fjf n ASP 151 N 2.48 -4.22 -4.26 1.43 8.00 -0.21 -0.73 116.55 119.03 2fjf n ASP 151 Ca -0.18 -0.15 -0.15 0.00 0.71 0.00 0.00 54.79 55.02 2fjf n ASP 151 Cb 0.53 -2.67 -0.10 0.00 -0.02 0.00 0.00 41.12 38.86 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 -3.07 1.33 -0.27 1.24 1.13 -0.11 -4.17 117.35 113.44 2fjf s TYR 152 Ca 0.08 -0.72 -0.24 0.00 -1.41 0.00 0.00 57.07 54.79 2fjf s TYR 152 Cb -0.01 -0.67 0.08 0.00 -1.10 0.00 0.00 41.96 40.26 2fjf s TYR 152 CO 0.31 0.13 0.74 0.12 -2.51 0.00 0.00 175.55 174.34 2fjf s PHE 153 N -3.21 -0.80 0.00 -3.49 2.19 0.44 -0.87 117.98 112.24 2fjf s PHE 153 Ca 0.17 1.90 0.00 0.00 0.33 0.00 0.00 56.93 59.33 2fjf s PHE 153 Cb 0.02 0.32 0.00 0.00 -1.31 0.00 0.00 43.02 42.05 2fjf s PHE 153 CO 0.02 -0.39 0.00 -0.35 1.83 0.00 0.00 175.22 176.33 2fjf n PRO 154 N 2.86 1.97 -1.34 10.12 -0.04 -1.26 -0.21 135.00 147.10 2fjf n PRO 154 Ca -0.15 0.00 -0.30 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 34.12 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 1.16 1.87 0.49 0.54 0.41 -1.26 -4.81 118.70 117.10 2fjf s GLU 155 Ca 0.00 0.87 0.07 0.00 -0.41 0.00 0.00 54.97 55.50 2fjf s GLU 155 Cb 0.00 -1.87 0.02 0.00 -1.78 0.00 0.00 34.13 30.50 2fjf s GLU 155 CO 0.00 -1.83 0.48 -1.25 -0.49 0.00 0.00 175.26 172.17 2fjf s PRO 156 N -4.99 2.40 -0.01 0.39 0.04 -1.26 -4.88 135.00 126.69 2fjf s PRO 156 Ca 0.62 -1.71 0.06 0.00 0.04 0.00 0.00 61.00 60.01 2fjf s PRO 156 Cb -0.16 -2.36 -0.02 0.00 0.04 0.00 0.00 34.50 32.00 2fjf s PRO 156 CO 0.56 -0.48 -0.20 0.08 0.04 0.00 0.00 177.00 176.99 2fjf s VAL 157 N -2.61 1.59 -0.13 -0.36 1.01 -1.26 -4.36 120.40 114.27 2fjf s VAL 157 Ca 0.46 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 2fjf s VAL 157 Cb -0.04 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2fjf s VAL 157 CO 0.28 0.43 0.08 -0.89 0.00 0.00 0.00 175.10 175.00 2fjf s THR 158 N -0.49 4.95 -0.00 3.92 2.01 -0.72 -4.98 115.64 120.33 2fjf s THR 158 Ca 0.08 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.11 2fjf s THR 158 Cb -0.08 -3.16 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 2fjf s THR 158 CO -0.01 0.57 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.71 2fjf s VAL 159 N -0.60 0.76 0.11 3.82 1.01 -1.26 -1.02 120.40 123.22 2fjf s VAL 159 Ca 0.11 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 2fjf s VAL 159 Cb -0.12 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.61 2fjf s VAL 159 CO 0.02 0.17 0.23 -0.94 0.00 0.00 0.00 175.10 174.58 2fjf s SER 160 N -0.35 0.08 0.08 3.32 1.04 -0.96 -4.97 113.70 111.94 2fjf s SER 160 Ca 0.03 -0.67 0.10 0.00 0.48 0.00 0.00 55.95 55.89 2fjf s SER 160 Cb -0.04 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 2fjf s SER 160 CO -0.00 -0.77 -0.25 0.26 0.98 0.00 0.00 173.24 173.46 2fjf s TRP 161 N -3.88 2.36 -1.36 5.02 0.52 -1.26 0.17 118.94 120.52 2fjf s TRP 161 Ca 0.07 -0.37 -0.04 0.00 0.02 0.00 0.00 56.10 55.78 2fjf s TRP 161 Cb 0.04 -1.34 0.01 0.00 -1.15 0.00 0.00 33.47 31.03 2fjf s TRP 161 CO -0.09 0.24 0.08 0.09 0.02 0.00 0.00 176.95 177.29 2fjf n ASN 162 N 1.33 0.30 -3.75 2.95 4.13 0.29 0.21 115.26 120.71 2fjf n ASN 162 Ca -0.17 -1.16 -0.29 0.00 1.68 0.00 0.00 54.58 54.64 2fjf n ASN 162 Cb 0.52 -1.43 -0.02 0.00 -1.54 0.00 0.00 39.78 37.32 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 -2.48 -3.33 0.00 6.41 7.64 -1.26 -1.42 113.62 119.19 2fjf n SER 163 Ca -0.27 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 58.95 2fjf n SER 163 Cb 0.61 -2.75 0.00 0.00 -1.01 0.00 0.00 64.21 61.06 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 -1.23 0.83 0.46 0.23 0.00 0.13 -4.91 105.19 100.71 2fjf n GLY 164 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2fjf n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fjf n ALA 165 N -0.60 2.51 -3.71 4.61 0.00 -0.51 -4.71 120.51 118.10 2fjf n ALA 165 Ca 0.00 -0.45 -0.17 0.00 0.00 0.00 0.00 53.44 52.81 2fjf n ALA 165 Cb 0.00 -1.08 -0.17 0.00 0.00 0.00 0.00 19.45 18.21 2fjf n ALA 165 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2fjf s LEU 166 N -1.35 0.47 0.00 0.00 2.96 -1.21 -5.00 118.68 114.56 2fjf s LEU 166 Ca 0.26 0.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.29 2fjf s LEU 166 Cb 0.14 -0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.80 2fjf s LEU 166 CO 0.20 -0.20 0.00 0.35 -1.32 0.00 0.00 176.35 175.38 2fjf n THR 167 N 4.84 0.00 -1.60 3.68 -2.24 -1.26 -4.15 114.28 113.54 2fjf n THR 167 Ca -0.14 0.00 -0.49 0.00 -2.27 0.00 0.00 64.05 61.15 2fjf n THR 167 Cb 0.50 -0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 68.02 2fjf n THR 167 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2fjf n SER 168 N -2.45 1.75 -0.01 3.42 2.88 -1.26 -1.92 113.62 116.03 2fjf n SER 168 Ca 0.00 1.13 -0.00 0.00 -1.33 0.00 0.00 58.87 58.67 2fjf n SER 168 Cb 0.17 -1.25 -0.00 0.00 -0.75 0.00 0.00 64.21 62.38 2fjf n SER 168 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2fjf n GLY 169 N 2.31 0.44 3.73 0.46 0.00 -1.26 -4.83 105.19 106.04 2fjf n GLY 169 Ca 0.16 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.88 5.29 -0.27 1.61 1.01 -0.81 -2.99 120.40 122.36 2fjf s VAL 170 Ca 0.00 0.59 0.01 0.00 0.00 0.00 0.00 61.98 62.58 2fjf s VAL 170 Cb 0.00 -3.65 0.08 0.00 0.00 0.00 0.00 36.38 32.81 2fjf s VAL 170 CO 0.00 0.39 0.01 -1.00 0.00 0.00 0.00 175.10 174.50 2fjf s HIS 171 N 0.40 2.51 -0.27 5.22 3.76 0.86 -4.98 115.29 122.78 2fjf s HIS 171 Ca 0.18 -2.01 -0.19 0.00 -0.15 0.00 0.00 55.06 52.89 2fjf s HIS 171 Cb -0.13 -1.90 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 2fjf s HIS 171 CO 0.05 -0.83 0.58 0.99 -0.85 0.00 0.00 174.74 174.67 2fjf s THR 172 N 1.35 5.01 0.37 1.30 2.01 -1.26 -0.97 115.64 123.45 2fjf s THR 172 Ca 0.02 0.95 -0.21 0.00 0.31 0.00 0.00 61.69 62.75 2fjf s THR 172 Cb -0.18 -3.90 -0.10 0.00 0.01 0.00 0.00 72.50 68.32 2fjf s THR 172 CO -0.11 0.02 0.90 -0.36 -0.69 0.00 0.00 174.62 174.37 2fjf s PHE 173 N 2.43 3.43 0.19 4.92 0.40 -0.67 -5.00 117.98 123.68 2fjf s PHE 173 Ca 0.24 1.57 -0.33 0.00 -0.60 0.00 0.00 56.93 57.80 2fjf s PHE 173 Cb -0.15 -2.80 -0.13 0.00 0.51 0.00 0.00 43.02 40.44 2fjf s PHE 173 CO 0.09 0.03 1.58 -2.30 0.70 0.00 0.00 175.22 175.32 2fjf n PRO 174 N -0.22 2.26 -1.37 0.24 -0.02 -1.26 -4.59 135.00 130.04 2fjf n PRO 174 Ca 0.05 0.81 -0.36 0.00 -2.02 0.00 0.00 63.50 61.98 2fjf n PRO 174 Cb 0.53 -2.58 0.07 0.00 -0.02 0.00 0.00 33.50 31.50 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 3.21 -0.75 -3.13 3.55 0.00 -1.26 -4.87 120.51 117.25 2fjf n ALA 175 Ca 0.16 -0.16 -0.28 0.00 0.00 0.00 0.00 53.44 53.15 2fjf n ALA 175 Cb 0.31 -1.99 -0.16 0.00 0.00 0.00 0.00 19.45 17.60 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 -1.80 1.57 -0.53 0.00 0.11 0.48 -4.95 120.40 115.28 2fjf s VAL 176 Ca 0.70 -0.76 -0.28 0.00 -2.93 0.00 0.00 61.98 58.72 2fjf s VAL 176 Cb -0.37 -1.37 0.03 0.00 -1.53 0.00 0.00 36.38 33.15 2fjf s VAL 176 CO 0.53 0.45 1.11 -0.22 -3.33 0.00 0.00 175.10 173.63 2fjf s LEU 177 N 0.28 3.67 0.60 2.54 1.98 -1.26 -1.76 118.68 124.73 2fjf s LEU 177 Ca -0.11 0.17 -0.16 0.00 -2.89 0.00 0.00 54.13 51.14 2fjf s LEU 177 Cb -0.15 -3.26 -0.03 0.00 0.66 0.00 0.00 46.19 43.41 2fjf s LEU 177 CO 0.05 -1.31 1.08 -1.10 -1.89 0.00 0.00 176.35 173.17 2fjf s GLN 178 N 4.49 3.18 0.00 1.98 -0.21 -0.47 -4.88 119.66 123.75 2fjf s GLN 178 Ca 0.42 1.33 0.03 0.00 0.02 0.00 0.00 55.36 57.16 2fjf s GLN 178 Cb -0.08 -2.01 0.15 0.00 1.00 0.00 0.00 33.01 32.07 2fjf s GLN 178 CO 0.27 -0.94 0.52 -1.13 -2.12 0.00 0.00 175.29 171.90 2fjf n SER 179 N -1.99 0.00 0.04 5.90 3.41 -1.26 0.21 113.62 119.92 2fjf n SER 179 Ca 0.10 -0.64 0.12 0.00 -0.26 0.00 0.00 58.87 58.18 2fjf n SER 179 Cb 0.52 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.56 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 -0.61 0.64 0.00 4.04 3.41 -1.26 -4.96 113.62 114.88 2fjf n SER 180 Ca 0.02 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2fjf n SER 180 Cb 0.01 0.53 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 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 1.37 0.34 3.89 5.00 0.00 0.13 -5.07 105.19 110.84 2fjf n GLY 181 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 4.35 0.52 0.99 1.02 -1.25 -4.83 118.68 119.48 2fjf s LEU 182 Ca 0.00 0.55 -0.17 0.00 0.02 0.00 0.00 54.13 54.53 2fjf s LEU 182 Cb 0.00 -2.80 -0.07 0.00 0.02 0.00 0.00 46.19 43.34 2fjf s LEU 182 CO 0.00 0.22 1.00 -0.31 0.02 0.00 0.00 176.35 177.28 2fjf s TYR 183 N -1.37 3.29 -0.00 0.29 2.02 -0.05 -1.37 117.35 120.16 2fjf s TYR 183 Ca 0.30 1.51 -0.08 0.00 -0.37 0.00 0.00 57.07 58.43 2fjf s TYR 183 Cb -0.13 -2.87 0.00 0.00 -0.40 0.00 0.00 41.96 38.56 2fjf s TYR 183 CO 0.18 -0.53 0.15 0.45 -1.57 0.00 0.00 175.55 174.23 2fjf s SER 184 N -2.79 -0.00 0.21 2.29 0.15 -0.72 -0.93 113.70 111.90 2fjf s SER 184 Ca 0.61 -0.15 -0.14 0.00 0.70 0.00 0.00 55.95 56.97 2fjf s SER 184 Cb -0.12 0.22 0.01 0.00 -1.71 0.00 0.00 66.02 64.43 2fjf s SER 184 CO 0.29 -0.35 0.46 -1.48 1.20 0.00 0.00 173.24 173.36 2fjf s LEU 185 N -1.27 0.35 -0.01 3.45 0.05 -0.05 -0.39 118.68 120.81 2fjf s LEU 185 Ca -0.14 -0.74 0.02 0.00 0.05 0.00 0.00 54.13 53.32 2fjf s LEU 185 Cb -0.07 1.82 -0.00 0.00 -2.05 0.00 0.00 46.19 45.89 2fjf s LEU 185 CO 0.02 -1.06 -0.05 -0.94 -0.55 0.00 0.00 176.35 173.76 2fjf s SER 186 N -2.95 0.64 -0.08 1.48 1.04 -1.26 0.99 113.70 113.56 2fjf s SER 186 Ca 0.16 -0.10 0.01 0.00 0.48 0.00 0.00 55.95 56.50 2fjf s SER 186 Cb -0.00 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2fjf s SER 186 CO 0.03 0.06 -0.10 -0.55 0.98 0.00 0.00 173.24 173.65 2fjf s SER 187 N -0.04 4.34 0.05 7.02 0.15 0.19 -1.67 113.70 123.74 2fjf s SER 187 Ca 0.01 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.54 2fjf s SER 187 Cb -0.03 -1.18 -0.03 0.00 -1.71 0.00 0.00 66.02 63.07 2fjf s SER 187 CO -0.00 0.31 -0.07 0.54 1.20 0.00 0.00 173.24 175.22 2fjf s VAL 188 N -0.49 0.50 -0.05 4.45 0.11 -0.15 0.09 120.40 124.87 2fjf s VAL 188 Ca 0.07 -1.24 -0.09 0.00 -2.93 0.00 0.00 61.98 57.79 2fjf s VAL 188 Cb -0.12 -0.79 0.02 0.00 -1.53 0.00 0.00 36.38 33.95 2fjf s VAL 188 CO 0.02 -0.51 0.21 0.54 -3.33 0.00 0.00 175.10 172.03 2fjf s VAL 189 N -1.90 0.04 -0.15 2.04 0.11 -0.02 -0.10 120.40 120.42 2fjf s VAL 189 Ca -0.06 -0.30 -0.07 0.00 -2.93 0.00 0.00 61.98 58.62 2fjf s VAL 189 Cb -0.07 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.34 2fjf s VAL 189 CO -0.01 -0.16 0.10 0.42 -3.33 0.00 0.00 175.10 172.12 2fjf s THR 190 N -0.59 5.19 0.14 5.04 -4.23 -1.16 -1.64 115.64 118.39 2fjf s THR 190 Ca -0.07 0.10 0.05 0.00 -1.18 0.00 0.00 61.69 60.59 2fjf s THR 190 Cb -0.04 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 2fjf s THR 190 CO 0.01 0.55 -0.12 0.68 -0.54 0.00 0.00 174.62 175.20 2fjf s VAL 191 N -0.43 1.24 0.17 2.29 -7.23 0.36 -4.86 120.40 111.95 2fjf s VAL 191 Ca 0.11 -1.93 -0.32 0.00 -1.81 0.00 0.00 61.98 58.03 2fjf s VAL 191 Cb -0.12 -1.72 -0.11 0.00 0.56 0.00 0.00 36.38 34.99 2fjf s VAL 191 CO 0.02 -0.62 1.73 -2.16 -0.31 0.00 0.00 175.10 173.76 2fjf s PRO 192 N -3.32 4.14 0.06 4.82 0.04 -1.26 -1.85 135.00 137.63 2fjf s PRO 192 Ca 0.14 2.57 0.15 0.00 0.04 0.00 0.00 61.00 63.89 2fjf s PRO 192 Cb -0.01 -3.25 0.64 0.00 0.04 0.00 0.00 34.50 31.92 2fjf s PRO 192 CO 0.02 -0.76 1.47 0.43 0.04 0.00 0.00 177.00 178.20 2fjf n SER 193 N 4.53 0.14 0.10 6.66 7.64 -1.23 -2.01 113.62 129.44 2fjf n SER 193 Ca 0.16 0.54 0.01 0.00 1.01 0.00 0.00 58.87 60.59 2fjf n SER 193 Cb 0.37 -0.57 -0.02 0.00 -1.01 0.00 0.00 64.21 62.98 2fjf n SER 193 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2fjf h SER 194 N 0.00 0.00 -0.23 6.43 4.64 -1.90 -3.34 113.55 119.14 2fjf h SER 194 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fjf h SER 194 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2fjf h SER 194 CO 0.00 0.54 0.00 -1.54 -0.87 0.00 0.00 176.83 174.96 2fjf n SER 195 N -3.09 2.85 -4.83 4.97 3.41 -0.85 -4.73 113.62 111.34 2fjf n SER 195 Ca -0.02 -1.90 -0.37 0.00 -0.26 0.00 0.00 58.87 56.31 2fjf n SER 195 Cb 0.78 -0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 2fjf n SER 195 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2fjf s LEU 196 N -1.67 4.41 0.00 1.04 0.20 -1.20 -2.14 118.68 119.32 2fjf s LEU 196 Ca 0.35 0.73 0.00 0.00 0.69 0.00 0.00 54.13 55.90 2fjf s LEU 196 Cb 0.21 -2.38 0.00 0.00 -0.43 0.00 0.00 46.19 43.59 2fjf s LEU 196 CO 0.30 0.32 0.00 0.61 -0.29 0.00 0.00 176.35 177.29 2fjf n GLY 197 N 2.13 0.58 0.00 7.98 0.00 -1.26 -4.74 105.19 109.87 2fjf n GLY 197 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2fjf n GLY 197 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fjf n THR 198 N -2.65 0.00 -3.77 2.61 -2.24 -1.24 -5.06 114.28 101.93 2fjf n THR 198 Ca 0.00 -0.12 -0.13 0.00 -2.27 0.00 0.00 64.05 61.53 2fjf n THR 198 Cb 0.04 1.40 -0.13 0.00 -2.10 0.00 0.00 70.33 69.53 2fjf n THR 198 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2fjf s GLN 199 N -0.11 0.19 0.06 -0.78 -0.44 -0.91 -5.06 119.66 112.60 2fjf s GLN 199 Ca 0.00 0.38 -0.23 0.00 -2.50 0.00 0.00 55.36 53.01 2fjf s GLN 199 Cb 0.00 -0.03 -0.06 0.00 -1.64 0.00 0.00 33.01 31.27 2fjf s GLN 199 CO 0.00 -0.10 0.71 0.95 0.50 0.00 0.00 175.29 177.34 2fjf s THR 200 N 0.74 4.69 -0.27 -0.34 -4.23 -1.26 -4.77 115.64 110.20 2fjf s THR 200 Ca -0.05 1.51 0.03 0.00 -1.18 0.00 0.00 61.69 62.00 2fjf s THR 200 Cb -0.07 -4.05 0.07 0.00 1.34 0.00 0.00 72.50 69.79 2fjf s THR 200 CO -0.04 0.44 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.08 2fjf s TYR 201 N -0.46 3.34 -0.17 3.99 2.02 -1.26 -4.95 117.35 119.86 2fjf s TYR 201 Ca 0.35 -2.41 -0.02 0.00 -0.37 0.00 0.00 57.07 54.62 2fjf s TYR 201 Cb -0.20 -2.07 -0.02 0.00 -0.40 0.00 0.00 41.96 39.27 2fjf s TYR 201 CO 0.22 -0.89 -0.08 0.96 -1.57 0.00 0.00 175.55 174.19 2fjf s ILE 202 N 1.08 3.35 0.01 2.71 -4.36 -1.25 -0.54 121.20 122.20 2fjf s ILE 202 Ca -0.06 -0.53 -0.16 0.00 -0.26 0.00 0.00 60.65 59.64 2fjf s ILE 202 Cb -0.20 -2.47 -0.06 0.00 1.25 0.00 0.00 42.46 40.99 2fjf s ILE 202 CO -0.05 0.48 0.44 0.00 0.24 0.00 0.00 174.94 176.05 2fjf s ASN 204 N -1.05 5.24 -0.05 0.00 -0.87 0.46 -1.58 114.94 117.09 2fjf s ASN 204 Ca 0.25 -2.39 -0.20 0.00 -1.57 0.00 0.00 52.86 48.95 2fjf s ASN 204 Cb -0.17 -1.84 -0.05 0.00 -0.02 0.00 0.00 41.25 39.17 2fjf s ASN 204 CO 0.14 -0.47 0.58 -0.69 -2.57 0.00 0.00 177.10 174.09 2fjf s VAL 205 N 0.62 5.02 -0.06 1.60 1.01 -0.07 -2.26 120.40 126.27 2fjf s VAL 205 Ca 0.12 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.33 2fjf s VAL 205 Cb -0.22 -3.91 -0.00 0.00 0.00 0.00 0.00 36.38 32.25 2fjf s VAL 205 CO -0.04 0.36 -0.20 0.20 0.00 0.00 0.00 175.10 175.43 2fjf s ASN 206 N 0.23 2.52 -0.43 3.32 0.01 -0.19 -1.82 114.94 118.58 2fjf s ASN 206 Ca 0.31 -0.43 0.02 0.00 -0.71 0.00 0.00 52.86 52.05 2fjf s ASN 206 Cb -0.17 -0.88 0.13 0.00 0.41 0.00 0.00 41.25 40.74 2fjf s ASN 206 CO 0.15 0.16 0.22 -2.28 -1.51 0.00 0.00 177.10 173.84 2fjf s HIS 207 N 0.16 2.13 0.15 2.20 5.65 0.14 -1.76 115.29 123.97 2fjf s HIS 207 Ca -0.09 -2.46 -0.16 0.00 0.25 0.00 0.00 55.06 52.60 2fjf s HIS 207 Cb -0.14 -2.00 0.02 0.00 -1.18 0.00 0.00 32.58 29.27 2fjf s HIS 207 CO 0.04 -0.79 1.80 0.87 -0.65 0.00 0.00 174.74 176.01 2fjf h LYS 208 N 6.85 0.46 -0.94 2.88 1.79 -1.80 -1.22 116.57 124.60 2fjf h LYS 208 Ca -0.03 -0.03 0.24 0.00 -2.18 0.00 0.00 60.65 58.66 2fjf h LYS 208 Cb 0.93 -0.10 -0.06 0.00 -1.58 0.00 0.00 32.23 31.42 2fjf h LYS 208 CO 0.50 0.31 0.64 -1.35 -1.08 0.00 0.00 179.45 178.47 2fjf h PRO 209 N 0.48 0.23 -0.41 3.15 0.11 -1.90 -0.16 132.00 133.50 2fjf h PRO 209 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2fjf h PRO 209 Cb -0.02 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.04 2fjf h PRO 209 CO -0.05 0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 176.76 2fjf n SER 210 N -4.42 3.10 -3.97 -2.05 3.41 -0.96 -4.97 113.62 103.75 2fjf n SER 210 Ca 0.20 -1.96 -0.31 0.00 -0.26 0.00 0.00 58.87 56.54 2fjf n SER 210 Cb 0.86 -0.27 0.02 0.00 -0.26 0.00 0.00 64.21 64.56 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 0.81 -4.61 -4.51 4.04 5.15 -0.07 -4.85 115.26 111.22 2fjf n ASN 211 Ca 0.14 -0.82 -0.35 0.00 -0.60 0.00 0.00 54.58 52.96 2fjf n ASN 211 Cb 0.47 -3.69 -0.12 0.00 -0.53 0.00 0.00 39.78 35.91 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 -3.29 4.31 -0.23 -0.44 2.01 -0.53 -4.99 115.64 112.47 2fjf s THR 212 Ca 0.69 -0.19 -0.01 0.00 0.31 0.00 0.00 61.69 62.48 2fjf s THR 212 Cb -0.35 -2.96 0.07 0.00 0.01 0.00 0.00 72.50 69.27 2fjf s THR 212 CO 0.84 0.41 0.03 -0.75 -0.69 0.00 0.00 174.62 174.47 2fjf s LYS 213 N 0.94 0.89 -0.11 4.92 2.20 -1.26 0.27 119.74 127.59 2fjf s LYS 213 Ca 0.03 -0.73 -0.01 0.00 -0.36 0.00 0.00 55.97 54.90 2fjf s LYS 213 Cb -0.14 -2.20 -0.02 0.00 -1.51 0.00 0.00 37.83 33.96 2fjf s LYS 213 CO 0.02 -0.72 -0.08 0.08 -0.36 0.00 0.00 175.35 174.29 2fjf s VAL 214 N 1.69 3.56 -0.10 4.02 1.01 -0.76 -5.01 120.40 124.81 2fjf s VAL 214 Ca 0.01 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2fjf s VAL 214 Cb -0.18 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2fjf s VAL 214 CO -0.12 0.54 -0.05 -1.81 0.00 0.00 0.00 175.10 173.66 2fjf s ASP 215 N -0.08 4.79 -0.07 3.32 1.01 -1.26 -0.89 116.67 123.49 2fjf s ASP 215 Ca 0.00 -0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.25 2fjf s ASP 215 Cb -0.13 -1.42 0.02 0.00 1.01 0.00 0.00 42.92 42.40 2fjf s ASP 215 CO 0.03 0.31 -0.08 -0.75 0.21 0.00 0.00 175.17 174.88 2fjf s LYS 216 N -0.46 1.39 -0.55 8.23 2.47 -0.61 -4.96 119.74 125.24 2fjf s LYS 216 Ca 0.07 -0.27 -0.26 0.00 -1.56 0.00 0.00 55.97 53.95 2fjf s LYS 216 Cb -0.12 -1.29 0.03 0.00 -1.46 0.00 0.00 37.83 34.99 2fjf s LYS 216 CO 0.02 -0.09 1.05 0.21 0.16 0.00 0.00 175.35 176.70 2fjf s LYS 217 N 1.06 3.44 -0.32 4.03 2.20 -1.26 -1.89 119.74 127.00 2fjf s LYS 217 Ca -0.08 0.02 -0.21 0.00 -0.36 0.00 0.00 55.97 55.35 2fjf s LYS 217 Cb -0.14 -4.02 -0.00 0.00 -1.51 0.00 0.00 37.83 32.15 2fjf s LYS 217 CO -0.01 -1.54 0.66 0.08 -0.36 0.00 0.00 175.35 174.19 2fjf s VAL 218 N 4.37 4.89 0.13 4.02 1.01 0.30 -4.97 120.40 130.15 2fjf s VAL 218 Ca 0.37 0.84 0.02 0.00 0.00 0.00 0.00 61.98 63.20 2fjf s VAL 218 Cb -0.10 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2fjf s VAL 218 CO 0.23 -0.21 -0.03 -1.83 0.00 0.00 0.00 175.10 173.25 2fjf s GLU 219 N 2.71 0.96 1.07 2.72 -1.05 -1.26 -4.35 118.70 119.49 2fjf s GLU 219 Ca 0.26 -1.42 -0.12 0.00 -0.15 0.00 0.00 54.97 53.54 2fjf s GLU 219 Cb -0.15 -0.22 0.23 0.00 -0.44 0.00 0.00 34.13 33.56 2fjf s GLU 219 CO 0.13 -0.07 1.07 -2.14 0.95 0.00 0.00 175.26 175.20 2fjf s PRO 220 N -3.88 -0.20 0.73 -4.83 0.02 -1.26 -4.62 135.00 120.97 2fjf s PRO 220 Ca 0.18 1.10 -0.04 0.00 0.02 0.00 0.00 61.00 62.25 2fjf s PRO 220 Cb 0.06 -1.62 0.15 0.00 0.02 0.00 0.00 34.50 33.11 2fjf s PRO 220 CO -0.01 -3.32 1.00 1.17 -0.33 0.00 0.00 177.00 175.52 2fjf n LYS 221 N -4.66 -0.38 0.08 5.54 0.00 -1.26 -5.01 118.16 112.46 2fjf n LYS 221 Ca 0.06 -2.33 -0.21 0.00 0.00 0.00 0.00 58.31 55.83 2fjf n LYS 221 Cb 0.53 -0.79 -0.15 0.00 0.00 0.00 0.00 35.03 34.62 2fjf n LYS 221 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 2fjf h SER 222 N -0.85 0.60 0.00 3.14 0.02 -2.00 -3.53 113.55 110.93 2fjf h SER 222 Ca -0.33 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 59.69 2fjf h SER 222 Cb 1.11 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2fjf h SER 222 CO 0.31 1.49 0.00 0.00 -1.14 0.00 0.00 176.83 177.49