#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gcf n SER 2 N 0.00 0.00 -3.17 1.61 3.41 -1.26 -4.68 113.62 109.53 1gcf n SER 2 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.56 1gcf n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1gcf n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1gcf s SER 3 N 0.00 -0.79 0.04 4.04 0.15 -1.26 -5.11 113.70 110.77 1gcf s SER 3 Ca 0.00 -1.23 -0.30 0.00 0.70 0.00 0.00 55.95 55.12 1gcf s SER 3 Cb 0.00 1.54 -0.09 0.00 -1.71 0.00 0.00 66.02 65.76 1gcf s SER 3 CO 0.00 -0.17 1.96 -0.76 1.20 0.00 0.00 173.24 175.48 1gcf s LEU 4 N 1.51 4.43 0.00 3.45 2.01 -1.26 -4.87 118.68 123.95 1gcf s LEU 4 Ca 0.19 2.68 0.00 0.00 0.01 0.00 0.00 54.13 57.01 1gcf s LEU 4 Cb -0.06 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.61 1gcf s LEU 4 CO -0.06 -1.05 0.00 -0.62 1.01 0.00 0.00 176.35 175.63 1gcf n GLU 5 N 7.48 -1.80 -1.72 1.70 1.02 -1.26 -5.15 120.64 120.91 1gcf n GLU 5 Ca 0.20 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.04 1gcf n GLU 5 Cb 0.41 0.00 0.22 0.00 -0.02 0.00 0.00 31.44 32.05 1gcf n GLU 5 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1gcf s PRO 6 N -2.00 -0.14 0.47 3.49 0.04 -1.26 -5.02 135.00 130.58 1gcf s PRO 6 Ca 0.00 -0.44 -0.22 0.00 0.04 0.00 0.00 61.00 60.37 1gcf s PRO 6 Cb 0.00 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.71 1gcf s PRO 6 CO 0.00 -2.93 1.16 -1.25 0.04 0.00 0.00 177.00 174.01 1gcf s PRO 7 N -5.85 3.71 0.00 0.56 0.04 -1.26 -5.01 135.00 127.19 1gcf s PRO 7 Ca 0.75 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1gcf s PRO 7 Cb -0.04 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1gcf s PRO 7 CO 0.54 -0.58 0.00 -1.33 0.04 0.00 0.00 177.00 175.67 1gcf n MET 8 N -0.59 0.00 -4.15 4.56 2.81 -0.91 -4.86 117.12 113.98 1gcf n MET 8 Ca 0.08 0.00 -0.29 0.00 -1.81 0.00 0.00 57.70 55.67 1gcf n MET 8 Cb 0.48 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.83 1gcf n MET 8 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 1gcf s LEU 9 N 0.00 1.66 0.44 4.03 1.98 -1.26 -1.90 118.68 123.62 1gcf s LEU 9 Ca 0.00 -0.46 0.03 0.00 -2.89 0.00 0.00 54.13 50.82 1gcf s LEU 9 Cb 0.00 -1.13 -0.02 0.00 0.66 0.00 0.00 46.19 45.70 1gcf s LEU 9 CO 0.00 -0.04 0.10 0.00 -1.89 0.00 0.00 176.35 174.52 1gcf s GLN 10 N 1.35 2.01 0.00 1.98 -2.07 -1.11 -4.69 119.66 117.13 1gcf s GLN 10 Ca 0.01 -2.24 0.00 0.00 -1.82 0.00 0.00 55.36 51.31 1gcf s GLN 10 Cb -0.13 -0.85 0.00 0.00 -1.09 0.00 0.00 33.01 30.93 1gcf s GLN 10 CO -0.08 -0.45 0.00 0.00 -1.32 0.00 0.00 175.29 173.44 1gcf n ALA 11 N -1.01 0.00 -2.85 2.60 0.00 -1.26 -2.53 120.51 115.47 1gcf n ALA 11 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.21 1gcf n ALA 11 Cb 0.65 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.99 1gcf n ALA 11 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1gcf s LEU 12 N 0.00 2.24 0.08 0.00 0.20 0.17 -4.12 118.68 117.25 1gcf s LEU 12 Ca 0.00 -0.52 -0.30 0.00 0.69 0.00 0.00 54.13 54.00 1gcf s LEU 12 Cb 0.00 -0.19 -0.06 0.00 -0.43 0.00 0.00 46.19 45.51 1gcf s LEU 12 CO 0.00 -0.18 1.13 -1.81 -0.29 0.00 0.00 176.35 175.21 1gcf s ASP 13 N -1.47 7.18 0.18 3.68 1.01 -1.26 -4.77 116.67 121.23 1gcf s ASP 13 Ca -0.09 1.97 -0.00 0.00 0.71 0.00 0.00 52.55 55.14 1gcf s ASP 13 Cb -0.09 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.21 1gcf s ASP 13 CO 0.00 -0.36 0.07 -0.63 0.21 0.00 0.00 175.17 174.46 1gcf s ILE 14 N 0.71 0.28 0.00 0.77 -1.09 -1.26 -5.04 121.20 115.56 1gcf s ILE 14 Ca 0.55 -1.97 0.00 0.00 -2.23 0.00 0.00 60.65 57.00 1gcf s ILE 14 Cb -0.28 -2.30 0.00 0.00 -1.58 0.00 0.00 42.46 38.30 1gcf s ILE 14 CO 0.30 -0.25 0.00 0.61 -1.23 0.00 0.00 174.94 174.37 1gcf n GLY 15 N -0.24 4.88 0.11 6.18 0.00 -1.26 -5.01 105.19 109.84 1gcf n GLY 15 Ca -0.03 -1.31 -0.01 0.00 0.00 0.00 0.00 46.02 44.67 1gcf n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gcf h PRO 16 N 0.00 0.00 0.02 1.61 0.13 -2.03 -3.34 132.00 128.39 1gcf h PRO 16 Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.93 1gcf h PRO 16 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1gcf h PRO 16 CO 0.00 0.69 -1.07 0.22 -0.23 0.00 0.00 178.00 177.61 1gcf h ASP 17 N 0.00 0.05 -6.95 1.44 1.82 -2.01 -3.48 116.42 107.29 1gcf h ASP 17 Ca -0.01 -0.65 -0.59 0.00 -0.39 0.00 0.00 57.03 55.39 1gcf h ASP 17 Cb 1.45 -0.02 -0.13 0.00 0.68 0.00 0.00 39.33 41.31 1gcf h ASP 17 CO 0.09 1.43 -0.97 0.55 -1.61 0.00 0.00 179.24 178.73 1gcf n VAL 18 N -4.38 -1.90 0.00 2.25 3.14 -1.26 -3.56 118.33 112.63 1gcf n VAL 18 Ca -0.27 -0.55 0.00 0.00 -2.96 0.00 0.00 64.34 60.56 1gcf n VAL 18 Cb 0.68 -1.67 0.00 0.00 -1.06 0.00 0.00 33.84 31.79 1gcf n VAL 18 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1gcf n VAL 19 N -4.69 0.00 -3.15 1.55 0.31 -1.26 -4.23 118.33 106.86 1gcf n VAL 19 Ca -0.26 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.12 1gcf n VAL 19 Cb 0.66 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.58 1gcf n VAL 19 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1gcf s SER 20 N -4.00 -0.67 0.00 4.52 0.01 -1.23 -5.16 113.70 107.17 1gcf s SER 20 Ca 0.00 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.42 1gcf s SER 20 Cb 0.00 1.45 0.00 0.00 0.21 0.00 0.00 66.02 67.68 1gcf s SER 20 CO 0.00 -0.12 0.00 1.57 0.41 0.00 0.00 173.24 175.10 1gcf n HIS 21 N 5.25 0.00 -2.71 2.43 -0.00 -1.26 -5.16 115.22 113.78 1gcf n HIS 21 Ca 0.05 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.94 1gcf n HIS 21 Cb 0.56 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.42 1gcf n HIS 21 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 1gcf s GLN 22 N 2.79 3.64 -0.03 1.57 -0.21 -1.26 -4.95 119.66 121.21 1gcf s GLN 22 Ca 0.00 0.32 0.00 0.00 0.02 0.00 0.00 55.36 55.70 1gcf s GLN 22 Cb 0.00 -2.38 0.03 0.00 1.00 0.00 0.00 33.01 31.67 1gcf s GLN 22 CO 0.00 -0.14 1.61 -0.35 -2.12 0.00 0.00 175.29 174.29 1gcf n PRO 23 N -1.87 1.09 -2.69 2.91 -0.04 -1.26 -4.30 135.00 128.84 1gcf n PRO 23 Ca 0.01 -0.19 -0.04 0.00 -0.04 0.00 0.00 63.50 63.24 1gcf n PRO 23 Cb 0.55 -1.08 0.05 0.00 -0.04 0.00 0.00 33.50 32.98 1gcf n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gcf n GLY 24 N 0.96 -1.38 2.57 0.55 0.00 -1.26 -4.67 105.19 101.97 1gcf n GLY 24 Ca 0.04 0.96 -0.16 0.00 0.00 0.00 0.00 46.02 46.86 1gcf n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gcf s LEU 26 N 0.00 2.10 -0.06 0.00 1.43 -0.14 -3.80 118.68 118.21 1gcf s LEU 26 Ca 0.32 -1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 52.25 1gcf s LEU 26 Cb 0.02 0.09 0.04 0.00 0.03 0.00 0.00 46.19 46.36 1gcf s LEU 26 CO 0.23 -0.61 0.09 0.26 0.23 0.00 0.00 176.35 176.55 1gcf s TRP 27 N -3.81 0.00 0.21 0.29 0.51 -1.26 -2.62 118.94 112.27 1gcf s TRP 27 Ca 0.20 0.32 0.02 0.00 -2.12 0.00 0.00 56.10 54.52 1gcf s TRP 27 Cb 0.07 -0.43 0.02 0.00 -0.81 0.00 0.00 33.47 32.31 1gcf s TRP 27 CO 0.00 -0.24 0.17 1.28 -0.51 0.00 0.00 176.95 177.66 1gcf n LEU 28 N 5.31 0.00 0.00 2.99 4.77 -0.46 0.43 117.00 130.03 1gcf n LEU 28 Ca -0.04 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 54.88 1gcf n LEU 28 Cb 0.50 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1gcf n LEU 28 CO 0.06 -0.40 0.00 -1.54 -1.33 0.00 0.00 177.39 174.17 1gcf n SER 29 N -2.04 0.00 -4.01 -1.43 3.41 -1.05 -1.34 113.62 107.16 1gcf n SER 29 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1gcf n SER 29 Cb 0.24 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.09 1gcf n SER 29 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1gcf s TRP 30 N 0.00 1.41 -0.30 7.33 -2.14 -1.21 -2.74 118.94 121.29 1gcf s TRP 30 Ca 0.00 -1.41 -0.06 0.00 2.66 0.00 0.00 56.10 57.29 1gcf s TRP 30 Cb 0.00 -0.69 0.17 0.00 -3.10 0.00 0.00 33.47 29.85 1gcf s TRP 30 CO 0.00 -0.63 0.68 0.21 -2.66 0.00 0.00 176.95 174.55 1gcf s LYS 31 N -3.94 0.52 0.00 3.25 2.20 -0.80 -3.03 119.74 117.95 1gcf s LYS 31 Ca 0.39 1.08 0.00 0.00 -0.36 0.00 0.00 55.97 57.07 1gcf s LYS 31 Cb 0.06 0.62 0.00 0.00 -1.51 0.00 0.00 37.83 37.00 1gcf s LYS 31 CO 0.16 -0.42 0.00 -0.35 -0.36 0.00 0.00 175.35 174.39 1gcf n PRO 32 N 5.41 1.41 0.00 4.03 -0.04 -1.25 -2.14 135.00 142.41 1gcf n PRO 32 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1gcf n PRO 32 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 1gcf n PRO 32 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1gcf n TRP 33 N -0.10 0.00 -0.29 0.54 4.27 -1.26 -4.77 117.44 115.83 1gcf n TRP 33 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1gcf n TRP 33 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1gcf n TRP 33 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1gcf n LYS 34 N 0.00 0.00 -0.71 -2.67 5.02 -1.26 -5.06 118.16 113.48 1gcf n LYS 34 Ca 0.00 0.10 -0.12 0.00 -2.02 0.00 0.00 58.31 56.27 1gcf n LYS 34 Cb 0.00 -0.19 0.09 0.00 -0.02 0.00 0.00 35.03 34.90 1gcf n LYS 34 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1gcf n PRO 35 N 0.37 -0.78 -2.61 1.97 -0.04 -1.26 -4.94 135.00 127.71 1gcf n PRO 35 Ca 0.00 -0.82 -0.41 0.00 -0.04 0.00 0.00 63.50 62.23 1gcf n PRO 35 Cb 0.00 -0.58 -0.03 0.00 -0.04 0.00 0.00 33.50 32.85 1gcf n PRO 35 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1gcf s SER 36 N -2.94 6.31 0.00 3.54 1.04 -1.26 -4.56 113.70 115.83 1gcf s SER 36 Ca 0.30 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.77 1gcf s SER 36 Cb -0.01 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1gcf s SER 36 CO 0.22 -1.63 0.00 1.21 0.98 0.00 0.00 173.24 174.02 1gcf n GLU 37 N 8.83 0.00 -3.27 4.02 4.07 -1.26 -5.17 120.64 127.87 1gcf n GLU 37 Ca 0.14 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 57.11 1gcf n GLU 37 Cb 0.49 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.83 1gcf n GLU 37 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1gcf n TYR 38 N -1.73 -0.11 -2.73 4.31 0.18 -1.26 -5.09 117.16 110.74 1gcf n TYR 38 Ca 0.00 -1.45 -0.03 0.00 1.88 0.00 0.00 57.90 58.29 1gcf n TYR 38 Cb 0.00 0.05 0.09 0.00 -0.38 0.00 0.00 39.34 39.10 1gcf n TYR 38 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 1gcf n MET 39 N -0.44 1.41 -3.54 -3.48 2.81 -1.26 -4.98 117.12 107.65 1gcf n MET 39 Ca -0.01 -2.32 -0.40 0.00 -1.81 0.00 0.00 57.70 53.17 1gcf n MET 39 Cb 0.33 -0.52 -0.05 0.00 -0.71 0.00 0.00 33.22 32.27 1gcf n MET 39 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1gcf s GLU 40 N -1.54 3.41 0.00 0.03 2.12 -1.26 -4.99 118.70 116.48 1gcf s GLU 40 Ca 0.19 -3.01 0.00 0.00 0.36 0.00 0.00 54.97 52.51 1gcf s GLU 40 Cb 0.40 -4.12 0.00 0.00 0.26 0.00 0.00 34.13 30.67 1gcf s GLU 40 CO -0.07 -1.25 0.00 1.04 -0.54 0.00 0.00 175.26 174.44 1gcf n GLN 41 N 2.86 0.00 -3.60 4.30 1.13 -1.26 -3.86 117.38 116.95 1gcf n GLN 41 Ca 0.18 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 55.16 1gcf n GLN 41 Cb 0.39 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.69 1gcf n GLN 41 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1gcf s GLU 42 N 1.18 0.45 0.11 -1.09 2.56 -1.14 -4.55 118.70 116.21 1gcf s GLU 42 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 54.97 55.07 1gcf s GLU 42 Cb 0.00 0.21 -0.01 0.00 2.00 0.00 0.00 34.13 36.33 1gcf s GLU 42 CO 0.00 -0.13 0.17 0.00 -0.56 0.00 0.00 175.26 174.74 1gcf s GLU 44 N -3.93 0.46 0.06 0.00 -1.05 -0.98 -1.55 118.70 111.70 1gcf s GLU 44 Ca 0.12 -0.73 0.04 0.00 -0.15 0.00 0.00 54.97 54.25 1gcf s GLU 44 Cb 0.05 -0.14 -0.04 0.00 -0.44 0.00 0.00 34.13 33.56 1gcf s GLU 44 CO -0.06 0.01 -0.03 -1.17 0.95 0.00 0.00 175.26 174.97 1gcf s LEU 45 N -1.60 3.36 -0.06 1.83 2.96 -0.96 -2.66 118.68 121.55 1gcf s LEU 45 Ca -0.11 -0.16 0.06 0.00 -0.22 0.00 0.00 54.13 53.70 1gcf s LEU 45 Cb -0.09 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 1gcf s LEU 45 CO -0.00 0.22 -0.25 -0.60 -1.32 0.00 0.00 176.35 174.40 1gcf s ARG 46 N -1.97 2.61 -0.16 1.98 3.52 -1.17 -1.09 118.95 122.68 1gcf s ARG 46 Ca 0.22 -0.90 -0.07 0.00 -0.13 0.00 0.00 55.73 54.85 1gcf s ARG 46 Cb -0.11 -2.18 0.07 0.00 -1.56 0.00 0.00 34.95 31.16 1gcf s ARG 46 CO 0.14 0.36 0.35 1.52 -0.81 0.00 0.00 175.30 176.86 1gcf s TYR 47 N -0.11 -0.58 0.13 5.12 -0.85 -0.83 -1.40 117.35 118.83 1gcf s TYR 47 Ca -0.05 1.21 0.09 0.00 -0.52 0.00 0.00 57.07 57.80 1gcf s TYR 47 Cb -0.14 0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.33 1gcf s TYR 47 CO 0.04 -0.37 -0.22 1.14 -1.52 0.00 0.00 175.55 174.62 1gcf s GLN 48 N 1.99 1.25 -0.28 -3.49 -2.07 -0.69 -2.32 119.66 114.05 1gcf s GLN 48 Ca -0.05 -1.29 -0.29 0.00 -1.82 0.00 0.00 55.36 51.92 1gcf s GLN 48 Cb -0.11 -1.52 0.01 0.00 -1.09 0.00 0.00 33.01 30.30 1gcf s GLN 48 CO -0.11 0.34 1.18 -1.25 -1.32 0.00 0.00 175.29 174.13 1gcf s PRO 49 N -2.21 4.06 -0.71 9.60 0.04 -1.26 -1.46 135.00 143.05 1gcf s PRO 49 Ca 0.11 1.25 -0.26 0.00 0.04 0.00 0.00 61.00 62.14 1gcf s PRO 49 Cb -0.09 -3.78 0.04 0.00 0.04 0.00 0.00 34.50 30.71 1gcf s PRO 49 CO 0.06 -0.92 1.18 -1.14 0.04 0.00 0.00 177.00 176.22 1gcf s GLN 50 N 3.76 3.17 0.00 4.56 0.74 0.13 -4.64 119.66 127.38 1gcf s GLN 50 Ca 0.50 -0.41 0.00 0.00 0.05 0.00 0.00 55.36 55.51 1gcf s GLN 50 Cb -0.15 -4.19 0.00 0.00 1.10 0.00 0.00 33.01 29.77 1gcf s GLN 50 CO 0.17 -2.04 0.00 1.47 -0.55 0.00 0.00 175.29 174.34 1gcf n LEU 51 N 8.87 0.00 -0.06 3.68 -0.00 -1.26 -3.16 117.00 125.07 1gcf n LEU 51 Ca 0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.91 1gcf n LEU 51 Cb 0.48 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.82 1gcf n LEU 51 CO 0.69 0.00 0.50 0.11 -0.00 0.00 0.00 177.39 178.69 1gcf h LYS 52 N 0.00 -0.36 0.00 1.47 6.56 -1.94 -3.45 116.57 118.85 1gcf h LYS 52 Ca 0.00 0.02 -0.46 0.00 -1.06 0.00 0.00 60.65 59.15 1gcf h LYS 52 Cb 0.00 0.08 -0.12 0.00 -0.57 0.00 0.00 32.23 31.62 1gcf h LYS 52 CO 0.00 -0.24 -0.45 0.41 -2.06 0.00 0.00 179.45 177.11 1gcf n GLY 53 N -1.30 2.93 3.61 3.86 0.00 -1.26 -5.18 105.19 107.84 1gcf n GLY 53 Ca -0.04 -1.88 -0.02 0.00 0.00 0.00 0.00 46.02 44.08 1gcf n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gcf s ALA 54 N -3.31 -2.10 0.00 4.61 0.00 -1.26 -4.88 121.76 114.82 1gcf s ALA 54 Ca 0.39 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1gcf s ALA 54 Cb 0.02 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.25 1gcf s ALA 54 CO 0.27 -0.78 0.75 -1.71 0.00 0.00 0.00 175.76 174.29 1gcf n ASN 55 N -0.25 1.48 -1.60 0.00 2.85 -1.26 -5.08 115.26 111.40 1gcf n ASN 55 Ca -0.03 -1.50 0.00 0.00 -0.11 0.00 0.00 54.58 52.93 1gcf n ASN 55 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 1gcf n ASN 55 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 1gcf n TRP 56 N -0.25 -4.28 -4.40 1.20 7.02 -1.26 -5.01 117.44 110.46 1gcf n TRP 56 Ca 0.00 2.25 -0.28 0.00 -1.02 0.00 0.00 57.50 58.45 1gcf n TRP 56 Cb 0.13 -3.45 -0.12 0.00 -2.42 0.00 0.00 31.31 25.45 1gcf n TRP 56 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1gcf s THR 57 N -2.70 2.31 0.36 -0.99 2.01 -0.98 -4.97 115.64 110.69 1gcf s THR 57 Ca 0.00 -1.87 0.07 0.00 0.31 0.00 0.00 61.69 60.20 1gcf s THR 57 Cb 0.00 -2.06 -0.07 0.00 0.01 0.00 0.00 72.50 70.38 1gcf s THR 57 CO 0.00 0.00 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.15 1gcf s LEU 58 N -2.32 2.70 0.00 4.42 1.43 -1.26 -1.97 118.68 121.68 1gcf s LEU 58 Ca 0.17 -1.30 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 1gcf s LEU 58 Cb -0.09 -0.83 -0.00 0.00 0.03 0.00 0.00 46.19 45.29 1gcf s LEU 58 CO 0.08 -0.38 -0.01 -0.69 0.23 0.00 0.00 176.35 175.58 1gcf s VAL 59 N -2.79 0.03 0.00 -1.59 1.01 -0.25 -4.97 120.40 111.84 1gcf s VAL 59 Ca 0.34 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1gcf s VAL 59 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.38 1gcf s VAL 59 CO 0.16 -0.10 0.00 0.49 0.00 0.00 0.00 175.10 175.66 1gcf n PHE 60 N 2.78 0.00 -2.19 5.22 3.72 -1.26 -2.26 117.46 123.46 1gcf n PHE 60 Ca -0.14 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.23 1gcf n PHE 60 Cb 0.59 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.13 1gcf n PHE 60 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 1gcf n HIS 61 N 0.00 -1.68 -3.27 1.38 1.44 -1.26 -4.86 115.22 106.98 1gcf n HIS 61 Ca 0.00 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.34 1gcf n HIS 61 Cb 0.00 -1.33 -0.06 0.00 0.12 0.00 0.00 29.99 28.72 1gcf n HIS 61 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1gcf s LEU 62 N -4.54 4.43 0.10 2.39 2.96 -0.60 -4.97 118.68 118.46 1gcf s LEU 62 Ca 0.00 1.23 -0.30 0.00 -0.22 0.00 0.00 54.13 54.84 1gcf s LEU 62 Cb 0.00 -3.15 -0.05 0.00 0.50 0.00 0.00 46.19 43.49 1gcf s LEU 62 CO 0.00 0.17 0.98 -2.16 -1.32 0.00 0.00 176.35 174.03 1gcf s PRO 63 N -1.56 4.66 0.60 0.98 0.04 -1.26 -1.87 135.00 136.59 1gcf s PRO 63 Ca 0.34 1.48 0.30 0.00 0.04 0.00 0.00 61.00 63.16 1gcf s PRO 63 Cb -0.17 -3.38 1.21 0.00 0.04 0.00 0.00 34.50 32.20 1gcf s PRO 63 CO 0.20 0.14 1.56 0.66 0.04 0.00 0.00 177.00 179.60 1gcf h SER 64 N 5.78 0.00 -3.25 6.66 4.64 -1.90 -3.32 113.55 122.16 1gcf h SER 64 Ca -0.43 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.43 1gcf h SER 64 Cb 1.21 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.92 1gcf h SER 64 CO 0.73 0.00 -0.77 -0.94 -0.87 0.00 0.00 176.83 174.98 1gcf s SER 65 N -4.19 1.96 -0.06 4.97 1.04 -1.26 -3.88 113.70 112.27 1gcf s SER 65 Ca -0.03 -0.29 -0.02 0.00 0.48 0.00 0.00 55.95 56.09 1gcf s SER 65 Cb 0.16 -0.50 -0.04 0.00 0.10 0.00 0.00 66.02 65.74 1gcf s SER 65 CO 0.54 -0.22 0.05 -0.75 0.98 0.00 0.00 173.24 173.84 1gcf s LYS 66 N 1.93 3.07 -0.02 4.02 2.47 -1.17 -5.00 119.74 125.04 1gcf s LYS 66 Ca 0.03 -0.40 -0.03 0.00 -1.56 0.00 0.00 55.97 54.01 1gcf s LYS 66 Cb -0.13 -2.87 -0.02 0.00 -1.46 0.00 0.00 37.83 33.35 1gcf s LYS 66 CO -0.06 0.69 0.27 0.22 0.16 0.00 0.00 175.35 176.63 1gcf h ASP 67 N 4.71 -0.09 -2.24 1.43 3.58 -1.89 -3.20 116.42 118.72 1gcf h ASP 67 Ca -0.51 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.37 1gcf h ASP 67 Cb 1.19 0.02 -0.38 0.00 1.72 0.00 0.00 39.33 41.89 1gcf h ASP 67 CO 0.58 0.07 -1.02 0.00 -2.88 0.00 0.00 179.24 175.99 1gcf n GLN 68 N -3.04 0.34 -1.32 0.28 10.64 -1.26 -4.47 117.38 118.56 1gcf n GLN 68 Ca -0.01 -3.18 -0.40 0.00 -1.83 0.00 0.00 57.00 51.58 1gcf n GLN 68 Cb 0.04 -1.53 0.01 0.00 -0.86 0.00 0.00 30.24 27.91 1gcf n GLN 68 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1gcf n PHE 69 N 2.40 -2.12 -3.60 2.61 -0.00 -0.45 -4.57 117.46 111.73 1gcf n PHE 69 Ca 0.27 0.50 -0.29 0.00 -0.00 0.00 0.00 57.45 57.92 1gcf n PHE 69 Cb 0.50 -1.78 -0.14 0.00 -0.00 0.00 0.00 39.48 38.05 1gcf n PHE 69 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.76 174.76 1gcf s GLU 70 N -1.26 0.47 -0.05 -4.13 -6.30 -1.26 -1.36 118.70 104.80 1gcf s GLU 70 Ca 0.60 -0.91 0.00 0.00 -2.50 0.00 0.00 54.97 52.17 1gcf s GLU 70 Cb -0.52 -1.51 -0.03 0.00 0.00 0.00 0.00 34.13 32.07 1gcf s GLU 70 CO 0.62 -1.05 -0.04 -1.17 0.02 0.00 0.00 175.26 173.65 1gcf s LEU 71 N 1.69 3.33 0.21 2.70 2.96 -1.08 -4.95 118.68 123.54 1gcf s LEU 71 Ca 0.11 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 1gcf s LEU 71 Cb -0.18 -1.79 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 1gcf s LEU 71 CO -0.25 0.35 -0.01 0.00 -1.32 0.00 0.00 176.35 175.11 1gcf n GLY 73 N -0.35 1.46 2.02 0.00 0.00 -1.26 -4.97 105.19 102.08 1gcf n GLY 73 Ca -0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.66 1gcf n GLY 73 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gcf n LEU 74 N 0.00 6.11 -4.56 0.99 4.77 -1.26 -4.86 117.00 118.19 1gcf n LEU 74 Ca 0.00 -3.17 -0.40 0.00 -0.03 0.00 0.00 56.01 52.41 1gcf n LEU 74 Cb 0.13 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 40.45 1gcf n LEU 74 CO 0.00 0.78 1.38 -1.38 -1.33 0.00 0.00 177.39 176.84 1gcf s HIS 75 N -2.95 2.38 0.00 -1.77 -3.43 -1.26 -4.00 115.29 104.26 1gcf s HIS 75 Ca 0.55 -0.46 0.00 0.00 -0.80 0.00 0.00 55.06 54.35 1gcf s HIS 75 Cb 0.44 -4.62 0.00 0.00 -1.43 0.00 0.00 32.58 26.97 1gcf s HIS 75 CO 0.14 -1.98 0.00 1.04 -2.00 0.00 0.00 174.74 171.94 1gcf n GLN 76 N 9.04 0.00 -4.17 -0.38 6.02 -1.26 -5.14 117.38 121.49 1gcf n GLN 76 Ca 0.24 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.95 1gcf n GLN 76 Cb 0.50 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.68 1gcf n GLN 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1gcf s ALA 77 N -1.62 3.21 0.17 -1.58 0.00 -1.26 -4.96 121.76 115.73 1gcf s ALA 77 Ca 0.00 -1.25 0.05 0.00 0.00 0.00 0.00 51.96 50.76 1gcf s ALA 77 Cb 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 22.05 1gcf s ALA 77 CO 0.00 0.59 1.39 -1.00 0.00 0.00 0.00 175.76 176.74 1gcf h PRO 78 N 3.11 0.12 -5.59 0.00 0.13 -1.93 -3.45 132.00 124.40 1gcf h PRO 78 Ca -0.48 -0.14 -0.48 0.00 -0.87 0.00 0.00 66.00 64.04 1gcf h PRO 78 Cb 1.18 0.04 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 1gcf h PRO 78 CO 0.58 0.92 -0.80 0.54 -0.23 0.00 0.00 178.00 179.00 1gcf s VAL 79 N -3.15 1.30 0.06 1.56 0.11 -1.19 -4.50 120.40 114.60 1gcf s VAL 79 Ca -0.02 -1.19 0.08 0.00 -2.93 0.00 0.00 61.98 57.92 1gcf s VAL 79 Cb 0.10 -1.18 -0.03 0.00 -1.53 0.00 0.00 36.38 33.74 1gcf s VAL 79 CO 0.82 -0.03 -0.23 -0.31 -3.33 0.00 0.00 175.10 172.02 1gcf s TYR 80 N -0.99 2.00 0.14 1.54 1.51 -0.66 0.18 117.35 121.07 1gcf s TYR 80 Ca 0.02 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.75 1gcf s TYR 80 Cb -0.09 -1.17 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 1gcf s TYR 80 CO 0.02 0.15 0.01 0.99 -1.11 0.00 0.00 175.55 175.60 1gcf s THR 81 N -0.89 3.87 -0.21 -0.71 2.01 -0.54 -2.47 115.64 116.70 1gcf s THR 81 Ca 0.09 -1.23 -0.11 0.00 0.31 0.00 0.00 61.69 60.75 1gcf s THR 81 Cb -0.09 -2.90 0.07 0.00 0.01 0.00 0.00 72.50 69.58 1gcf s THR 81 CO 0.03 -0.02 0.51 -0.76 -0.69 0.00 0.00 174.62 173.69 1gcf s LEU 82 N -2.69 -0.42 0.00 4.42 1.02 -0.59 -1.70 118.68 118.72 1gcf s LEU 82 Ca 0.27 1.12 0.00 0.00 0.02 0.00 0.00 54.13 55.54 1gcf s LEU 82 Cb -0.10 1.71 0.00 0.00 0.02 0.00 0.00 46.19 47.82 1gcf s LEU 82 CO 0.19 -0.21 0.00 1.67 0.02 0.00 0.00 176.35 178.02 1gcf n GLN 83 N 4.34 1.82 -3.88 1.70 -0.06 -0.49 -1.69 117.38 119.12 1gcf n GLN 83 Ca -0.22 -0.20 -0.11 0.00 -2.00 0.00 0.00 57.00 54.48 1gcf n GLN 83 Cb 0.56 0.05 -0.10 0.00 -4.06 0.00 0.00 30.24 26.69 1gcf n GLN 83 CO 0.00 0.00 0.00 1.41 -0.20 0.00 0.00 177.06 178.27 1gcf s MET 84 N -2.11 0.50 -0.03 3.69 1.75 -1.18 -3.02 119.30 118.91 1gcf s MET 84 Ca 0.00 -0.48 -0.04 0.00 -1.25 0.00 0.00 55.69 53.93 1gcf s MET 84 Cb -0.00 0.21 0.01 0.00 2.84 0.00 0.00 34.83 37.88 1gcf s MET 84 CO 0.00 -0.12 0.10 0.50 -0.65 0.00 0.00 175.02 174.85 1gcf s ARG 85 N -1.64 0.14 -0.09 4.11 6.06 -1.09 -1.94 118.95 124.51 1gcf s ARG 85 Ca -0.13 0.08 -0.04 0.00 -2.50 0.00 0.00 55.73 53.14 1gcf s ARG 85 Cb -0.06 0.07 0.04 0.00 0.06 0.00 0.00 34.95 35.05 1gcf s ARG 85 CO 0.00 -0.02 0.20 0.00 -2.50 0.00 0.00 175.30 172.98 1gcf n ILE 87 N 4.10 0.00 -1.80 0.00 3.06 -1.07 -4.15 119.36 119.50 1gcf n ILE 87 Ca -0.25 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.00 1gcf n ILE 87 Cb 0.53 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.71 1gcf n ILE 87 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1gcf n ARG 88 N 0.00 3.97 -3.08 9.51 5.12 -1.26 -4.02 116.66 126.90 1gcf n ARG 88 Ca 0.00 0.00 -0.17 0.00 -1.93 0.00 0.00 57.85 55.75 1gcf n ARG 88 Cb 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.28 1gcf n ARG 88 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1gcf n SER 89 N 0.00 -0.16 0.00 0.55 2.88 -1.25 -2.91 113.62 112.73 1gcf n SER 89 Ca 0.00 -3.06 0.00 0.00 -1.33 0.00 0.00 58.87 54.48 1gcf n SER 89 Cb 0.00 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.45 1gcf n SER 89 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1gcf n SER 90 N 0.71 0.00 -3.05 -3.46 7.64 -1.26 -4.89 113.62 109.31 1gcf n SER 90 Ca 0.20 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.91 1gcf n SER 90 Cb 0.63 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.81 1gcf n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gcf n LEU 91 N -0.22 1.32 -4.57 -3.43 -0.00 -1.26 -5.03 117.00 103.80 1gcf n LEU 91 Ca 0.00 -4.80 -0.36 0.00 -0.00 0.00 0.00 56.01 50.84 1gcf n LEU 91 Cb 0.00 0.54 -0.03 0.00 -0.00 0.00 0.00 43.42 43.93 1gcf n LEU 91 CO 0.00 2.15 1.66 -2.16 -0.00 0.00 0.00 177.39 179.04 1gcf s PRO 92 N -2.67 3.30 0.00 1.47 0.04 -1.26 -4.47 135.00 131.41 1gcf s PRO 92 Ca 0.38 -1.35 0.00 0.00 0.04 0.00 0.00 61.00 60.07 1gcf s PRO 92 Cb 0.37 -5.36 0.00 0.00 0.04 0.00 0.00 34.50 29.55 1gcf s PRO 92 CO -0.06 -2.87 0.77 0.41 0.04 0.00 0.00 177.00 175.29 1gcf n GLY 93 N 6.03 -1.05 1.70 0.56 0.00 -1.26 -4.91 105.19 106.25 1gcf n GLY 93 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1gcf n GLY 93 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1gcf n PHE 94 N 0.00 -0.58 -2.03 1.61 -0.00 -1.26 -5.15 117.46 110.05 1gcf n PHE 94 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1gcf n PHE 94 Cb 0.61 0.42 0.00 0.00 -0.00 0.00 0.00 39.48 40.51 1gcf n PHE 94 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.76 177.67 1gcf n TRP 95 N -2.35 -4.92 -0.23 -5.13 7.02 -1.26 -4.92 117.44 105.66 1gcf n TRP 95 Ca 0.00 2.93 -0.09 0.00 -1.02 0.00 0.00 57.50 59.31 1gcf n TRP 95 Cb 0.00 -3.68 0.09 0.00 -2.42 0.00 0.00 31.31 25.30 1gcf n TRP 95 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1gcf n SER 96 N 1.76 -2.29 -4.73 -0.99 7.64 -1.26 -4.87 113.62 108.87 1gcf n SER 96 Ca 0.00 -0.27 -0.41 0.00 1.01 0.00 0.00 58.87 59.20 1gcf n SER 96 Cb 0.00 -0.42 -0.04 0.00 -1.01 0.00 0.00 64.21 62.74 1gcf n SER 96 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1gcf s PRO 97 N -2.84 4.62 -0.27 1.43 0.04 -1.26 -4.92 135.00 131.80 1gcf s PRO 97 Ca 0.21 1.57 -0.33 0.00 0.04 0.00 0.00 61.00 62.49 1gcf s PRO 97 Cb -0.04 -3.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.06 1gcf s PRO 97 CO 0.17 0.09 2.16 0.91 0.04 0.00 0.00 177.00 180.37 1gcf n TRP 98 N 2.88 1.81 -1.90 0.56 7.02 -1.26 -4.91 117.44 121.64 1gcf n TRP 98 Ca 0.03 0.12 -0.34 0.00 -1.02 0.00 0.00 57.50 56.29 1gcf n TRP 98 Cb 0.48 -2.61 0.03 0.00 -2.42 0.00 0.00 31.31 26.79 1gcf n TRP 98 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1gcf s SER 99 N 7.19 5.28 0.14 -0.99 0.01 -0.82 -4.92 113.70 119.59 1gcf s SER 99 Ca 1.05 2.06 -0.30 0.00 1.31 0.00 0.00 55.95 60.07 1gcf s SER 99 Cb -0.67 -2.56 -0.07 0.00 0.21 0.00 0.00 66.02 62.93 1gcf s SER 99 CO 0.45 -1.52 1.07 -2.16 0.41 0.00 0.00 173.24 171.50 1gcf s PRO 100 N -3.85 4.60 0.00 12.44 0.04 -1.26 -3.10 135.00 143.87 1gcf s PRO 100 Ca 0.69 1.64 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1gcf s PRO 100 Cb -0.22 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1gcf s PRO 100 CO 0.37 0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.89 1gcf n GLY 101 N 2.27 0.71 0.29 0.56 0.00 -1.25 -4.80 105.19 102.98 1gcf n GLY 101 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 1gcf n GLY 101 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1gcf n LEU 102 N 0.00 0.00 -3.70 0.99 -0.00 -0.68 -4.99 117.00 108.62 1gcf n LEU 102 Ca 0.00 -0.09 -0.11 0.00 -0.00 0.00 0.00 56.01 55.81 1gcf n LEU 102 Cb 0.00 0.19 -0.11 0.00 -0.00 0.00 0.00 43.42 43.51 1gcf n LEU 102 CO 0.00 -0.03 0.05 0.00 -0.00 0.00 0.00 177.39 177.41 1gcf s GLN 103 N -2.00 0.40 0.00 1.47 -2.07 -1.26 -1.54 119.66 114.65 1gcf s GLN 103 Ca 0.02 0.76 0.00 0.00 -1.82 0.00 0.00 55.36 54.32 1gcf s GLN 103 Cb -0.00 0.00 0.00 0.00 -1.09 0.00 0.00 33.01 31.92 1gcf s GLN 103 CO 0.00 -0.15 0.00 1.28 -1.32 0.00 0.00 175.29 175.11 1gcf n LEU 104 N 4.12 0.00 -4.25 2.60 4.77 -1.03 -4.95 117.00 118.25 1gcf n LEU 104 Ca -0.22 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.37 1gcf n LEU 104 Cb 0.55 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.53 1gcf n LEU 104 CO 0.09 0.00 -0.21 -0.13 -1.33 0.00 0.00 177.39 175.81 1gcf s ARG 105 N -1.96 2.54 0.40 3.23 0.52 -1.26 -1.65 118.95 120.75 1gcf s ARG 105 Ca 0.00 -1.34 -0.23 0.00 -0.52 0.00 0.00 55.73 53.64 1gcf s ARG 105 Cb 0.00 -3.56 -0.10 0.00 0.52 0.00 0.00 34.95 31.82 1gcf s ARG 105 CO 0.00 -0.79 0.99 -1.25 0.02 0.00 0.00 175.30 174.27 1gcf s PRO 106 N 1.37 4.26 0.26 3.54 0.04 -1.26 -4.88 135.00 138.34 1gcf s PRO 106 Ca 0.01 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1gcf s PRO 106 Cb -0.21 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.86 1gcf s PRO 106 CO 0.02 -0.02 0.00 0.25 0.04 0.00 0.00 177.00 177.28 1gcf n THR 107 N -0.14 0.00 -0.36 1.26 -2.24 -1.25 -4.51 114.28 107.04 1gcf n THR 107 Ca 0.05 0.23 0.07 0.00 -2.27 0.00 0.00 64.05 62.13 1gcf n THR 107 Cb 0.51 -0.50 0.21 0.00 -2.10 0.00 0.00 70.33 68.44 1gcf n THR 107 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1gcf n MET 108 N -3.18 2.94 0.00 -0.78 0.00 -1.26 -5.07 117.12 109.77 1gcf n MET 108 Ca -0.02 -2.31 0.04 0.00 0.00 0.00 0.00 57.70 55.41 1gcf n MET 108 Cb 0.60 -1.44 0.03 0.00 0.00 0.00 0.00 33.22 32.41 1gcf n MET 108 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14