#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 2.78 -0.08 6.31 1.01 -1.26 -4.23 120.40 124.93 2fjf s VAL 2 Ca 0.00 0.35 -0.26 0.00 0.00 0.00 0.00 61.98 62.07 2fjf s VAL 2 Cb 0.00 -3.23 0.06 0.00 0.00 0.00 0.00 36.38 33.21 2fjf s VAL 2 CO 0.00 0.01 0.60 0.00 0.00 0.00 0.00 175.10 175.70 2fjf s GLN 3 N 2.26 0.92 -0.23 2.72 -2.07 -0.87 -4.99 119.66 117.41 2fjf s GLN 3 Ca 0.75 0.28 -0.07 0.00 -1.82 0.00 0.00 55.36 54.50 2fjf s GLN 3 Cb -0.43 0.43 -0.03 0.00 -1.09 0.00 0.00 33.01 31.89 2fjf s GLN 3 CO 0.33 -0.26 0.07 -0.51 -1.32 0.00 0.00 175.29 173.60 2fjf s LEU 4 N -0.93 3.56 -0.22 2.60 2.01 -1.26 -2.02 118.68 122.41 2fjf s LEU 4 Ca -0.09 -0.11 -0.01 0.00 0.01 0.00 0.00 54.13 53.93 2fjf s LEU 4 Cb -0.02 -1.93 0.02 0.00 0.01 0.00 0.00 46.19 44.27 2fjf s LEU 4 CO 0.07 0.04 -0.11 -0.69 1.01 0.00 0.00 176.35 176.67 2fjf s VAL 5 N 1.19 2.58 0.28 -1.59 1.01 -0.63 -4.12 120.40 119.12 2fjf s VAL 5 Ca 0.04 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 2fjf s VAL 5 Cb -0.14 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 2fjf s VAL 5 CO 0.03 0.33 0.51 -1.61 0.00 0.00 0.00 175.10 174.37 2fjf s GLU 6 N 1.31 3.58 0.36 2.72 2.02 -1.26 -1.49 118.70 125.94 2fjf s GLU 6 Ca 0.02 -0.13 -0.07 0.00 0.02 0.00 0.00 54.97 54.81 2fjf s GLU 6 Cb -0.15 -2.70 0.02 0.00 0.10 0.00 0.00 34.13 31.40 2fjf s GLU 6 CO -0.07 0.25 0.58 -1.54 0.02 0.00 0.00 175.26 174.50 2fjf s SER 7 N -3.30 0.59 0.00 -0.19 1.04 -1.03 -4.94 113.70 105.87 2fjf s SER 7 Ca 0.42 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.49 2fjf s SER 7 Cb -0.11 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.74 2fjf s SER 7 CO 0.31 -1.43 0.00 0.61 0.98 0.00 0.00 173.24 173.71 2fjf n GLY 8 N -0.55 1.91 3.73 7.32 0.00 -1.26 -1.34 105.19 115.00 2fjf n GLY 8 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.24 2.09 0.00 -0.02 0.00 -1.26 -4.52 107.32 101.37 2fjf s GLY 9 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.37 2fjf s GLY 9 CO 0.00 1.04 0.00 0.61 0.00 0.00 0.00 173.10 174.75 2fjf n GLY 10 N -0.12 -1.22 3.51 0.20 0.00 -0.30 -4.89 105.19 102.38 2fjf n GLY 10 Ca 0.12 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.90 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 3.65 0.22 0.99 0.20 -1.26 -1.50 118.68 120.98 2fjf s LEU 11 Ca 0.00 -0.11 0.05 0.00 0.69 0.00 0.00 54.13 54.75 2fjf s LEU 11 Cb 0.00 -1.98 -0.05 0.00 -0.43 0.00 0.00 46.19 43.73 2fjf s LEU 11 CO 0.00 -0.01 -0.05 0.68 -0.29 0.00 0.00 176.35 176.69 2fjf s VAL 12 N 1.47 1.24 0.62 1.68 -7.23 -0.84 -5.01 120.40 112.33 2fjf s VAL 12 Ca 0.06 -2.07 -0.14 0.00 -1.81 0.00 0.00 61.98 58.01 2fjf s VAL 12 Cb -0.15 -2.24 -0.03 0.00 0.56 0.00 0.00 36.38 34.52 2fjf s VAL 12 CO 0.05 -0.43 1.05 -1.10 -0.31 0.00 0.00 175.10 174.37 2fjf s GLN 13 N -3.79 3.26 0.30 4.82 -1.52 -1.24 -1.44 119.66 120.04 2fjf s GLN 13 Ca 0.26 1.12 -0.30 0.00 -1.95 0.00 0.00 55.36 54.49 2fjf s GLN 13 Cb 0.04 -2.03 -0.11 0.00 -0.22 0.00 0.00 33.01 30.69 2fjf s GLN 13 CO 0.08 -0.85 1.57 -2.14 -0.25 0.00 0.00 175.29 173.69 2fjf s PRO 14 N -4.33 4.13 0.00 2.91 0.02 -1.26 -1.18 135.00 135.29 2fjf s PRO 14 Ca 0.62 2.56 0.00 0.00 0.02 0.00 0.00 61.00 64.20 2fjf s PRO 14 Cb -0.15 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.35 2fjf s PRO 14 CO 0.41 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.88 2fjf n GLY 15 N 1.97 1.08 0.00 0.52 0.00 0.48 -4.89 105.19 104.35 2fjf n GLY 15 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.82 2.94 -0.02 0.00 -0.32 -4.18 105.19 100.79 2fjf n GLY 16 Ca 0.00 -1.69 -0.11 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.00 0.08 0.06 1.61 0.01 -1.26 -2.09 113.70 111.11 2fjf s SER 17 Ca 0.00 -0.18 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 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 -0.14 0.13 -0.76 0.41 0.00 0.00 173.24 172.88 2fjf s LEU 18 N -0.64 1.67 -0.12 2.44 1.43 -0.47 -4.98 118.68 118.01 2fjf s LEU 18 Ca -0.07 -0.62 -0.01 0.00 -1.03 0.00 0.00 54.13 52.41 2fjf s LEU 18 Cb -0.04 0.78 0.03 0.00 0.03 0.00 0.00 46.19 46.99 2fjf s LEU 18 CO -0.00 -0.62 -0.05 -0.60 0.23 0.00 0.00 176.35 175.31 2fjf s ARG 19 N -3.28 1.26 0.01 1.70 3.52 -1.26 -0.39 118.95 120.52 2fjf s ARG 19 Ca 0.01 -0.24 -0.10 0.00 -0.13 0.00 0.00 55.73 55.27 2fjf s ARG 19 Cb 0.03 -1.57 -0.05 0.00 -1.56 0.00 0.00 34.95 31.80 2fjf s ARG 19 CO -0.08 -0.33 0.33 -0.51 -0.81 0.00 0.00 175.30 173.91 2fjf s LEU 20 N 1.76 4.40 0.16 -0.88 1.02 -0.48 -4.49 118.68 120.16 2fjf s LEU 20 Ca 0.04 0.74 0.11 0.00 0.02 0.00 0.00 54.13 55.03 2fjf s LEU 20 Cb -0.13 -2.67 -0.04 0.00 0.02 0.00 0.00 46.19 43.36 2fjf s LEU 20 CO -0.07 0.27 -0.24 -0.44 0.02 0.00 0.00 176.35 175.88 2fjf s SER 21 N -1.46 3.45 -0.32 2.29 0.01 -0.45 -1.71 113.70 115.50 2fjf s SER 21 Ca 0.27 -0.78 -0.01 0.00 1.31 0.00 0.00 55.95 56.73 2fjf s SER 21 Cb -0.14 -0.28 0.13 0.00 0.21 0.00 0.00 66.02 65.93 2fjf s SER 21 CO 0.14 0.15 0.21 0.00 0.41 0.00 0.00 173.24 174.15 2fjf s ALA 23 N 1.63 3.45 0.30 0.00 0.00 -0.56 -0.56 121.76 126.02 2fjf s ALA 23 Ca 0.14 -0.78 -0.15 0.00 0.00 0.00 0.00 51.96 51.17 2fjf s ALA 23 Cb -0.19 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 2fjf s ALA 23 CO -0.17 -1.39 0.71 0.00 0.00 0.00 0.00 175.76 174.91 2fjf s ALA 24 N 2.84 3.36 0.06 0.00 0.00 -0.45 -1.60 121.76 125.97 2fjf s ALA 24 Ca 0.27 0.02 -0.09 0.00 0.00 0.00 0.00 51.96 52.16 2fjf s ALA 24 Cb -0.14 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2fjf s ALA 24 CO 0.15 0.35 0.18 -1.54 0.00 0.00 0.00 175.76 174.91 2fjf s SER 25 N -2.21 0.08 0.00 0.00 1.04 -0.86 -4.86 113.70 106.89 2fjf s SER 25 Ca 0.52 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2fjf s SER 25 Cb -0.11 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.31 2fjf s SER 25 CO 0.18 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2fjf n GLY 26 N 0.44 1.92 1.87 7.32 0.00 -1.26 -2.05 105.19 113.44 2fjf n GLY 26 Ca -0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 2fjf n GLY 26 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2fjf n PHE 27 N -2.00 -1.52 -3.89 1.61 -1.74 -1.26 -4.57 117.46 104.09 2fjf n PHE 27 Ca 0.00 -0.86 -0.35 0.00 -0.56 0.00 0.00 57.45 55.68 2fjf n PHE 27 Cb 0.00 0.43 -0.14 0.00 1.52 0.00 0.00 39.48 41.29 2fjf n PHE 27 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2fjf s THR 28 N -2.50 3.13 0.38 1.97 2.01 -1.26 -4.95 115.64 114.43 2fjf s THR 28 Ca 0.09 -1.23 0.18 0.00 0.31 0.00 0.00 61.69 61.03 2fjf s THR 28 Cb -0.02 -2.74 0.38 0.00 0.01 0.00 0.00 72.50 70.13 2fjf s THR 28 CO 0.05 -0.04 1.74 0.16 -0.69 0.00 0.00 174.62 175.84 2fjf h ILE 29 N 6.33 0.47 0.00 1.82 -0.00 -1.93 0.06 117.51 124.25 2fjf h ILE 29 Ca -0.24 -0.13 0.00 0.00 -0.00 0.00 0.00 64.86 64.48 2fjf h ILE 29 Cb 1.08 0.05 0.00 0.00 -0.00 0.00 0.00 36.82 37.94 2fjf h ILE 29 CO 0.55 0.07 0.00 -1.54 -0.00 0.00 0.00 178.15 177.24 2fjf n SER 30 N -4.70 0.03 -0.03 2.16 3.41 -1.26 -0.82 113.62 112.41 2fjf n SER 30 Ca 0.27 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.52 2fjf n SER 30 Cb 0.92 -0.52 0.45 0.00 -0.26 0.00 0.00 64.21 64.80 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 -1.54 0.34 -4.24 4.04 8.00 0.01 0.21 116.55 123.37 2fjf n ASP 31 Ca 0.02 -0.06 -0.14 0.00 0.71 0.00 0.00 54.79 55.33 2fjf n ASP 31 Cb 0.11 -0.08 -0.10 0.00 -0.02 0.00 0.00 41.12 41.03 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 -2.89 1.20 0.56 1.24 1.51 0.00 -4.81 117.35 114.16 2fjf s TYR 32 Ca 0.16 -0.79 -0.19 0.00 -1.01 0.00 0.00 57.07 55.23 2fjf s TYR 32 Cb 0.19 -0.62 -0.05 0.00 -0.11 0.00 0.00 41.96 41.36 2fjf s TYR 32 CO 0.60 0.03 1.13 -1.58 -1.11 0.00 0.00 175.55 174.62 2fjf s TRP 33 N -3.39 2.65 -0.17 2.71 0.52 0.70 -3.49 118.94 118.47 2fjf s TRP 33 Ca 0.16 1.54 0.01 0.00 0.02 0.00 0.00 56.10 57.83 2fjf s TRP 33 Cb 0.03 -3.28 0.01 0.00 -1.15 0.00 0.00 33.47 29.08 2fjf s TRP 33 CO -0.00 -1.62 -0.19 0.42 0.02 0.00 0.00 176.95 175.58 2fjf s ILE 34 N -1.83 2.25 -0.03 2.03 -1.09 -0.92 -2.04 121.20 119.57 2fjf s ILE 34 Ca 0.72 -0.89 -0.03 0.00 -2.23 0.00 0.00 60.65 58.22 2fjf s ILE 34 Cb -0.24 -1.94 -0.04 0.00 -1.58 0.00 0.00 42.46 38.66 2fjf s ILE 34 CO 0.29 0.53 0.14 -1.00 -1.23 0.00 0.00 174.94 173.67 2fjf s HIS 35 N 1.13 3.47 -0.22 3.97 3.76 0.28 -2.17 115.29 125.51 2fjf s HIS 35 Ca 0.01 0.34 -0.06 0.00 -0.15 0.00 0.00 55.06 55.19 2fjf s HIS 35 Cb -0.14 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.70 2fjf s HIS 35 CO -0.08 0.63 0.04 -1.58 -0.85 0.00 0.00 174.74 172.90 2fjf s TRP 36 N -1.23 3.09 -0.06 1.40 0.52 0.23 -1.40 118.94 121.48 2fjf s TRP 36 Ca 0.24 -0.38 0.05 0.00 0.02 0.00 0.00 56.10 56.03 2fjf s TRP 36 Cb -0.12 -2.16 -0.01 0.00 -1.15 0.00 0.00 33.47 30.03 2fjf s TRP 36 CO 0.15 -0.25 -0.24 0.08 0.02 0.00 0.00 176.95 176.71 2fjf s VAL 37 N 1.22 1.97 0.16 4.03 1.01 -0.16 -0.10 120.40 128.52 2fjf s VAL 37 Ca 0.04 -1.01 0.10 0.00 0.00 0.00 0.00 61.98 61.11 2fjf s VAL 37 Cb -0.14 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2fjf s VAL 37 CO 0.03 0.55 -0.17 0.00 0.00 0.00 0.00 175.10 175.50 2fjf s ARG 38 N -0.02 1.80 -0.28 2.72 1.70 0.19 -0.39 118.95 124.67 2fjf s ARG 38 Ca -0.07 -1.30 -0.01 0.00 -0.47 0.00 0.00 55.73 53.88 2fjf s ARG 38 Cb -0.14 -2.06 0.09 0.00 -0.57 0.00 0.00 34.95 32.26 2fjf s ARG 38 CO 0.05 0.44 0.08 -1.14 -1.08 0.00 0.00 175.30 173.65 2fjf s GLN 39 N -2.50 0.71 0.71 3.89 0.74 0.18 -0.43 119.66 122.96 2fjf s GLN 39 Ca 0.21 -0.87 -0.14 0.00 0.05 0.00 0.00 55.36 54.61 2fjf s GLN 39 Cb -0.09 -1.99 0.03 0.00 1.10 0.00 0.00 33.01 32.05 2fjf s GLN 39 CO 0.12 -0.88 1.12 0.00 -0.55 0.00 0.00 175.29 175.09 2fjf s ALA 40 N 1.70 2.31 -0.11 1.58 0.00 -1.26 -1.12 121.76 124.86 2fjf s ALA 40 Ca 0.06 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.26 2fjf s ALA 40 Cb -0.17 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.54 2fjf s ALA 40 CO -0.21 -1.56 2.10 -2.30 0.00 0.00 0.00 175.76 173.80 2fjf n PRO 41 N -2.81 2.30 0.00 0.00 -0.02 -1.26 -1.66 135.00 131.56 2fjf n PRO 41 Ca 0.11 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2fjf n PRO 41 Cb 0.52 -3.08 0.00 0.00 -0.02 0.00 0.00 33.50 30.92 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 5.23 1.96 0.62 -1.23 0.00 -1.26 -5.04 105.19 105.48 2fjf n GLY 42 Ca 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 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 0.97 -0.10 1.61 5.02 -0.66 -5.14 118.16 117.86 2fjf n LYS 43 Ca 0.00 -0.50 0.00 0.00 -2.02 0.00 0.00 58.31 55.79 2fjf n LYS 43 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 35.03 34.98 2fjf n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fjf n GLY 44 N 3.88 -0.42 3.54 0.72 0.00 -1.26 -4.67 105.19 106.98 2fjf n GLY 44 Ca 0.02 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 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 4.44 -0.22 0.99 1.43 -1.26 -4.20 118.68 119.85 2fjf s LEU 45 Ca 0.00 -0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 52.81 2fjf s LEU 45 Cb 0.00 -2.28 0.00 0.00 0.03 0.00 0.00 46.19 43.94 2fjf s LEU 45 CO 0.00 -0.30 -0.07 -0.70 0.23 0.00 0.00 176.35 175.51 2fjf s GLU 46 N 1.94 3.23 0.40 1.70 2.12 0.42 -4.94 118.70 123.58 2fjf s GLU 46 Ca 0.10 -0.71 -0.26 0.00 0.36 0.00 0.00 54.97 54.47 2fjf s GLU 46 Cb -0.17 -2.93 -0.08 0.00 0.26 0.00 0.00 34.13 31.21 2fjf s GLU 46 CO 0.11 -0.23 1.23 -0.46 -0.54 0.00 0.00 175.26 175.38 2fjf s TRP 47 N 1.43 2.94 0.00 5.30 -0.00 -1.26 0.53 118.94 127.88 2fjf s TRP 47 Ca 0.05 1.49 0.00 0.00 -0.00 0.00 0.00 56.10 57.63 2fjf s TRP 47 Cb -0.14 -3.53 0.00 0.00 -0.00 0.00 0.00 33.47 29.80 2fjf s TRP 47 CO -0.05 -1.70 0.00 1.55 -0.00 0.00 0.00 176.95 176.74 2fjf n VAL 48 N 0.09 0.00 -3.53 5.86 3.14 0.85 -4.72 118.33 120.03 2fjf n VAL 48 Ca 0.04 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.33 2fjf n VAL 48 Cb 0.45 -0.53 -0.03 0.00 -1.06 0.00 0.00 33.84 32.67 2fjf n VAL 48 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2fjf s ALA 49 N -1.79 -1.86 -0.09 1.55 0.00 -1.12 -0.93 121.76 117.52 2fjf s ALA 49 Ca 0.00 1.19 -0.17 0.00 0.00 0.00 0.00 51.96 52.99 2fjf s ALA 49 Cb 0.00 0.10 0.04 0.00 0.00 0.00 0.00 23.12 23.25 2fjf s ALA 49 CO 0.00 -0.58 0.41 0.20 0.00 0.00 0.00 175.76 175.79 2fjf s GLY 50 N -2.08 -0.28 -0.03 0.00 0.00 -0.54 -0.60 107.32 103.79 2fjf s GLY 50 Ca 0.03 0.87 0.04 0.00 0.00 0.00 0.00 44.72 45.66 2fjf s GLY 50 CO -0.05 0.66 -0.13 -0.26 0.00 0.00 0.00 173.10 173.32 2fjf s ILE 51 N -0.55 3.14 0.69 0.90 -4.36 -0.92 -1.25 121.20 118.85 2fjf s ILE 51 Ca -0.07 -0.77 -0.13 0.00 -0.26 0.00 0.00 60.65 59.42 2fjf s ILE 51 Cb -0.04 -2.26 0.02 0.00 1.25 0.00 0.00 42.46 41.43 2fjf s ILE 51 CO 0.03 0.54 1.09 -0.89 0.24 0.00 0.00 174.94 175.95 2fjf s THR 52 N -0.79 3.46 0.51 8.37 2.01 -0.34 -2.17 115.64 126.70 2fjf s THR 52 Ca 0.13 0.58 -0.20 0.00 0.31 0.00 0.00 61.69 62.50 2fjf s THR 52 Cb -0.11 -3.12 -0.09 0.00 0.01 0.00 0.00 72.50 69.19 2fjf s THR 52 CO 0.02 -0.52 0.71 -2.65 -0.69 0.00 0.00 174.62 171.49 2fjf n PRO 53 N -2.84 0.77 -0.94 4.92 -0.02 -1.23 -1.41 135.00 134.26 2fjf n PRO 53 Ca 0.09 0.29 -0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2fjf n PRO 53 Cb 0.53 -1.82 -0.00 0.00 -0.02 0.00 0.00 33.50 32.19 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 -1.28 -0.00 -2.84 3.55 0.00 0.13 -2.54 120.51 117.53 2fjf n ALA 54 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.34 2fjf n ALA 54 Cb 0.44 -1.41 0.02 0.00 0.00 0.00 0.00 19.45 18.51 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 0.92 -0.51 0.22 0.00 0.00 -0.50 -4.92 105.19 100.40 2fjf n GLY 55 Ca -0.00 0.09 0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.00 0.00 -2.92 -0.02 0.00 -1.62 -3.47 103.07 94.05 2fjf h GLY 56 Ca -0.52 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2fjf h GLY 56 CO 0.58 0.00 0.13 -0.47 0.00 0.00 0.00 176.54 176.77 2fjf s TYR 57 N -3.73 -0.40 -0.02 5.60 5.04 -1.26 -4.99 117.35 117.59 2fjf s TYR 57 Ca -0.00 0.13 0.02 0.00 -2.44 0.00 0.00 57.07 54.78 2fjf s TYR 57 Cb 0.11 0.48 0.00 0.00 0.35 0.00 0.00 41.96 42.91 2fjf s TYR 57 CO 0.65 -0.85 -0.06 -0.08 -1.34 0.00 0.00 175.55 173.87 2fjf s THR 58 N -3.79 0.51 0.02 4.34 -1.32 -1.26 -1.20 115.64 112.95 2fjf s THR 58 Ca 0.03 -0.22 0.02 0.00 -1.21 0.00 0.00 61.69 60.31 2fjf s THR 58 Cb -0.01 -0.47 -0.02 0.00 -1.51 0.00 0.00 72.50 70.50 2fjf s THR 58 CO -0.11 0.17 -0.07 -0.31 -2.21 0.00 0.00 174.62 172.09 2fjf s TYR 59 N 0.20 0.61 -0.00 9.09 1.51 -0.38 -5.00 117.35 123.36 2fjf s TYR 59 Ca -0.02 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 2fjf s TYR 59 Cb -0.06 -0.37 -0.00 0.00 -0.11 0.00 0.00 41.96 41.41 2fjf s TYR 59 CO -0.00 -0.05 -0.03 0.71 -1.11 0.00 0.00 175.55 175.07 2fjf s TYR 60 N -0.90 0.28 0.36 2.71 1.51 -1.26 -1.47 117.35 118.58 2fjf s TYR 60 Ca -0.05 -0.05 -0.28 0.00 -1.01 0.00 0.00 57.07 55.68 2fjf s TYR 60 Cb -0.07 -0.19 -0.10 0.00 -0.11 0.00 0.00 41.96 41.50 2fjf s TYR 60 CO 0.00 -0.01 1.32 0.00 -1.11 0.00 0.00 175.55 175.76 2fjf s ALA 61 N -0.05 3.42 0.49 3.71 0.00 -0.11 -4.77 121.76 124.45 2fjf s ALA 61 Ca 0.01 1.28 0.27 0.00 0.00 0.00 0.00 51.96 53.52 2fjf s ALA 61 Cb -0.01 -3.49 1.33 0.00 0.00 0.00 0.00 23.12 20.95 2fjf s ALA 61 CO -0.00 -0.75 1.85 -0.44 0.00 0.00 0.00 175.76 176.42 2fjf h ASP 62 N 3.10 0.17 0.02 0.00 3.45 -1.95 0.35 116.42 121.56 2fjf h ASP 62 Ca -0.49 0.02 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2fjf h ASP 62 Cb 1.23 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.00 2fjf h ASP 62 CO 0.64 0.05 0.00 -1.54 -1.57 0.00 0.00 179.24 176.83 2fjf n SER 63 N -4.37 0.00 0.00 6.45 3.41 -1.26 -3.18 113.62 114.66 2fjf n SER 63 Ca 0.21 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 2fjf n SER 63 Cb 0.92 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 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 -1.03 0.00 -1.61 -3.33 0.31 -0.03 -5.02 118.33 107.61 2fjf n VAL 64 Ca 0.09 0.00 -0.58 0.00 -0.01 0.00 0.00 64.34 63.84 2fjf n VAL 64 Cb 0.05 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.90 2fjf n VAL 64 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2fjf n LYS 65 N -0.07 0.87 -0.23 5.55 5.02 -0.36 -1.04 118.16 127.90 2fjf n LYS 65 Ca 0.00 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.59 2fjf n LYS 65 Cb 0.00 -2.03 0.00 0.00 -0.02 0.00 0.00 35.03 32.98 2fjf n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fjf n GLY 66 N 5.01 0.70 0.03 0.72 0.00 -1.26 -4.84 105.19 105.56 2fjf n GLY 66 Ca 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.31 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 1.05 -4.08 1.61 1.74 -0.20 -5.03 116.66 109.74 2fjf n ARG 67 Ca 0.00 0.03 -0.26 0.00 -0.77 0.00 0.00 57.85 56.85 2fjf n ARG 67 Cb 0.00 -1.13 -0.05 0.00 -1.02 0.00 0.00 32.46 30.25 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 -2.13 3.15 -0.06 -1.55 0.40 -0.97 -1.06 117.98 115.76 2fjf s PHE 68 Ca -0.07 -0.02 0.02 0.00 -0.60 0.00 0.00 56.93 56.25 2fjf s PHE 68 Cb 0.02 -1.51 0.02 0.00 0.51 0.00 0.00 43.02 42.06 2fjf s PHE 68 CO 0.17 0.52 -0.09 0.99 0.70 0.00 0.00 175.22 177.51 2fjf s THR 69 N -1.78 0.89 -0.16 0.64 2.01 0.34 -4.90 115.64 112.68 2fjf s THR 69 Ca 0.31 -0.33 -0.08 0.00 0.31 0.00 0.00 61.69 61.91 2fjf s THR 69 Cb -0.10 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 2fjf s THR 69 CO 0.24 0.30 0.11 -0.51 -0.69 0.00 0.00 174.62 174.07 2fjf s ILE 70 N 0.81 5.23 0.06 1.82 2.07 -1.26 -0.16 121.20 129.77 2fjf s ILE 70 Ca -0.12 0.12 -0.01 0.00 -1.41 0.00 0.00 60.65 59.22 2fjf s ILE 70 Cb -0.15 -3.33 0.00 0.00 0.13 0.00 0.00 42.46 39.12 2fjf s ILE 70 CO 0.02 0.52 0.09 -0.24 -1.91 0.00 0.00 174.94 173.42 2fjf n SER 71 N 2.85 -0.27 -3.61 4.50 2.88 -0.91 -4.94 113.62 114.12 2fjf n SER 71 Ca -0.18 -1.28 -0.10 0.00 -1.33 0.00 0.00 58.87 55.97 2fjf n SER 71 Cb 0.53 0.47 -0.03 0.00 -0.75 0.00 0.00 64.21 64.43 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 -1.56 -1.18 -0.32 -1.46 0.00 -1.26 -0.18 121.76 115.80 2fjf s ALA 72 Ca 0.04 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.08 2fjf s ALA 72 Cb -0.00 0.83 0.10 0.00 0.00 0.00 0.00 23.12 24.04 2fjf s ALA 72 CO 0.03 -0.77 0.06 0.34 0.00 0.00 0.00 175.76 175.42 2fjf s ASP 73 N -2.82 4.48 0.37 0.00 -1.08 0.56 -4.96 116.67 113.22 2fjf s ASP 73 Ca 0.05 -1.93 0.06 0.00 -0.52 0.00 0.00 52.55 50.21 2fjf s ASP 73 Cb -0.01 -1.36 0.75 0.00 -1.46 0.00 0.00 42.92 40.84 2fjf s ASP 73 CO -0.08 -0.38 1.98 0.71 0.52 0.00 0.00 175.17 177.92 2fjf h THR 74 N 6.58 1.04 0.00 1.71 1.35 -1.96 0.15 112.91 121.78 2fjf h THR 74 Ca -0.08 -0.25 -0.01 0.00 -0.55 0.00 0.00 66.41 65.52 2fjf h THR 74 Cb 1.02 0.24 -0.00 0.00 -1.73 0.00 0.00 68.15 67.68 2fjf h THR 74 CO 0.50 0.13 -0.04 0.77 -0.25 0.00 0.00 175.52 176.63 2fjf h SER 75 N 0.74 0.00 -0.24 5.36 4.64 -1.95 -1.32 113.55 120.77 2fjf h SER 75 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2fjf h SER 75 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2fjf h SER 75 CO -0.09 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 176.21 2fjf n LYS 76 N -3.81 2.08 -4.24 4.77 5.02 0.38 -4.97 118.16 117.38 2fjf n LYS 76 Ca -0.03 -1.77 -0.33 0.00 -2.02 0.00 0.00 58.31 54.16 2fjf n LYS 76 Cb 0.14 -1.26 -0.05 0.00 -0.02 0.00 0.00 35.03 33.83 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 0.59 -1.20 -3.90 4.39 5.15 -0.27 -4.76 115.26 115.25 2fjf n ASN 77 Ca 0.10 -1.12 -0.21 0.00 -0.60 0.00 0.00 54.58 52.75 2fjf n ASN 77 Cb 0.38 -2.34 -0.16 0.00 -0.53 0.00 0.00 39.78 37.13 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 -3.73 0.61 0.28 -0.44 2.01 -1.11 -1.33 115.64 111.93 2fjf s THR 78 Ca 0.38 -0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.25 2fjf s THR 78 Cb -0.22 -0.63 -0.03 0.00 0.01 0.00 0.00 72.50 71.63 2fjf s THR 78 CO 0.95 0.25 0.45 0.00 -0.69 0.00 0.00 174.62 175.58 2fjf s ALA 79 N 0.97 3.80 0.07 7.40 0.00 0.27 -0.32 121.76 133.95 2fjf s ALA 79 Ca -0.10 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.87 2fjf s ALA 79 Cb -0.14 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 2fjf s ALA 79 CO -0.00 0.16 -0.06 0.71 0.00 0.00 0.00 175.76 176.57 2fjf s TYR 80 N -2.11 0.75 -0.26 0.00 2.02 0.75 -0.14 117.35 118.36 2fjf s TYR 80 Ca 0.38 -0.83 -0.01 0.00 -0.37 0.00 0.00 57.07 56.23 2fjf s TYR 80 Cb -0.10 -0.45 0.08 0.00 -0.40 0.00 0.00 41.96 41.09 2fjf s TYR 80 CO 0.32 -0.18 0.04 -1.17 -1.57 0.00 0.00 175.55 173.00 2fjf s LEU 81 N -2.63 2.14 -0.12 -1.29 2.96 -0.69 -2.14 118.68 116.91 2fjf s LEU 81 Ca 0.05 -1.32 -0.27 0.00 -0.22 0.00 0.00 54.13 52.37 2fjf s LEU 81 Cb 0.02 -0.90 -0.02 0.00 0.50 0.00 0.00 46.19 45.79 2fjf s LEU 81 CO -0.04 -0.34 0.87 -1.58 -1.32 0.00 0.00 176.35 173.94 2fjf s GLN 82 N 1.60 4.38 -0.30 1.98 2.00 0.78 -1.39 119.66 128.71 2fjf s GLN 82 Ca 0.03 1.14 0.00 0.00 -2.00 0.00 0.00 55.36 54.54 2fjf s GLN 82 Cb -0.18 -3.53 0.06 0.00 0.80 0.00 0.00 33.01 30.17 2fjf s GLN 82 CO -0.15 -0.23 -0.02 -1.64 -0.50 0.00 0.00 175.29 172.75 2fjf s MET 83 N 1.76 2.23 0.21 1.67 -1.94 0.48 -0.50 119.30 123.21 2fjf s MET 83 Ca 0.42 -1.41 0.07 0.00 -1.71 0.00 0.00 55.69 53.06 2fjf s MET 83 Cb -0.18 -3.11 -0.04 0.00 2.01 0.00 0.00 34.83 33.51 2fjf s MET 83 CO 0.17 -0.67 0.11 -0.80 -0.01 0.00 0.00 175.02 173.81 2fjf s ASN 84 N 1.21 5.24 -1.26 3.03 0.01 -0.23 -1.37 114.94 121.57 2fjf s ASN 84 Ca -0.04 -0.29 -0.08 0.00 -0.71 0.00 0.00 52.86 51.74 2fjf s ASN 84 Cb -0.20 -1.26 -0.01 0.00 0.41 0.00 0.00 41.25 40.19 2fjf s ASN 84 CO -0.03 0.03 0.65 -1.20 -1.51 0.00 0.00 177.10 175.04 2fjf n SER 85 N -0.64 -2.64 -4.75 -1.22 7.64 -0.95 -4.63 113.62 106.42 2fjf n SER 85 Ca -0.08 -0.95 -0.41 0.00 1.01 0.00 0.00 58.87 58.44 2fjf n SER 85 Cb 0.56 -3.55 -0.02 0.00 -1.01 0.00 0.00 64.21 60.20 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 -6.64 4.39 0.16 -3.43 1.43 -0.89 -4.56 118.68 109.15 2fjf s LEU 86 Ca 0.19 2.66 0.07 0.00 -1.03 0.00 0.00 54.13 56.02 2fjf s LEU 86 Cb -0.07 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.49 2fjf s LEU 86 CO 0.85 -0.66 0.03 -0.13 0.23 0.00 0.00 176.35 176.67 2fjf s ARG 87 N -0.69 2.53 0.25 1.70 0.52 -1.26 0.18 118.95 122.17 2fjf s ARG 87 Ca 0.57 -1.03 -0.09 0.00 -0.52 0.00 0.00 55.73 54.65 2fjf s ARG 87 Cb -0.41 -2.44 0.39 0.00 0.52 0.00 0.00 34.95 33.01 2fjf s ARG 87 CO 0.45 0.47 1.60 0.00 0.02 0.00 0.00 175.30 177.84 2fjf h ALA 88 N 2.70 0.63 0.00 2.13 0.00 -1.96 -0.84 119.26 121.92 2fjf h ALA 88 Ca -0.47 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2fjf h ALA 88 Cb 1.20 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2fjf h ALA 88 CO 0.59 -0.42 0.00 -0.85 0.00 0.00 0.00 179.25 178.57 2fjf n GLU 89 N -5.48 0.11 0.01 0.00 0.00 -1.26 -1.66 120.64 112.37 2fjf n GLU 89 Ca 0.13 0.17 0.14 0.00 0.00 0.00 0.00 57.16 57.59 2fjf n GLU 89 Cb 0.45 -1.50 0.52 0.00 0.00 0.00 0.00 31.44 30.91 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 -1.21 0.20 -4.60 -1.84 8.00 -0.32 -4.84 116.55 111.95 2fjf n ASP 90 Ca 0.03 0.38 -0.51 0.00 0.71 0.00 0.00 54.79 55.41 2fjf n ASP 90 Cb 0.04 -0.40 -0.06 0.00 -0.02 0.00 0.00 41.12 40.68 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 -1.61 0.37 -3.69 -3.53 -1.04 -0.66 -4.89 114.28 99.23 2fjf n THR 91 Ca 0.06 -0.17 -0.01 0.00 -2.04 0.00 0.00 64.05 61.89 2fjf n THR 91 Cb 0.35 -1.70 -0.01 0.00 -1.82 0.00 0.00 70.33 67.15 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 5.38 -1.92 -0.12 2.41 0.00 -0.11 -4.53 121.76 122.87 2fjf s ALA 92 Ca 1.00 0.39 -0.23 0.00 0.00 0.00 0.00 51.96 53.13 2fjf s ALA 92 Cb -0.81 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 2fjf s ALA 92 CO 0.53 -1.04 0.69 0.08 0.00 0.00 0.00 175.76 176.01 2fjf s VAL 93 N -2.90 5.02 -0.19 0.00 1.01 -0.27 -0.80 120.40 122.27 2fjf s VAL 93 Ca 0.13 1.38 -0.07 0.00 0.00 0.00 0.00 61.98 63.42 2fjf s VAL 93 Cb 0.01 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2fjf s VAL 93 CO -0.01 0.18 0.06 -0.31 0.00 0.00 0.00 175.10 175.02 2fjf s TYR 94 N 1.30 3.21 0.01 5.22 1.51 -0.08 -0.65 117.35 127.87 2fjf s TYR 94 Ca 0.35 -0.01 0.04 0.00 -1.01 0.00 0.00 57.07 56.43 2fjf s TYR 94 Cb -0.17 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 2fjf s TYR 94 CO 0.15 0.08 -0.08 0.71 -1.11 0.00 0.00 175.55 175.29 2fjf s TYR 95 N 0.54 2.85 0.20 2.71 1.51 0.47 -1.39 117.35 124.25 2fjf s TYR 95 Ca 0.03 -0.06 0.05 0.00 -1.01 0.00 0.00 57.07 56.08 2fjf s TYR 95 Cb -0.13 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 2fjf s TYR 95 CO 0.01 0.36 0.19 0.00 -1.11 0.00 0.00 175.55 175.00 2fjf s ALA 97 N -1.90 -1.05 -0.03 0.00 0.00 -0.50 -0.59 121.76 117.70 2fjf s ALA 97 Ca 0.32 0.29 -0.00 0.00 0.00 0.00 0.00 51.96 52.57 2fjf s ALA 97 Cb -0.09 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 2fjf s ALA 97 CO 0.25 -0.50 0.03 -0.98 0.00 0.00 0.00 175.76 174.56 2fjf s ARG 98 N -2.72 2.95 -0.04 0.00 1.70 -0.90 -0.55 118.95 119.39 2fjf s ARG 98 Ca -0.04 -0.49 -0.09 0.00 -0.47 0.00 0.00 55.73 54.64 2fjf s ARG 98 Cb -0.00 -2.78 0.02 0.00 -0.57 0.00 0.00 34.95 31.61 2fjf s ARG 98 CO -0.04 0.66 0.21 0.12 -1.08 0.00 0.00 175.30 175.18 2fjf s PHE 99 N -1.05 -0.14 0.05 5.89 5.36 -0.86 -3.78 117.98 123.46 2fjf s PHE 99 Ca 0.18 0.30 -0.05 0.00 -0.96 0.00 0.00 56.93 56.40 2fjf s PHE 99 Cb -0.12 0.04 -0.02 0.00 -0.34 0.00 0.00 43.02 42.59 2fjf s PHE 99 CO 0.08 -0.23 0.08 0.54 -1.46 0.00 0.00 175.22 174.24 2fjf s VAL 100 N -0.67 0.16 -1.13 3.12 0.11 -1.26 -0.21 120.40 120.52 2fjf s VAL 100 Ca -0.08 -1.32 0.29 0.00 -2.93 0.00 0.00 61.98 57.94 2fjf s VAL 100 Cb -0.04 -1.19 0.27 0.00 -1.53 0.00 0.00 36.38 33.89 2fjf s VAL 100 CO 0.01 -0.73 1.87 0.49 -3.33 0.00 0.00 175.10 173.41 2fjf n PHE 101 N 0.37 0.00 -1.80 1.54 3.01 -1.26 -3.76 117.46 115.56 2fjf n PHE 101 Ca -0.17 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 57.97 2fjf n PHE 101 Cb 0.60 -0.40 0.04 0.00 -0.01 0.00 0.00 39.48 39.71 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 -2.88 2.79 0.15 1.38 2.99 -1.26 -4.57 117.98 116.58 2fjf s PHE 102 Ca 0.17 1.53 -0.33 0.00 0.00 0.00 0.00 56.93 58.29 2fjf s PHE 102 Cb 0.19 -3.08 -0.17 0.00 0.00 0.00 0.00 43.02 39.97 2fjf s PHE 102 CO 0.54 -1.45 1.07 1.28 -0.00 0.00 0.00 175.22 176.66 2fjf n LEU 103 N -2.44 0.95 -0.67 -0.37 4.77 -1.26 -0.13 117.00 117.85 2fjf n LEU 103 Ca 0.09 1.14 0.06 0.00 -0.03 0.00 0.00 56.01 57.28 2fjf n LEU 103 Cb 0.52 -1.14 0.17 0.00 -2.33 0.00 0.00 43.42 40.65 2fjf n LEU 103 CO 0.49 -1.60 0.64 -0.81 -1.33 0.00 0.00 177.39 174.78 2fjf n PRO 104 N 1.64 1.84 -3.96 3.23 -0.04 -1.26 -5.00 135.00 131.45 2fjf n PRO 104 Ca 0.16 -1.30 -0.31 0.00 -0.04 0.00 0.00 63.50 62.01 2fjf n PRO 104 Cb 0.22 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 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 0.56 -1.01 -4.12 0.54 0.18 0.81 -4.95 117.16 109.17 2fjf n TYR 105 Ca 0.12 0.25 -0.15 0.00 1.88 0.00 0.00 57.90 60.00 2fjf n TYR 105 Cb 0.31 -2.14 -0.05 0.00 -0.38 0.00 0.00 39.34 37.08 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 0.94 -0.79 -3.48 0.00 -1.26 -5.00 121.76 108.20 2fjf s ALA 106 Ca 0.20 -1.60 -0.16 0.00 0.00 0.00 0.00 51.96 50.40 2fjf s ALA 106 Cb -0.11 1.21 0.17 0.00 0.00 0.00 0.00 23.12 24.40 2fjf s ALA 106 CO 0.76 -0.77 0.82 -1.64 0.00 0.00 0.00 175.76 174.94 2fjf s MET 107 N -3.18 3.47 0.08 0.00 -1.94 -1.26 -4.55 119.30 111.92 2fjf s MET 107 Ca 0.32 -2.07 -0.07 0.00 -1.71 0.00 0.00 55.69 52.16 2fjf s MET 107 Cb 0.00 -4.51 -0.25 0.00 2.01 0.00 0.00 34.83 32.08 2fjf s MET 107 CO 0.21 -1.44 1.15 0.38 -0.01 0.00 0.00 175.02 175.31 2fjf h ASP 108 N 8.33 0.55 -3.58 3.03 3.04 -1.99 -3.45 116.42 122.35 2fjf h ASP 108 Ca 0.03 -0.55 -0.62 0.00 -3.24 0.00 0.00 57.03 52.64 2fjf h ASP 108 Cb 1.05 -0.18 -0.32 0.00 -1.04 0.00 0.00 39.33 38.84 2fjf h ASP 108 CO 0.91 1.40 -0.86 -0.31 -2.04 0.00 0.00 179.24 178.35 2fjf s TYR 109 N -2.81 2.15 0.23 4.15 1.51 -1.26 -5.05 117.35 116.26 2fjf s TYR 109 Ca -0.06 -0.78 0.11 0.00 -1.01 0.00 0.00 57.07 55.33 2fjf s TYR 109 Cb 0.07 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 2fjf s TYR 109 CO 0.89 -0.31 -0.20 -1.58 -1.11 0.00 0.00 175.55 173.25 2fjf s TRP 110 N 0.26 2.12 0.97 2.71 0.52 -1.26 -2.11 118.94 122.15 2fjf s TRP 110 Ca -0.13 -0.40 -0.16 0.00 0.02 0.00 0.00 56.10 55.44 2fjf s TRP 110 Cb -0.16 -0.98 0.19 0.00 -1.15 0.00 0.00 33.47 31.37 2fjf s TRP 110 CO 0.06 0.55 1.26 0.20 0.02 0.00 0.00 176.95 179.03 2fjf s GLY 111 N -3.14 1.71 0.14 0.98 0.00 0.25 -4.23 107.32 103.03 2fjf s GLY 111 Ca 0.24 -1.03 0.27 0.00 0.00 0.00 0.00 44.72 44.20 2fjf s GLY 111 CO 0.11 -0.31 1.81 0.61 0.00 0.00 0.00 173.10 175.33 2fjf n GLN 112 N -3.83 0.18 0.00 2.90 -0.00 -1.26 -4.78 117.38 110.60 2fjf n GLN 112 Ca 0.13 0.15 0.00 0.00 -0.00 0.00 0.00 57.00 57.28 2fjf n GLN 112 Cb 0.60 -1.71 0.00 0.00 -0.00 0.00 0.00 30.24 29.13 2fjf n GLN 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2fjf n GLY 113 N 1.37 0.69 3.19 2.61 0.00 -1.25 -5.01 105.19 106.78 2fjf n GLY 113 Ca 0.06 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.96 1.37 -0.19 2.61 -4.23 -0.48 -4.90 115.64 107.86 2fjf s THR 114 Ca 0.00 -1.01 -0.26 0.00 -1.18 0.00 0.00 61.69 59.24 2fjf s THR 114 Cb 0.00 -1.20 -0.01 0.00 1.34 0.00 0.00 72.50 72.63 2fjf s THR 114 CO 0.00 0.17 0.88 -0.22 -0.54 0.00 0.00 174.62 174.91 2fjf s LEU 115 N -0.98 4.15 -0.18 4.79 0.20 -1.26 -0.90 118.68 124.49 2fjf s LEU 115 Ca 0.05 1.21 -0.02 0.00 0.69 0.00 0.00 54.13 56.06 2fjf s LEU 115 Cb -0.08 -3.30 -0.01 0.00 -0.43 0.00 0.00 46.19 42.37 2fjf s LEU 115 CO 0.01 -0.47 -0.09 -0.69 -0.29 0.00 0.00 176.35 174.82 2fjf s VAL 116 N 2.46 3.13 -0.09 1.68 1.01 0.02 -1.15 120.40 127.47 2fjf s VAL 116 Ca 0.39 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.79 2fjf s VAL 116 Cb -0.16 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.86 2fjf s VAL 116 CO 0.11 0.47 -0.12 0.28 0.00 0.00 0.00 175.10 175.84 2fjf s THR 117 N 1.03 1.24 -0.30 3.92 -1.32 -0.56 -0.93 115.64 118.71 2fjf s THR 117 Ca -0.00 -0.50 -0.01 0.00 -1.21 0.00 0.00 61.69 59.97 2fjf s THR 117 Cb -0.15 -1.15 0.05 0.00 -1.51 0.00 0.00 72.50 69.75 2fjf s THR 117 CO -0.01 0.39 -0.02 -0.69 -2.21 0.00 0.00 174.62 172.08 2fjf s VAL 118 N 0.94 2.82 0.13 5.08 1.01 -1.26 -1.98 120.40 127.14 2fjf s VAL 118 Ca -0.09 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.23 2fjf s VAL 118 Cb -0.15 -2.65 0.05 0.00 0.00 0.00 0.00 36.38 33.63 2fjf s VAL 118 CO 0.00 -0.12 0.48 -0.55 0.00 0.00 0.00 175.10 174.92 2fjf s SER 119 N 1.23 -0.37 0.00 3.32 0.15 -0.52 -4.49 113.70 113.02 2fjf s SER 119 Ca -0.05 -0.14 0.25 0.00 0.70 0.00 0.00 55.95 56.70 2fjf s SER 119 Cb -0.20 0.52 0.68 0.00 -1.71 0.00 0.00 66.02 65.30 2fjf s SER 119 CO -0.02 -0.87 1.53 -1.54 1.20 0.00 0.00 173.24 173.54 2fjf n SER 120 N -0.19 2.19 -4.82 5.45 3.41 -1.26 -3.71 113.62 114.70 2fjf n SER 120 Ca -0.17 -1.74 -0.35 0.00 -0.26 0.00 0.00 58.87 56.35 2fjf n SER 120 Cb 0.64 -0.04 -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 -1.91 3.30 0.62 7.33 0.00 -1.26 -5.04 121.76 124.79 2fjf s ALA 121 Ca 0.34 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.45 2fjf s ALA 121 Cb 0.20 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 2fjf s ALA 121 CO 0.31 0.27 1.00 -1.12 0.00 0.00 0.00 175.76 176.22 2fjf s SER 122 N -1.85 6.07 0.62 0.00 0.01 -1.26 -5.00 113.70 112.28 2fjf s SER 122 Ca 0.50 1.27 -0.18 0.00 1.31 0.00 0.00 55.95 58.84 2fjf s SER 122 Cb -0.15 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2fjf s SER 122 CO 0.20 -0.92 1.03 0.41 0.41 0.00 0.00 173.24 174.36 2fjf n THR 123 N -2.72 4.00 -3.64 1.44 -1.04 -1.26 -4.75 114.28 106.31 2fjf n THR 123 Ca 0.05 -0.50 -0.06 0.00 -2.04 0.00 0.00 64.05 61.50 2fjf n THR 123 Cb 0.55 -1.22 -0.07 0.00 -1.82 0.00 0.00 70.33 67.78 2fjf n THR 123 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2fjf s LYS 124 N -2.90 0.68 0.67 -2.82 2.20 0.13 -4.91 119.74 112.79 2fjf s LYS 124 Ca 0.78 1.26 -0.13 0.00 -0.36 0.00 0.00 55.97 57.52 2fjf s LYS 124 Cb -0.41 0.27 0.00 0.00 -1.51 0.00 0.00 37.83 36.19 2fjf s LYS 124 CO 0.45 -0.16 1.07 0.20 -0.36 0.00 0.00 175.35 176.55 2fjf s GLY 125 N 1.87 1.86 0.40 5.54 0.00 -1.26 -1.01 107.32 114.72 2fjf s GLY 125 Ca -0.09 0.25 -0.15 0.00 0.00 0.00 0.00 44.72 44.73 2fjf s GLY 125 CO -0.20 0.58 0.83 2.56 0.00 0.00 0.00 173.10 176.87 2fjf s PRO 126 N -4.62 3.95 0.06 2.90 0.04 -1.26 -4.47 135.00 131.60 2fjf s PRO 126 Ca 0.61 0.73 -0.19 0.00 0.04 0.00 0.00 61.00 62.20 2fjf s PRO 126 Cb -0.16 -2.32 -0.06 0.00 0.04 0.00 0.00 34.50 32.00 2fjf s PRO 126 CO 0.48 -0.02 0.54 -1.54 0.04 0.00 0.00 177.00 176.50 2fjf s SER 127 N -2.70 7.02 -0.14 6.66 1.04 -0.41 -4.90 113.70 120.26 2fjf s SER 127 Ca 0.55 1.21 -0.01 0.00 0.48 0.00 0.00 55.95 58.18 2fjf s SER 127 Cb -0.10 -2.34 -0.01 0.00 0.10 0.00 0.00 66.02 63.67 2fjf s SER 127 CO 0.24 0.28 -0.12 -0.69 0.98 0.00 0.00 173.24 173.93 2fjf s VAL 128 N -1.08 3.08 0.06 5.02 1.01 -1.26 -1.30 120.40 125.94 2fjf s VAL 128 Ca 0.28 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.70 2fjf s VAL 128 Cb -0.19 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2fjf s VAL 128 CO 0.18 0.51 -0.23 -0.36 0.00 0.00 0.00 175.10 175.21 2fjf s PHE 129 N 0.50 1.97 0.44 5.22 0.08 0.35 -4.98 117.98 121.56 2fjf s PHE 129 Ca -0.08 -0.39 -0.22 0.00 0.12 0.00 0.00 56.93 56.36 2fjf s PHE 129 Cb -0.16 -1.15 -0.09 0.00 -0.57 0.00 0.00 43.02 41.06 2fjf s PHE 129 CO 0.04 0.15 1.03 -1.25 -0.10 0.00 0.00 175.22 175.09 2fjf s PRO 130 N -1.43 4.00 -0.46 0.24 0.04 -1.26 0.36 135.00 136.48 2fjf s PRO 130 Ca 0.09 1.39 0.01 0.00 0.04 0.00 0.00 61.00 62.53 2fjf s PRO 130 Cb -0.09 -2.28 0.12 0.00 0.04 0.00 0.00 34.50 32.29 2fjf s PRO 130 CO 0.03 -0.27 0.21 -0.51 0.04 0.00 0.00 177.00 176.50 2fjf s LEU 131 N -3.12 4.81 0.13 -3.56 1.43 -0.85 -4.69 118.68 112.84 2fjf s LEU 131 Ca 0.63 -2.52 -0.23 0.00 -1.03 0.00 0.00 54.13 50.98 2fjf s LEU 131 Cb -0.18 -1.71 -0.07 0.00 0.03 0.00 0.00 46.19 44.26 2fjf s LEU 131 CO 0.22 -0.37 0.71 0.00 0.23 0.00 0.00 176.35 177.15 2fjf s ALA 132 N 0.42 3.49 0.24 4.21 0.00 -1.26 -1.24 121.76 127.61 2fjf s ALA 132 Ca 0.13 0.26 -0.31 0.00 0.00 0.00 0.00 51.96 52.04 2fjf s ALA 132 Cb -0.22 -2.86 -0.12 0.00 0.00 0.00 0.00 23.12 19.92 2fjf s ALA 132 CO -0.04 0.31 1.68 -0.35 0.00 0.00 0.00 175.76 177.36 2fjf n PRO 133 N 1.73 2.78 -0.38 0.00 -0.04 -1.25 -4.96 135.00 132.87 2fjf n PRO 133 Ca -0.07 1.00 0.00 0.00 -0.04 0.00 0.00 63.50 64.39 2fjf n PRO 133 Cb 0.49 -2.82 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 2fjf n PRO 133 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2fjf n SER 134 N 3.28 0.00 0.00 3.54 3.41 -1.26 -4.66 113.62 117.93 2fjf n SER 134 Ca 0.13 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 58.15 2fjf n SER 134 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 2fjf n SER 134 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2fjf n SER 135 N -1.77 0.00 0.00 4.04 7.64 -1.26 -5.07 113.62 117.20 2fjf n SER 135 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2fjf n SER 135 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 0.21 3.33 0.23 0.00 -1.26 -5.12 105.19 102.58 2fjf n GLY 141 Ca 0.00 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 2.06 0.10 2.61 -4.23 -1.26 -2.72 115.64 112.20 2fjf s THR 142 Ca 0.00 -1.39 0.07 0.00 -1.18 0.00 0.00 61.69 59.19 2fjf s THR 142 Cb 0.00 -1.78 -0.04 0.00 1.34 0.00 0.00 72.50 72.03 2fjf s THR 142 CO 0.00 0.31 -0.12 0.00 -0.54 0.00 0.00 174.62 174.27 2fjf s ALA 143 N -0.83 2.89 -0.12 3.99 0.00 -0.10 -4.83 121.76 122.76 2fjf s ALA 143 Ca 0.11 -1.24 -0.01 0.00 0.00 0.00 0.00 51.96 50.81 2fjf s ALA 143 Cb -0.10 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.14 2fjf s ALA 143 CO 0.02 0.63 -0.07 0.00 0.00 0.00 0.00 175.76 176.34 2fjf s ALA 144 N -1.17 2.91 0.04 0.00 0.00 -1.26 -1.82 121.76 120.46 2fjf s ALA 144 Ca 0.20 -0.86 -0.02 0.00 0.00 0.00 0.00 51.96 51.29 2fjf s ALA 144 Cb -0.11 -1.37 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 2fjf s ALA 144 CO 0.12 0.35 -0.01 -0.48 0.00 0.00 0.00 175.76 175.74 2fjf s LEU 145 N -0.05 2.32 0.00 0.00 0.05 -0.23 -3.97 118.68 116.80 2fjf s LEU 145 Ca 0.00 -0.83 0.00 0.00 0.05 0.00 0.00 54.13 53.35 2fjf s LEU 145 Cb -0.13 0.26 0.00 0.00 -2.05 0.00 0.00 46.19 44.26 2fjf s LEU 145 CO 0.03 -0.53 0.00 0.61 -0.55 0.00 0.00 176.35 175.91 2fjf n GLY 146 N 0.50 3.39 3.00 -3.48 0.00 -0.37 0.85 105.19 109.08 2fjf n GLY 146 Ca -0.17 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 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 1.68 4.26 -0.34 0.00 2.96 0.16 -0.86 118.68 126.53 2fjf s LEU 148 Ca -0.05 1.09 -0.00 0.00 -0.22 0.00 0.00 54.13 54.95 2fjf s LEU 148 Cb -0.11 -3.04 0.08 0.00 0.50 0.00 0.00 46.19 43.62 2fjf s LEU 148 CO -0.08 -0.18 0.06 -0.69 -1.32 0.00 0.00 176.35 174.14 2fjf s VAL 149 N 1.20 2.83 -0.02 1.68 1.01 0.98 -0.50 120.40 127.58 2fjf s VAL 149 Ca 0.35 -1.84 0.07 0.00 0.00 0.00 0.00 61.98 60.56 2fjf s VAL 149 Cb -0.17 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2fjf s VAL 149 CO 0.15 -0.39 -0.24 -0.75 0.00 0.00 0.00 175.10 173.87 2fjf s LYS 150 N 1.12 1.94 -0.65 2.72 2.36 -0.42 -0.13 119.74 126.69 2fjf s LYS 150 Ca 0.02 -0.85 -0.01 0.00 -2.55 0.00 0.00 55.97 52.58 2fjf s LYS 150 Cb -0.21 -1.86 0.00 0.00 -1.05 0.00 0.00 37.83 34.71 2fjf s LYS 150 CO -0.04 0.50 0.63 -0.25 1.55 0.00 0.00 175.35 177.74 2fjf n ASP 151 N 2.52 -7.32 -4.16 1.43 8.00 -0.23 -1.29 116.55 115.50 2fjf n ASP 151 Ca -0.16 -0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.22 2fjf n ASP 151 Cb 0.52 -4.95 -0.10 0.00 -0.02 0.00 0.00 41.12 36.56 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 -2.95 0.90 -0.27 1.24 1.13 0.02 -4.03 117.35 113.39 2fjf s TYR 152 Ca 0.02 -0.84 -0.23 0.00 -1.41 0.00 0.00 57.07 54.61 2fjf s TYR 152 Cb -0.01 -0.52 0.08 0.00 -1.10 0.00 0.00 41.96 40.41 2fjf s TYR 152 CO 0.69 -0.12 0.74 0.12 -2.51 0.00 0.00 175.55 174.47 2fjf s PHE 153 N -3.30 -0.83 0.00 -3.49 2.19 -0.18 -0.57 117.98 111.81 2fjf s PHE 153 Ca 0.09 1.91 0.00 0.00 0.33 0.00 0.00 56.93 59.27 2fjf s PHE 153 Cb 0.03 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.10 2fjf s PHE 153 CO -0.04 -0.40 0.00 -0.35 1.83 0.00 0.00 175.22 176.26 2fjf n PRO 154 N 3.04 0.66 -1.07 10.12 -0.04 -1.26 0.22 135.00 146.67 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 0.15 0.00 -0.04 0.00 0.00 33.50 34.17 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 -2.11 1.11 0.33 0.54 0.41 -1.26 -4.72 118.70 112.99 2fjf s GLU 155 Ca 0.00 0.97 0.06 0.00 -0.41 0.00 0.00 54.97 55.59 2fjf s GLU 155 Cb 0.00 -1.78 -0.01 0.00 -1.78 0.00 0.00 34.13 30.56 2fjf s GLU 155 CO 0.00 -2.38 0.46 -1.25 -0.49 0.00 0.00 175.26 171.60 2fjf s PRO 156 N -4.84 3.16 0.12 0.39 0.04 -1.26 -4.97 135.00 127.64 2fjf s PRO 156 Ca 0.64 -0.95 0.07 0.00 0.04 0.00 0.00 61.00 60.80 2fjf s PRO 156 Cb -0.19 -2.82 -0.04 0.00 0.04 0.00 0.00 34.50 31.49 2fjf s PRO 156 CO 0.58 0.10 -0.07 0.54 0.04 0.00 0.00 177.00 178.19 2fjf s VAL 157 N -2.17 3.50 -0.11 -0.36 0.11 -1.26 -4.48 120.40 115.63 2fjf s VAL 157 Ca 0.44 -1.30 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 2fjf s VAL 157 Cb -0.09 -2.67 -0.01 0.00 -1.53 0.00 0.00 36.38 32.07 2fjf s VAL 157 CO 0.31 0.05 -0.17 -0.89 -3.33 0.00 0.00 175.10 171.07 2fjf s THR 158 N -1.36 2.69 -0.01 5.04 2.01 0.15 -4.98 115.64 119.16 2fjf s THR 158 Ca 0.23 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.49 2fjf s THR 158 Cb -0.11 -2.09 -0.01 0.00 0.01 0.00 0.00 72.50 70.30 2fjf s THR 158 CO 0.15 0.54 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.76 2fjf s VAL 159 N 0.21 1.41 0.14 3.82 1.01 -1.26 -0.61 120.40 125.11 2fjf s VAL 159 Ca -0.11 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 2fjf s VAL 159 Cb -0.16 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2fjf s VAL 159 CO 0.06 0.40 0.05 -0.94 0.00 0.00 0.00 175.10 174.67 2fjf s SER 160 N -0.41 0.42 -0.04 3.32 1.04 -0.68 -4.98 113.70 112.37 2fjf s SER 160 Ca 0.07 -1.21 0.06 0.00 0.48 0.00 0.00 55.95 55.35 2fjf s SER 160 Cb -0.07 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 2fjf s SER 160 CO -0.01 -0.71 -0.22 0.26 0.98 0.00 0.00 173.24 173.54 2fjf s TRP 161 N -4.00 2.47 -1.60 5.02 0.52 -1.26 0.21 118.94 120.30 2fjf s TRP 161 Ca 0.24 -0.37 -0.11 0.00 0.02 0.00 0.00 56.10 55.88 2fjf s TRP 161 Cb 0.07 -1.56 0.09 0.00 -1.15 0.00 0.00 33.47 30.93 2fjf s TRP 161 CO 0.02 0.02 0.58 0.09 0.02 0.00 0.00 176.95 177.68 2fjf n ASN 162 N 2.46 -1.84 -4.14 2.95 5.03 0.40 -1.46 115.26 118.65 2fjf n ASN 162 Ca -0.17 -1.04 -0.34 0.00 0.87 0.00 0.00 54.58 53.90 2fjf n ASN 162 Cb 0.52 -2.71 -0.01 0.00 -1.02 0.00 0.00 39.78 36.55 2fjf n ASN 162 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2fjf n SER 163 N -2.78 -3.54 0.00 6.41 7.64 -1.26 -1.68 113.62 118.40 2fjf n SER 163 Ca -0.09 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 58.83 2fjf n SER 163 Cb 0.58 -3.05 0.00 0.00 -1.01 0.00 0.00 64.21 60.73 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 -1.50 3.32 0.31 0.23 0.00 -0.54 -4.92 105.19 102.10 2fjf n GLY 164 Ca 0.05 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.26 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 1.06 -3.61 4.61 0.00 -1.37 -3.38 119.26 116.57 2fjf h ALA 165 Ca 0.00 -0.02 -0.68 0.00 0.00 0.00 0.00 54.91 54.21 2fjf h ALA 165 Cb 0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 17.79 17.45 2fjf h ALA 165 CO 0.00 0.02 -0.74 -1.17 0.00 0.00 0.00 179.25 177.37 2fjf s LEU 166 N -6.38 3.71 0.00 0.00 2.96 -1.14 -4.92 118.68 112.91 2fjf s LEU 166 Ca -0.03 -1.29 0.00 0.00 -0.22 0.00 0.00 54.13 52.59 2fjf s LEU 166 Cb 0.12 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 45.15 2fjf s LEU 166 CO 0.49 -0.23 0.00 0.35 -1.32 0.00 0.00 176.35 175.64 2fjf n THR 167 N 4.56 0.00 -2.26 3.68 -2.24 -1.26 -4.07 114.28 112.70 2fjf n THR 167 Ca -0.14 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 2fjf n THR 167 Cb 0.43 -0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 67.78 2fjf n THR 167 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2fjf s SER 168 N -2.96 6.86 0.00 3.42 0.01 -1.26 -3.18 113.70 116.59 2fjf s SER 168 Ca 0.00 2.00 0.00 0.00 1.31 0.00 0.00 55.95 59.26 2fjf s SER 168 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2fjf s SER 168 CO 0.00 -0.75 0.00 0.61 0.41 0.00 0.00 173.24 173.51 2fjf n GLY 169 N 3.69 0.88 3.74 3.44 0.00 -1.26 -4.74 105.19 110.94 2fjf n GLY 169 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.97 4.14 -0.24 1.61 1.01 -1.19 -3.11 120.40 119.65 2fjf s VAL 170 Ca 0.00 1.96 -0.02 0.00 0.00 0.00 0.00 61.98 63.93 2fjf s VAL 170 Cb 0.00 -4.25 0.08 0.00 0.00 0.00 0.00 36.38 32.20 2fjf s VAL 170 CO 0.00 0.39 0.05 -1.00 0.00 0.00 0.00 175.10 174.54 2fjf s HIS 171 N -0.62 1.34 -0.37 5.22 3.76 0.20 -4.98 115.29 119.85 2fjf s HIS 171 Ca 0.45 -1.24 -0.15 0.00 -0.15 0.00 0.00 55.06 53.96 2fjf s HIS 171 Cb -0.26 -1.31 -0.00 0.00 1.11 0.00 0.00 32.58 32.12 2fjf s HIS 171 CO 0.32 -0.73 0.35 0.99 -0.85 0.00 0.00 174.74 174.82 2fjf s THR 172 N 1.75 5.18 0.19 1.30 2.01 -1.26 -1.02 115.64 123.79 2fjf s THR 172 Ca 0.03 -0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 2fjf s THR 172 Cb -0.17 -3.86 -0.08 0.00 0.01 0.00 0.00 72.50 68.40 2fjf s THR 172 CO -0.15 -0.17 1.08 -0.36 -0.69 0.00 0.00 174.62 174.32 2fjf s PHE 173 N 1.94 3.64 0.30 4.92 0.40 0.29 -4.98 117.98 124.49 2fjf s PHE 173 Ca 0.10 1.65 -0.28 0.00 -0.60 0.00 0.00 56.93 57.80 2fjf s PHE 173 Cb -0.17 -3.24 -0.14 0.00 0.51 0.00 0.00 43.02 39.98 2fjf s PHE 173 CO 0.12 -0.45 1.02 -0.35 0.70 0.00 0.00 175.22 176.25 2fjf n PRO 174 N 2.19 1.37 -1.97 0.24 -0.04 -1.26 -4.44 135.00 131.10 2fjf n PRO 174 Ca 0.02 0.48 -0.37 0.00 -0.04 0.00 0.00 63.50 63.59 2fjf n PRO 174 Cb 0.46 -1.86 0.03 0.00 -0.04 0.00 0.00 33.50 32.09 2fjf n PRO 174 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fjf s ALA 175 N -1.07 2.70 -0.02 0.55 0.00 -1.26 -4.86 121.76 117.80 2fjf s ALA 175 Ca 0.59 1.11 0.03 0.00 0.00 0.00 0.00 51.96 53.69 2fjf s ALA 175 Cb -0.69 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 18.92 2fjf s ALA 175 CO 0.60 -1.16 -0.10 0.54 0.00 0.00 0.00 175.76 175.64 2fjf s VAL 176 N -1.48 3.39 -0.27 0.00 0.11 -0.27 -4.97 120.40 116.91 2fjf s VAL 176 Ca 0.73 -0.74 -0.23 0.00 -2.93 0.00 0.00 61.98 58.81 2fjf s VAL 176 Cb -0.34 -2.41 -0.00 0.00 -1.53 0.00 0.00 36.38 32.10 2fjf s VAL 176 CO 0.38 0.49 0.78 -0.22 -3.33 0.00 0.00 175.10 173.21 2fjf s LEU 177 N -1.07 4.08 0.76 2.54 0.20 -1.26 -2.05 118.68 121.87 2fjf s LEU 177 Ca 0.14 0.84 -0.11 0.00 0.69 0.00 0.00 54.13 55.69 2fjf s LEU 177 Cb -0.11 -3.10 0.05 0.00 -0.43 0.00 0.00 46.19 42.60 2fjf s LEU 177 CO 0.04 -0.53 1.10 -1.10 -0.29 0.00 0.00 176.35 175.56 2fjf s GLN 178 N 2.84 2.40 0.44 1.98 -0.21 -0.31 -4.93 119.66 121.87 2fjf s GLN 178 Ca 0.33 0.53 0.09 0.00 0.02 0.00 0.00 55.36 56.33 2fjf s GLN 178 Cb -0.15 -1.96 0.96 0.00 1.00 0.00 0.00 33.01 32.86 2fjf s GLN 178 CO 0.10 -1.37 2.07 0.66 -2.12 0.00 0.00 175.29 174.63 2fjf h SER 179 N -0.90 0.36 0.32 5.90 4.64 -1.97 -0.32 113.55 121.59 2fjf h SER 179 Ca -0.46 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2fjf h SER 179 Cb 1.27 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2fjf h SER 179 CO 0.62 0.26 0.00 -1.54 -0.87 0.00 0.00 176.83 175.30 2fjf n SER 180 N -4.49 0.12 0.00 4.97 3.41 -1.26 -4.85 113.62 111.52 2fjf n SER 180 Ca 0.02 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2fjf n SER 180 Cb 0.09 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 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 -0.59 0.63 3.76 5.00 0.00 -0.13 -5.04 105.19 108.81 2fjf n GLY 181 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 3.78 0.30 0.99 1.02 -1.26 -4.85 118.68 118.67 2fjf s LEU 182 Ca 0.00 0.05 -0.19 0.00 0.02 0.00 0.00 54.13 54.02 2fjf s LEU 182 Cb 0.00 -2.31 -0.09 0.00 0.02 0.00 0.00 46.19 43.81 2fjf s LEU 182 CO 0.00 0.23 0.78 -0.31 0.02 0.00 0.00 176.35 177.08 2fjf s TYR 183 N -1.25 3.49 0.03 0.29 2.02 0.27 -1.16 117.35 121.03 2fjf s TYR 183 Ca 0.25 1.39 0.01 0.00 -0.37 0.00 0.00 57.07 58.35 2fjf s TYR 183 Cb -0.12 -2.65 -0.02 0.00 -0.40 0.00 0.00 41.96 38.77 2fjf s TYR 183 CO 0.17 0.16 -0.06 0.45 -1.57 0.00 0.00 175.55 174.70 2fjf s SER 184 N -1.98 0.58 0.32 2.29 0.15 -0.87 -0.80 113.70 113.38 2fjf s SER 184 Ca 0.51 -0.55 -0.04 0.00 0.70 0.00 0.00 55.95 56.57 2fjf s SER 184 Cb -0.13 0.07 -0.00 0.00 -1.71 0.00 0.00 66.02 64.25 2fjf s SER 184 CO 0.19 -0.26 0.44 -1.48 1.20 0.00 0.00 173.24 173.32 2fjf s LEU 185 N -1.59 0.93 0.00 3.45 0.05 0.82 -1.11 118.68 121.23 2fjf s LEU 185 Ca -0.12 -1.39 0.02 0.00 0.05 0.00 0.00 54.13 52.69 2fjf s LEU 185 Cb -0.09 1.40 -0.01 0.00 -2.05 0.00 0.00 46.19 45.44 2fjf s LEU 185 CO -0.01 -1.23 -0.06 -0.44 -0.55 0.00 0.00 176.35 174.06 2fjf s SER 186 N -3.20 0.73 -0.07 1.48 0.01 -1.26 -0.01 113.70 111.37 2fjf s SER 186 Ca 0.30 -0.18 0.03 0.00 1.31 0.00 0.00 55.95 57.41 2fjf s SER 186 Cb 0.00 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 2fjf s SER 186 CO 0.18 0.03 -0.15 -0.55 0.41 0.00 0.00 173.24 173.16 2fjf s SER 187 N -0.38 3.91 0.02 2.44 0.15 -0.04 -0.54 113.70 119.26 2fjf s SER 187 Ca 0.00 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.39 2fjf s SER 187 Cb -0.04 -1.04 -0.02 0.00 -1.71 0.00 0.00 66.02 63.21 2fjf s SER 187 CO -0.00 0.29 -0.03 0.54 1.20 0.00 0.00 173.24 175.23 2fjf s VAL 188 N -0.38 0.15 -0.05 4.45 0.11 -0.19 0.38 120.40 124.87 2fjf s VAL 188 Ca 0.04 -0.96 -0.05 0.00 -2.93 0.00 0.00 61.98 58.07 2fjf s VAL 188 Cb -0.12 -0.34 0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2fjf s VAL 188 CO 0.02 -0.51 0.14 0.54 -3.33 0.00 0.00 175.10 171.96 2fjf s VAL 189 N -1.55 0.01 -0.08 2.04 0.11 0.25 0.61 120.40 121.78 2fjf s VAL 189 Ca -0.15 -0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2fjf s VAL 189 Cb -0.09 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 2fjf s VAL 189 CO -0.01 -0.05 0.10 0.42 -3.33 0.00 0.00 175.10 172.22 2fjf s THR 190 N -0.12 5.06 0.22 5.04 -4.23 -1.18 -1.07 115.64 119.35 2fjf s THR 190 Ca -0.02 -0.04 -0.10 0.00 -1.18 0.00 0.00 61.69 60.35 2fjf s THR 190 Cb -0.02 -3.22 -0.01 0.00 1.34 0.00 0.00 72.50 70.59 2fjf s THR 190 CO 0.00 0.55 0.36 0.68 -0.54 0.00 0.00 174.62 175.68 2fjf s VAL 191 N -1.04 0.01 0.28 2.29 -7.23 -0.76 -4.72 120.40 109.23 2fjf s VAL 191 Ca 0.17 -1.52 -0.29 0.00 -1.81 0.00 0.00 61.98 58.53 2fjf s VAL 191 Cb -0.12 -2.18 -0.14 0.00 0.56 0.00 0.00 36.38 34.50 2fjf s VAL 191 CO 0.06 -0.06 1.08 -2.65 -0.31 0.00 0.00 175.10 173.22 2fjf n PRO 192 N -0.32 1.44 -0.11 4.82 -0.02 -1.26 -0.93 135.00 138.62 2fjf n PRO 192 Ca -0.02 0.51 -0.06 0.00 -2.02 0.00 0.00 63.50 61.90 2fjf n PRO 192 Cb 0.63 -1.93 0.12 0.00 -0.02 0.00 0.00 33.50 32.29 2fjf n PRO 192 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2fjf h SER 193 N 2.36 0.79 0.32 2.55 0.02 -1.83 -3.11 113.55 114.65 2fjf h SER 193 Ca -0.41 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 2fjf h SER 193 Cb 1.33 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2fjf h SER 193 CO 0.63 0.92 0.00 -1.54 -1.14 0.00 0.00 176.83 175.70 2fjf n SER 194 N -4.16 0.00 -0.28 3.07 3.41 -1.26 -3.23 113.62 111.17 2fjf n SER 194 Ca 0.01 -0.11 0.14 0.00 -0.26 0.00 0.00 58.87 58.66 2fjf n SER 194 Cb 0.37 -0.24 0.60 0.00 -0.26 0.00 0.00 64.21 64.68 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 -1.24 0.93 -4.62 4.04 3.41 -1.17 -4.67 113.62 110.29 2fjf n SER 195 Ca 0.11 -1.11 -0.43 0.00 -0.26 0.00 0.00 58.87 57.17 2fjf n SER 195 Cb 0.15 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.08 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 -2.18 3.88 0.00 1.04 1.43 -1.20 -1.32 118.68 120.33 2fjf s LEU 196 Ca 0.36 0.81 0.00 0.00 -1.03 0.00 0.00 54.13 54.26 2fjf s LEU 196 Cb 0.21 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.95 2fjf s LEU 196 CO 0.40 -0.96 0.00 0.61 0.23 0.00 0.00 176.35 176.63 2fjf n GLY 197 N 4.22 0.33 0.00 -3.19 0.00 -1.26 -4.85 105.19 100.44 2fjf n GLY 197 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.00 0.00 -3.64 2.61 -2.24 -1.14 -5.01 114.28 102.86 2fjf n THR 198 Ca 0.00 -0.40 -0.17 0.00 -2.27 0.00 0.00 64.05 61.20 2fjf n THR 198 Cb 0.00 1.00 -0.15 0.00 -2.10 0.00 0.00 70.33 69.08 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 -0.80 0.06 0.34 -0.78 -0.44 -0.43 -5.08 119.66 112.53 2fjf s GLN 199 Ca 0.00 0.48 -0.27 0.00 -2.50 0.00 0.00 55.36 53.08 2fjf s GLN 199 Cb 0.00 -0.48 -0.09 0.00 -1.64 0.00 0.00 33.01 30.79 2fjf s GLN 199 CO 0.00 -0.38 1.09 0.95 0.50 0.00 0.00 175.29 177.45 2fjf s THR 200 N 2.30 3.54 -0.21 -0.34 -4.23 -1.26 -4.69 115.64 110.74 2fjf s THR 200 Ca 0.03 1.37 0.01 0.00 -1.18 0.00 0.00 61.69 61.93 2fjf s THR 200 Cb -0.13 -3.81 0.04 0.00 1.34 0.00 0.00 72.50 69.95 2fjf s THR 200 CO -0.07 0.20 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.78 2fjf s TYR 201 N -1.38 2.62 -0.17 3.99 2.02 -1.26 -5.03 117.35 118.14 2fjf s TYR 201 Ca 0.51 -1.73 -0.04 0.00 -0.37 0.00 0.00 57.07 55.43 2fjf s TYR 201 Cb -0.28 -1.73 -0.03 0.00 -0.40 0.00 0.00 41.96 39.52 2fjf s TYR 201 CO 0.36 -0.78 -0.02 0.42 -1.57 0.00 0.00 175.55 173.96 2fjf s ILE 202 N 1.33 4.03 -0.15 2.71 1.01 -1.26 -0.34 121.20 128.53 2fjf s ILE 202 Ca -0.02 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 2fjf s ILE 202 Cb -0.16 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 2fjf s ILE 202 CO -0.08 0.48 0.30 0.00 0.00 0.00 0.00 174.94 175.63 2fjf s ASN 204 N 0.38 5.46 -0.23 0.00 -0.87 0.13 -1.16 114.94 118.65 2fjf s ASN 204 Ca 0.17 -1.76 -0.09 0.00 -1.57 0.00 0.00 52.86 49.61 2fjf s ASN 204 Cb -0.13 -1.91 -0.05 0.00 -0.02 0.00 0.00 41.25 39.14 2fjf s ASN 204 CO 0.04 -0.55 0.13 -0.69 -2.57 0.00 0.00 177.10 173.46 2fjf s VAL 205 N 1.30 5.09 -0.04 1.60 1.01 0.13 -1.68 120.40 127.81 2fjf s VAL 205 Ca 0.05 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.16 2fjf s VAL 205 Cb -0.23 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 2fjf s VAL 205 CO -0.01 0.36 -0.19 0.20 0.00 0.00 0.00 175.10 175.46 2fjf s ASN 206 N 1.03 2.36 -0.32 3.32 -0.87 0.22 -0.73 114.94 119.95 2fjf s ASN 206 Ca 0.06 -0.38 -0.00 0.00 -1.57 0.00 0.00 52.86 50.97 2fjf s ASN 206 Cb -0.14 -0.57 0.10 0.00 -0.02 0.00 0.00 41.25 40.62 2fjf s ASN 206 CO 0.04 0.19 0.10 -2.28 -2.57 0.00 0.00 177.10 172.58 2fjf s HIS 207 N -0.10 1.90 0.09 2.20 2.46 -0.54 0.30 115.29 121.60 2fjf s HIS 207 Ca -0.01 -1.90 -0.22 0.00 0.47 0.00 0.00 55.06 53.40 2fjf s HIS 207 Cb -0.11 -1.83 -0.12 0.00 -0.13 0.00 0.00 32.58 30.38 2fjf s HIS 207 CO 0.02 -0.88 1.67 0.87 -2.47 0.00 0.00 174.74 173.95 2fjf h LYS 208 N 7.94 0.12 -1.10 2.88 1.57 -1.82 -2.15 116.57 124.02 2fjf h LYS 208 Ca -0.12 -0.01 0.30 0.00 -1.87 0.00 0.00 60.65 58.95 2fjf h LYS 208 Cb 1.01 -0.02 -0.09 0.00 0.08 0.00 0.00 32.23 33.21 2fjf h LYS 208 CO 0.48 0.17 0.73 -1.35 -0.57 0.00 0.00 179.45 178.90 2fjf h PRO 209 N 0.04 0.27 -0.44 3.15 0.11 -1.92 -0.36 132.00 132.85 2fjf h PRO 209 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2fjf h PRO 209 Cb 0.08 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.13 2fjf h PRO 209 CO -0.00 0.18 0.00 -1.13 -0.21 0.00 0.00 178.00 176.83 2fjf n SER 210 N -4.54 3.38 -3.51 -2.05 3.41 -1.16 -4.93 113.62 104.21 2fjf n SER 210 Ca 0.27 -1.95 -0.26 0.00 -0.26 0.00 0.00 58.87 56.66 2fjf n SER 210 Cb 1.01 -0.29 0.01 0.00 -0.26 0.00 0.00 64.21 64.69 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 1.29 -4.62 -4.69 4.04 5.15 -0.14 -4.85 115.26 111.43 2fjf n ASN 211 Ca 0.18 -0.52 -0.37 0.00 -0.60 0.00 0.00 54.58 53.28 2fjf n ASN 211 Cb 0.55 -3.75 -0.08 0.00 -0.53 0.00 0.00 39.78 35.97 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 -3.12 5.33 -0.10 -0.44 2.01 -0.83 -5.02 115.64 113.47 2fjf s THR 212 Ca 0.49 0.34 -0.01 0.00 0.31 0.00 0.00 61.69 62.82 2fjf s THR 212 Cb -0.25 -3.56 0.03 0.00 0.01 0.00 0.00 72.50 68.73 2fjf s THR 212 CO 0.60 0.35 -0.05 -0.75 -0.69 0.00 0.00 174.62 174.08 2fjf s LYS 213 N 0.89 1.22 -0.04 4.92 2.20 -1.26 -1.46 119.74 126.21 2fjf s LYS 213 Ca 0.11 -0.14 0.05 0.00 -0.36 0.00 0.00 55.97 55.64 2fjf s LYS 213 Cb -0.13 -1.37 -0.01 0.00 -1.51 0.00 0.00 37.83 34.82 2fjf s LYS 213 CO 0.04 -0.27 -0.19 0.08 -0.36 0.00 0.00 175.35 174.65 2fjf s VAL 214 N 1.75 1.55 -0.13 4.02 1.01 0.09 -5.01 120.40 123.67 2fjf s VAL 214 Ca 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2fjf s VAL 214 Cb -0.13 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.96 2fjf s VAL 214 CO -0.07 0.44 -0.16 -1.81 0.00 0.00 0.00 175.10 173.51 2fjf s ASP 215 N -0.13 2.64 -0.18 3.32 1.01 -1.26 0.23 116.67 122.30 2fjf s ASP 215 Ca -0.01 -0.48 0.01 0.00 0.71 0.00 0.00 52.55 52.78 2fjf s ASP 215 Cb -0.11 -1.18 0.03 0.00 1.01 0.00 0.00 42.92 42.68 2fjf s ASP 215 CO 0.02 -0.01 -0.12 -0.75 0.21 0.00 0.00 175.17 174.51 2fjf s LYS 216 N 1.22 2.15 0.08 8.23 2.20 -0.31 -4.94 119.74 128.37 2fjf s LYS 216 Ca -0.01 -0.72 -0.31 0.00 -0.36 0.00 0.00 55.97 54.57 2fjf s LYS 216 Cb -0.14 -2.29 -0.08 0.00 -1.51 0.00 0.00 37.83 33.81 2fjf s LYS 216 CO -0.06 -0.35 1.54 0.21 -0.36 0.00 0.00 175.35 176.33 2fjf s LYS 217 N 1.43 4.24 -0.22 4.03 2.20 -1.26 -1.13 119.74 129.03 2fjf s LYS 217 Ca 0.01 2.23 -0.04 0.00 -0.36 0.00 0.00 55.97 57.81 2fjf s LYS 217 Cb -0.15 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2fjf s LYS 217 CO -0.09 -0.63 -0.03 0.08 -0.36 0.00 0.00 175.35 174.32 2fjf s VAL 218 N 2.01 3.52 0.06 4.02 1.01 0.54 -4.94 120.40 126.63 2fjf s VAL 218 Ca 0.70 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 2fjf s VAL 218 Cb -0.39 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 2fjf s VAL 218 CO 0.31 0.42 0.09 -1.83 0.00 0.00 0.00 175.10 174.08 2fjf s GLU 219 N 1.40 0.70 0.34 2.72 -1.05 -1.26 -4.14 118.70 117.41 2fjf s GLU 219 Ca 0.05 -1.00 -0.28 0.00 -0.15 0.00 0.00 54.97 53.59 2fjf s GLU 219 Cb -0.14 0.27 -0.12 0.00 -0.44 0.00 0.00 34.13 33.69 2fjf s GLU 219 CO -0.02 -0.18 1.36 -2.30 0.95 0.00 0.00 175.26 175.07 2fjf n PRO 220 N 0.21 2.28 -0.27 -4.83 -0.02 -1.26 -4.69 135.00 126.42 2fjf n PRO 220 Ca -0.16 0.80 -0.01 0.00 -2.02 0.00 0.00 63.50 62.11 2fjf n PRO 220 Cb 0.61 -2.43 0.01 0.00 -0.02 0.00 0.00 33.50 31.66 2fjf n PRO 220 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2fjf n LYS 221 N 0.72 0.12 -0.05 -0.52 4.01 -1.26 -5.03 118.16 116.16 2fjf n LYS 221 Ca 0.05 -0.11 -0.14 0.00 -0.51 0.00 0.00 58.31 57.60 2fjf n LYS 221 Cb 0.36 -0.06 -0.08 0.00 -0.51 0.00 0.00 35.03 34.75 2fjf n LYS 221 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 2fjf h SER 222 N -0.07 0.37 0.00 4.39 0.02 -2.01 -3.54 113.55 112.71 2fjf h SER 222 Ca -0.02 -0.53 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2fjf h SER 222 Cb 0.06 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2fjf h SER 222 CO 0.02 0.83 0.00 0.00 -1.14 0.00 0.00 176.83 176.53