#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lth s THR 8 N 0.00 4.87 -0.22 3.45 2.01 -1.26 -4.96 115.64 119.54 1lth s THR 8 Ca 0.00 0.92 -0.05 0.00 0.31 0.00 0.00 61.69 62.87 1lth s THR 8 Cb 0.00 -4.07 -0.02 0.00 0.01 0.00 0.00 72.50 68.42 1lth s THR 8 CO 0.00 -0.22 0.00 -0.75 -0.69 0.00 0.00 174.62 172.96 1lth s LYS 9 N 2.77 3.56 -0.23 4.92 2.20 -1.26 -0.50 119.74 131.20 1lth s LYS 9 Ca 0.28 -0.54 -0.11 0.00 -0.36 0.00 0.00 55.97 55.24 1lth s LYS 9 Cb -0.14 -3.11 -0.05 0.00 -1.51 0.00 0.00 37.83 33.01 1lth s LYS 9 CO 0.13 -0.09 0.19 -1.17 -0.36 0.00 0.00 175.35 174.05 1lth s LEU 10 N 1.26 4.14 -0.13 5.43 2.96 0.12 -0.85 118.68 131.61 1lth s LEU 10 Ca 0.04 0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 1lth s LEU 10 Cb -0.15 -2.16 -0.03 0.00 0.50 0.00 0.00 46.19 44.35 1lth s LEU 10 CO 0.01 0.06 0.01 0.00 -1.32 0.00 0.00 176.35 175.12 1lth s ALA 11 N 0.98 3.27 -0.13 5.97 0.00 0.73 -0.92 121.76 131.68 1lth s ALA 11 Ca 0.09 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.28 1lth s ALA 11 Cb -0.13 -1.65 -0.00 0.00 0.00 0.00 0.00 23.12 21.34 1lth s ALA 11 CO 0.04 0.38 -0.18 0.08 0.00 0.00 0.00 175.76 176.08 1lth s VAL 12 N -0.22 2.55 -0.35 0.00 1.01 -0.64 0.02 120.40 122.76 1lth s VAL 12 Ca 0.06 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 1lth s VAL 12 Cb -0.12 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.22 1lth s VAL 12 CO 0.02 0.54 0.21 -0.63 0.00 0.00 0.00 175.10 175.24 1lth s ILE 13 N 0.49 4.85 0.00 2.22 -1.09 0.60 -1.51 121.20 126.75 1lth s ILE 13 Ca -0.12 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 1lth s ILE 13 Cb -0.16 -3.59 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 1lth s ILE 13 CO 0.05 -0.11 0.00 0.61 -1.23 0.00 0.00 174.94 174.26 1lth n GLY 14 N 5.04 1.46 2.26 6.18 0.00 0.15 -0.22 105.19 120.06 1lth n GLY 14 Ca -0.12 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.78 1lth n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lth n ALA 15 N 0.66 7.11 -1.62 4.61 0.00 -1.26 -4.01 120.51 126.00 1lth n ALA 15 Ca 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 53.44 50.30 1lth n ALA 15 Cb 0.00 -2.96 0.00 0.00 0.00 0.00 0.00 19.45 16.49 1lth n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lth n GLY 16 N 2.91 0.91 0.24 0.00 0.00 -1.26 -4.56 105.19 103.42 1lth n GLY 16 Ca 0.66 -1.88 -0.04 0.00 0.00 0.00 0.00 46.02 44.75 1lth n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lth h ALA 17 N -1.38 0.81 0.00 4.61 0.00 -1.95 -2.28 119.26 119.07 1lth h ALA 17 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1lth h ALA 17 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1lth h ALA 17 CO 0.00 0.10 -0.08 0.28 0.00 0.00 0.00 179.25 179.55 1lth h VAL 18 N 0.72 0.28 -1.14 0.00 2.07 -1.89 -3.14 116.25 113.15 1lth h VAL 18 Ca 0.25 -1.22 0.32 0.00 0.82 0.00 0.00 66.70 66.87 1lth h VAL 18 Cb 0.05 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.29 1lth h VAL 18 CO -0.12 0.09 0.79 1.23 0.02 0.00 0.00 177.57 179.58 1lth h GLY 19 N -1.00 0.50 0.91 2.17 0.00 -1.69 0.41 103.07 104.36 1lth h GLY 19 Ca -0.01 -0.08 -0.34 0.00 0.00 0.00 0.00 47.33 46.91 1lth h GLY 19 CO -0.00 -0.07 -1.77 1.76 0.00 0.00 0.00 176.54 176.45 1lth h SER 20 N 0.14 0.42 0.24 0.19 0.02 -1.56 -2.73 113.55 110.28 1lth h SER 20 Ca 0.59 -0.74 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1lth h SER 20 Cb 2.01 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 64.39 1lth h SER 20 CO -0.13 1.64 -0.25 0.74 -1.14 0.00 0.00 176.83 177.69 1lth h THR 21 N 0.07 0.46 -0.70 -2.27 2.02 -1.32 0.14 112.91 111.32 1lth h THR 21 Ca -0.34 0.00 0.10 0.00 0.77 0.00 0.00 66.41 66.94 1lth h THR 21 Cb 2.05 0.46 -0.12 0.00 -1.74 0.00 0.00 68.15 68.80 1lth h THR 21 CO 0.13 0.00 -0.44 0.25 0.37 0.00 0.00 175.52 175.84 1lth h LEU 22 N -0.53 -1.54 -1.25 2.58 5.85 -0.29 0.43 115.31 120.56 1lth h LEU 22 Ca -0.00 0.27 -0.07 0.00 0.84 0.00 0.00 57.88 58.91 1lth h LEU 22 Cb 0.49 0.72 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1lth h LEU 22 CO -0.06 -0.31 -0.24 0.00 -0.34 0.00 0.00 178.44 177.48 1lth h ALA 23 N 0.77 1.38 0.50 1.25 0.00 -1.39 0.11 119.26 121.86 1lth h ALA 23 Ca 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1lth h ALA 23 Cb 0.55 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1lth h ALA 23 CO -0.77 0.43 -0.24 0.35 0.00 0.00 0.00 179.25 179.03 1lth h PHE 24 N 0.19 -0.62 0.56 0.00 3.57 0.25 0.14 116.94 121.04 1lth h PHE 24 Ca 0.03 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1lth h PHE 24 Cb 0.53 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1lth h PHE 24 CO 0.01 -0.34 -0.48 0.00 -2.23 0.00 0.00 178.31 175.26 1lth h ALA 25 N -0.28 -1.18 -0.94 2.41 0.00 -0.11 -1.04 119.26 118.13 1lth h ALA 25 Ca -0.07 -0.20 0.21 0.00 0.00 0.00 0.00 54.91 54.85 1lth h ALA 25 Cb 0.55 0.68 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 1lth h ALA 25 CO 0.11 -1.18 0.61 0.00 0.00 0.00 0.00 179.25 178.79 1lth h ALA 26 N -1.02 2.12 -0.32 0.00 0.00 -0.81 0.32 119.26 119.55 1lth h ALA 26 Ca -0.07 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1lth h ALA 26 Cb 0.87 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1lth h ALA 26 CO -0.01 -0.43 0.16 0.00 0.00 0.00 0.00 179.25 178.97 1lth h ALA 27 N 1.61 0.41 0.00 0.00 0.00 -0.09 0.13 119.26 121.32 1lth h ALA 27 Ca 0.50 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.26 1lth h ALA 27 Cb 1.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1lth h ALA 27 CO -0.22 -0.04 -0.31 1.96 0.00 0.00 0.00 179.25 180.64 1lth h GLN 28 N 0.38 0.00 0.00 0.00 4.20 0.78 -2.64 115.11 117.84 1lth h GLN 28 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1lth h GLN 28 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1lth h GLN 28 CO -0.02 0.31 -0.44 -2.13 -0.67 0.00 0.00 178.83 175.88 1lth n ARG 29 N -3.61 0.08 -3.74 1.46 0.63 0.42 -4.64 116.66 107.26 1lth n ARG 29 Ca -0.01 0.03 -0.24 0.00 -0.92 0.00 0.00 57.85 56.71 1lth n ARG 29 Cb 0.44 -1.55 0.04 0.00 0.45 0.00 0.00 32.46 31.83 1lth n ARG 29 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1lth n GLY 30 N 1.46 -0.38 0.09 5.14 0.00 0.37 -4.89 105.19 106.98 1lth n GLY 30 Ca 0.05 0.16 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1lth n GLY 30 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lth h ILE 31 N -2.01 1.58 -4.07 -0.61 6.09 -1.81 -3.45 117.51 113.23 1lth h ILE 31 Ca -0.60 -2.05 -0.57 0.00 -1.37 0.00 0.00 64.86 60.28 1lth h ILE 31 Cb 1.36 2.90 -0.24 0.00 0.47 0.00 0.00 36.82 41.31 1lth h ILE 31 CO 0.59 0.56 -0.83 0.00 -3.07 0.00 0.00 178.15 175.39 1lth s ALA 32 N -2.93 1.77 0.02 0.18 0.00 -1.26 -4.97 121.76 114.56 1lth s ALA 32 Ca -0.16 -1.13 0.15 0.00 0.00 0.00 0.00 51.96 50.81 1lth s ALA 32 Cb 0.00 -0.30 0.23 0.00 0.00 0.00 0.00 23.12 23.05 1lth s ALA 32 CO 0.74 0.38 1.52 -0.09 0.00 0.00 0.00 175.76 178.31 1lth h ARG 33 N 4.55 0.00 -4.98 0.00 1.12 -1.85 -3.41 114.38 109.82 1lth h ARG 33 Ca -0.44 0.00 -0.66 0.00 -1.11 0.00 0.00 59.98 57.77 1lth h ARG 33 Cb 1.17 0.00 -0.30 0.00 -0.01 0.00 0.00 29.97 30.83 1lth h ARG 33 CO 0.42 0.56 -0.75 -1.21 -3.11 0.00 0.00 179.97 175.88 1lth s GLU 34 N -3.16 3.19 -0.19 0.20 2.02 0.35 -1.84 118.70 119.27 1lth s GLU 34 Ca 0.02 -0.74 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 1lth s GLU 34 Cb 0.09 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.38 1lth s GLU 34 CO 0.74 -0.25 -0.12 0.42 0.02 0.00 0.00 175.26 176.07 1lth s ILE 35 N 1.42 2.79 0.23 -1.63 -1.09 -0.37 0.13 121.20 122.68 1lth s ILE 35 Ca 0.04 -0.70 0.12 0.00 -2.23 0.00 0.00 60.65 57.88 1lth s ILE 35 Cb -0.15 -2.22 -0.05 0.00 -1.58 0.00 0.00 42.46 38.46 1lth s ILE 35 CO -0.05 0.48 -0.22 0.68 -1.23 0.00 0.00 174.94 174.60 1lth s VAL 36 N 1.25 2.41 -0.07 2.92 -7.23 -0.09 -0.80 120.40 118.79 1lth s VAL 36 Ca 0.03 -2.17 0.02 0.00 -1.81 0.00 0.00 61.98 58.05 1lth s VAL 36 Cb -0.14 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.61 1lth s VAL 36 CO -0.06 -0.23 -0.11 -0.76 -0.31 0.00 0.00 175.10 173.64 1lth s LEU 37 N -3.00 1.59 0.06 1.32 1.43 0.36 -1.63 118.68 118.81 1lth s LEU 37 Ca 0.24 -0.28 0.09 0.00 -1.03 0.00 0.00 54.13 53.15 1lth s LEU 37 Cb -0.07 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 1lth s LEU 37 CO 0.12 0.02 -0.26 -0.70 0.23 0.00 0.00 176.35 175.76 1lth s GLU 38 N 0.74 1.71 0.00 1.70 -6.30 -0.57 -1.18 118.70 114.81 1lth s GLU 38 Ca -0.13 -1.13 -0.28 0.00 -2.50 0.00 0.00 54.97 50.92 1lth s GLU 38 Cb -0.15 -1.93 0.08 0.00 0.00 0.00 0.00 34.13 32.12 1lth s GLU 38 CO 0.03 0.49 0.71 0.34 0.02 0.00 0.00 175.26 176.85 1lth s ASP 39 N -1.35 -0.57 0.28 -1.70 -1.08 -0.80 -0.68 116.67 110.77 1lth s ASP 39 Ca 0.12 0.40 0.00 0.00 -0.52 0.00 0.00 52.55 52.55 1lth s ASP 39 Cb -0.10 0.52 0.51 0.00 -1.46 0.00 0.00 42.92 42.39 1lth s ASP 39 CO 0.03 -0.69 1.85 0.16 0.52 0.00 0.00 175.17 177.04 1lth h ILE 40 N 2.56 0.97 -1.35 4.11 3.07 -1.90 -3.36 117.51 121.61 1lth h ILE 40 Ca -0.28 -0.36 -0.49 0.00 1.55 0.00 0.00 64.86 65.28 1lth h ILE 40 Cb 1.20 -0.17 -0.07 0.00 -0.27 0.00 0.00 36.82 37.50 1lth h ILE 40 CO 0.37 0.19 1.19 0.00 -1.05 0.00 0.00 178.15 178.85 1lth s ALA 41 N -5.98 2.36 0.06 0.16 0.00 -1.26 -4.89 121.76 112.20 1lth s ALA 41 Ca -0.12 -1.68 -0.20 0.00 0.00 0.00 0.00 51.96 49.96 1lth s ALA 41 Cb 0.22 -4.46 -0.09 0.00 0.00 0.00 0.00 23.12 18.79 1lth s ALA 41 CO 0.81 -3.93 1.32 -0.22 0.00 0.00 0.00 175.76 173.75 1lth h LYS 42 N 10.92 -0.47 0.00 0.00 3.64 -1.90 -0.34 116.57 128.42 1lth h LYS 42 Ca 0.02 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1lth h LYS 42 Cb 1.04 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1lth h LYS 42 CO 1.31 -0.31 -0.16 1.49 -2.27 0.00 0.00 179.45 179.51 1lth h GLU 43 N -0.48 0.00 0.15 1.90 4.81 -1.95 -1.35 114.58 117.66 1lth h GLU 43 Ca -0.01 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1lth h GLU 43 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1lth h GLU 43 CO -0.13 0.16 -0.07 -0.09 -0.73 0.00 0.00 179.01 178.14 1lth h ARG 44 N 0.00 -0.20 -0.32 1.92 2.43 -1.93 -2.51 114.38 113.77 1lth h ARG 44 Ca -0.00 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1lth h ARG 44 Cb 0.53 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1lth h ARG 44 CO 0.02 0.24 0.22 -0.24 -1.51 0.00 0.00 179.97 178.70 1lth h VAL 45 N -0.86 0.91 -0.45 0.20 3.04 -0.81 -1.26 116.25 117.01 1lth h VAL 45 Ca -0.02 -0.04 -0.06 0.00 -1.01 0.00 0.00 66.70 65.57 1lth h VAL 45 Cb 0.53 0.76 -0.02 0.00 -2.01 0.00 0.00 31.29 30.55 1lth h VAL 45 CO 0.03 0.02 0.05 -0.33 -1.01 0.00 0.00 177.57 176.34 1lth h GLU 46 N 0.13 0.76 -0.71 4.17 5.08 -1.29 -2.78 114.58 119.94 1lth h GLU 46 Ca 0.15 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1lth h GLU 46 Cb 0.42 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1lth h GLU 46 CO -0.02 0.80 0.19 0.00 -1.00 0.00 0.00 179.01 178.98 1lth h ALA 47 N 0.94 1.00 -0.32 3.43 0.00 -0.77 -1.19 119.26 122.35 1lth h ALA 47 Ca 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1lth h ALA 47 Cb 0.42 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1lth h ALA 47 CO 0.01 0.66 0.14 0.93 0.00 0.00 0.00 179.25 181.00 1lth h GLU 48 N 1.07 0.47 -0.23 0.00 4.39 -1.51 -1.22 114.58 117.54 1lth h GLU 48 Ca 0.23 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 1lth h GLU 48 Cb 0.34 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1lth h GLU 48 CO -0.00 0.45 0.08 0.28 -1.16 0.00 0.00 179.01 178.66 1lth h VAL 49 N 0.38 1.18 -0.74 3.13 2.07 -1.35 -0.22 116.25 120.70 1lth h VAL 49 Ca 0.11 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 1lth h VAL 49 Cb 0.14 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1lth h VAL 49 CO -0.01 0.18 0.26 0.25 0.02 0.00 0.00 177.57 178.27 1lth h LEU 50 N 0.22 1.05 0.33 2.57 5.85 -1.18 -0.58 115.31 123.56 1lth h LEU 50 Ca 0.08 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1lth h LEU 50 Cb 0.21 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1lth h LEU 50 CO -0.00 0.96 -0.16 -0.78 -0.34 0.00 0.00 178.44 178.12 1lth h ASP 51 N 1.08 -0.37 -0.08 1.25 3.58 -0.91 -2.84 116.42 118.13 1lth h ASP 51 Ca 0.24 -0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 1lth h ASP 51 Cb 0.26 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 1lth h ASP 51 CO -0.01 -0.17 -0.15 0.24 -2.88 0.00 0.00 179.24 176.27 1lth h MET 52 N -0.56 0.43 -0.89 0.28 2.86 -0.82 -2.38 114.93 113.85 1lth h MET 52 Ca -0.04 -0.13 0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1lth h MET 52 Cb 0.41 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 1lth h MET 52 CO 0.07 0.58 0.56 1.96 1.06 0.00 0.00 176.91 181.14 1lth h GLN 53 N 0.40 0.99 0.00 1.72 4.20 -1.04 -1.14 115.11 120.24 1lth h GLN 53 Ca 0.07 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1lth h GLN 53 Cb 0.50 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1lth h GLN 53 CO 0.03 0.65 0.00 0.72 -0.67 0.00 0.00 178.83 179.57 1lth n HIS 54 N -4.59 0.00 1.10 2.96 8.25 -0.89 -0.83 115.22 121.21 1lth n HIS 54 Ca 0.13 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.71 1lth n HIS 54 Cb 0.18 -0.44 0.17 0.00 1.12 0.00 0.00 29.99 31.02 1lth n HIS 54 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lth n GLY 55 N -1.08 -0.48 0.43 -1.41 0.00 -0.43 -4.60 105.19 97.62 1lth n GLY 55 Ca 0.01 -0.51 0.35 0.00 0.00 0.00 0.00 46.02 45.87 1lth n GLY 55 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lth h SER 56 N 1.42 0.28 0.65 1.61 0.02 -1.04 0.32 113.55 116.80 1lth h SER 56 Ca 0.00 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1lth h SER 56 Cb 0.60 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1lth h SER 56 CO 0.00 -0.23 0.00 -1.54 -1.14 0.00 0.00 176.83 173.92 1lth n SER 57 N -4.83 0.65 -0.72 3.07 3.41 -1.26 -2.38 113.62 111.56 1lth n SER 57 Ca 0.37 0.67 0.08 0.00 -0.26 0.00 0.00 58.87 59.73 1lth n SER 57 Cb 1.38 -0.81 0.12 0.00 -0.26 0.00 0.00 64.21 64.64 1lth n SER 57 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1lth n PHE 58 N -2.23 0.26 -3.24 7.33 3.72 0.11 -4.99 117.46 118.42 1lth n PHE 58 Ca 0.02 -0.20 -0.18 0.00 -0.05 0.00 0.00 57.45 57.03 1lth n PHE 58 Cb 0.21 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 1lth n PHE 58 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1lth s TYR 59 N -1.16 2.95 1.34 1.38 2.02 -1.00 -5.03 117.35 117.85 1lth s TYR 59 Ca 0.24 -0.31 -0.20 0.00 -0.37 0.00 0.00 57.07 56.42 1lth s TYR 59 Cb 0.14 -2.19 0.34 0.00 -0.40 0.00 0.00 41.96 39.85 1lth s TYR 59 CO 0.20 -0.22 0.98 -1.25 -1.57 0.00 0.00 175.55 173.69 1lth s PRO 60 N -4.26 -2.31 -0.04 -1.71 0.04 -1.26 -4.92 135.00 120.54 1lth s PRO 60 Ca 0.50 0.23 -0.30 0.00 0.04 0.00 0.00 61.00 61.47 1lth s PRO 60 Cb -0.10 -1.44 -0.05 0.00 0.04 0.00 0.00 34.50 32.95 1lth s PRO 60 CO 0.32 -4.49 1.54 -0.08 0.04 0.00 0.00 177.00 174.34 1lth s THR 61 N -2.43 3.63 0.23 1.26 -1.32 -1.26 -4.97 115.64 110.79 1lth s THR 61 Ca 0.69 0.88 -0.15 0.00 -1.21 0.00 0.00 61.69 61.90 1lth s THR 61 Cb -0.15 -3.57 0.01 0.00 -1.51 0.00 0.00 72.50 67.28 1lth s THR 61 CO 0.59 -0.05 0.51 0.68 -2.21 0.00 0.00 174.62 174.14 1lth s VAL 62 N 3.41 0.01 -0.07 5.08 -7.23 -1.26 -4.83 120.40 115.50 1lth s VAL 62 Ca 0.69 -1.21 -0.00 0.00 -1.81 0.00 0.00 61.98 59.65 1lth s VAL 62 Cb -0.32 -2.01 0.03 0.00 0.56 0.00 0.00 36.38 34.64 1lth s VAL 62 CO 0.27 -0.05 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.54 1lth s SER 63 N -2.97 1.57 -0.10 4.85 0.01 -0.77 -5.04 113.70 111.25 1lth s SER 63 Ca 0.17 -0.15 -0.06 0.00 1.31 0.00 0.00 55.95 57.23 1lth s SER 63 Cb -0.01 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.64 1lth s SER 63 CO 0.05 -0.14 0.12 -0.63 0.41 0.00 0.00 173.24 173.06 1lth s ILE 64 N 1.63 5.31 0.07 1.44 -1.09 -1.25 -1.24 121.20 126.07 1lth s ILE 64 Ca 0.01 0.10 -0.10 0.00 -2.23 0.00 0.00 60.65 58.43 1lth s ILE 64 Cb -0.13 -3.32 0.00 0.00 -1.58 0.00 0.00 42.46 37.43 1lth s ILE 64 CO -0.04 0.58 0.21 -0.62 -1.23 0.00 0.00 174.94 173.84 1lth s ASP 65 N -1.11 0.06 -0.25 3.58 2.15 0.02 -4.98 116.67 116.14 1lth s ASP 65 Ca 0.16 -0.51 -0.23 0.00 0.43 0.00 0.00 52.55 52.40 1lth s ASP 65 Cb -0.12 0.33 0.07 0.00 -0.30 0.00 0.00 42.92 42.89 1lth s ASP 65 CO 0.05 -0.67 0.68 -0.83 -0.17 0.00 0.00 175.17 174.23 1lth s GLY 66 N -2.54 -0.51 0.00 2.66 0.00 -1.25 0.13 107.32 105.82 1lth s GLY 66 Ca 0.01 1.91 0.00 0.00 0.00 0.00 0.00 44.72 46.63 1lth s GLY 66 CO -0.08 1.65 0.00 -1.26 0.00 0.00 0.00 173.10 173.40 1lth n SER 67 N 2.72 0.00 -2.27 1.64 2.88 -0.32 -4.77 113.62 113.50 1lth n SER 67 Ca -0.14 -0.73 -0.13 0.00 -1.33 0.00 0.00 58.87 56.54 1lth n SER 67 Cb 0.55 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.05 1lth n SER 67 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1lth n ASP 68 N -1.93 3.45 -3.71 -3.46 5.68 -1.26 -1.90 116.55 113.42 1lth n ASP 68 Ca 0.00 -3.06 -0.15 0.00 -0.50 0.00 0.00 54.79 51.09 1lth n ASP 68 Cb 0.00 -0.40 -0.15 0.00 -1.14 0.00 0.00 41.12 39.43 1lth n ASP 68 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1lth s ASP 69 N -3.63 0.20 0.00 -1.12 -1.08 -1.26 -4.91 116.67 104.88 1lth s ASP 69 Ca 0.41 0.35 0.01 0.00 -0.52 0.00 0.00 52.55 52.80 1lth s ASP 69 Cb 0.37 0.27 0.05 0.00 -1.46 0.00 0.00 42.92 42.15 1lth s ASP 69 CO 0.00 -0.19 1.01 -2.65 0.52 0.00 0.00 175.17 173.86 1lth n PRO 70 N 4.67 0.00 -0.33 4.34 -0.02 -1.26 -3.14 135.00 139.26 1lth n PRO 70 Ca -0.18 0.45 0.06 0.00 -2.02 0.00 0.00 63.50 61.82 1lth n PRO 70 Cb 0.51 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.71 1lth n PRO 70 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1lth h GLU 71 N 0.00 0.84 0.00 -0.52 4.39 -1.96 -2.04 114.58 115.30 1lth h GLU 71 Ca 0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1lth h GLU 71 Cb 0.02 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 1lth h GLU 71 CO 0.00 0.56 0.00 -0.89 -1.16 0.00 0.00 179.01 177.52 1lth n ILE 72 N -4.70 1.65 1.83 3.13 5.41 -1.19 0.01 119.36 125.50 1lth n ILE 72 Ca 0.17 0.55 0.07 0.00 1.00 0.00 0.00 62.75 64.55 1lth n ILE 72 Cb 0.35 -1.54 0.39 0.00 -0.71 0.00 0.00 39.64 38.13 1lth n ILE 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1lth n ARG 74 N -0.49 1.54 -0.68 0.00 0.63 0.10 -1.49 116.66 116.27 1lth n ARG 74 Ca 0.11 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.45 1lth n ARG 74 Cb 0.10 -2.90 0.00 0.00 0.45 0.00 0.00 32.46 30.11 1lth n ARG 74 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1lth n ASP 75 N 11.03 0.00 -4.71 6.15 8.00 -1.06 -4.97 116.55 130.99 1lth n ASP 75 Ca 0.35 0.00 -0.56 0.00 0.71 0.00 0.00 54.79 55.29 1lth n ASP 75 Cb 0.35 -0.17 -0.07 0.00 -0.02 0.00 0.00 41.12 41.22 1lth n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lth n ALA 76 N 0.73 -0.08 -0.36 2.24 0.00 -0.55 -4.76 120.51 117.71 1lth n ALA 76 Ca 0.00 0.38 0.28 0.00 0.00 0.00 0.00 53.44 54.10 1lth n ALA 76 Cb 0.00 -2.25 0.57 0.00 0.00 0.00 0.00 19.45 17.77 1lth n ALA 76 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1lth h ASP 77 N 7.38 0.35 -4.25 0.00 5.19 -1.35 -3.35 116.42 120.38 1lth h ASP 77 Ca -0.47 0.10 -0.14 0.00 -0.62 0.00 0.00 57.03 55.89 1lth h ASP 77 Cb 1.31 0.05 -0.23 0.00 0.18 0.00 0.00 39.33 40.64 1lth h ASP 77 CO 0.96 -0.01 -0.37 -0.32 -3.12 0.00 0.00 179.24 176.37 1lth s MET 78 N -5.39 0.43 -0.05 3.56 1.75 -1.10 -2.05 119.30 116.46 1lth s MET 78 Ca -0.08 0.16 0.04 0.00 -1.25 0.00 0.00 55.69 54.55 1lth s MET 78 Cb 0.27 0.20 -0.00 0.00 2.84 0.00 0.00 34.83 38.13 1lth s MET 78 CO 0.81 -0.08 -0.16 0.08 -0.65 0.00 0.00 175.02 175.01 1lth s VAL 79 N -0.39 1.36 -0.21 10.11 1.01 0.03 -0.19 120.40 132.12 1lth s VAL 79 Ca -0.05 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 1lth s VAL 79 Cb -0.03 -1.18 0.05 0.00 0.00 0.00 0.00 36.38 35.22 1lth s VAL 79 CO 0.01 0.40 -0.05 -0.69 0.00 0.00 0.00 175.10 174.77 1lth s VAL 80 N 0.12 1.29 -0.20 2.92 1.01 0.10 -0.97 120.40 124.67 1lth s VAL 80 Ca -0.05 -0.95 -0.26 0.00 0.00 0.00 0.00 61.98 60.72 1lth s VAL 80 Cb -0.12 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1lth s VAL 80 CO 0.02 -0.03 0.90 -0.63 0.00 0.00 0.00 175.10 175.36 1lth s ILE 81 N 1.52 4.81 -0.07 2.22 -1.09 -1.12 -0.29 121.20 127.18 1lth s ILE 81 Ca -0.03 1.75 0.08 0.00 -2.23 0.00 0.00 60.65 60.22 1lth s ILE 81 Cb -0.17 -4.19 -0.12 0.00 -1.58 0.00 0.00 42.46 36.40 1lth s ILE 81 CO -0.07 -0.05 0.07 0.35 -1.23 0.00 0.00 174.94 174.01 1lth n THR 82 N 4.99 0.50 -1.69 2.92 -2.24 0.69 0.36 114.28 119.82 1lth n THR 82 Ca 0.07 -0.35 -0.66 0.00 -2.27 0.00 0.00 64.05 60.84 1lth n THR 82 Cb 0.48 -0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 68.06 1lth n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lth n ALA 83 N -2.24 -1.56 0.00 6.98 0.00 0.55 -4.21 120.51 120.03 1lth n ALA 83 Ca -0.12 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1lth n ALA 83 Cb 0.69 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1lth n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lth n GLY 84 N 3.68 0.28 3.84 0.00 0.00 -1.26 -4.73 105.19 107.00 1lth n GLY 84 Ca 0.29 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 1lth n GLY 84 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1lth s PRO 85 N -2.00 4.01 0.59 1.61 0.02 -1.26 -5.00 135.00 132.97 1lth s PRO 85 Ca 0.00 0.89 0.01 0.00 0.02 0.00 0.00 61.00 61.93 1lth s PRO 85 Cb 0.00 -2.22 0.06 0.00 0.02 0.00 0.00 34.50 32.36 1lth s PRO 85 CO 0.00 -0.11 0.83 1.03 -0.33 0.00 0.00 177.00 178.42 1lth s ARG 86 N -3.64 2.30 0.29 5.54 0.52 -1.26 -4.59 118.95 118.11 1lth s ARG 86 Ca 0.58 -0.94 -0.12 0.00 -0.52 0.00 0.00 55.73 54.73 1lth s ARG 86 Cb -0.10 -2.46 -0.08 0.00 0.52 0.00 0.00 34.95 32.83 1lth s ARG 86 CO 0.24 -0.91 0.66 -0.65 0.02 0.00 0.00 175.30 174.66 1lth s GLN 87 N -4.85 3.89 0.36 3.54 -0.21 -1.26 -5.00 119.66 116.14 1lth s GLN 87 Ca 0.60 0.47 -0.07 0.00 0.02 0.00 0.00 55.36 56.39 1lth s GLN 87 Cb -0.09 -2.52 -0.05 0.00 1.00 0.00 0.00 33.01 31.35 1lth s GLN 87 CO 0.40 0.21 0.66 0.15 -2.12 0.00 0.00 175.29 174.59 1lth s LYS 88 N -3.01 3.66 -0.23 2.91 3.01 -1.26 -4.95 119.74 119.88 1lth s LYS 88 Ca 0.51 0.18 -0.38 0.00 -1.01 0.00 0.00 55.97 55.26 1lth s LYS 88 Cb -0.11 -2.52 -0.14 0.00 -1.01 0.00 0.00 37.83 34.05 1lth s LYS 88 CO 0.20 0.06 1.81 -2.30 0.51 0.00 0.00 175.35 175.63 1lth n PRO 89 N -1.31 1.46 -0.14 -1.68 -0.02 -1.26 -0.09 135.00 131.96 1lth n PRO 89 Ca -0.00 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1lth n PRO 89 Cb 0.54 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1lth n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lth n GLY 90 N 4.35 1.80 3.70 -1.23 0.00 -1.26 -5.01 105.19 107.55 1lth n GLY 90 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1lth n GLY 90 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1lth s GLN 91 N -0.31 4.45 -0.26 1.61 0.74 0.88 -5.00 119.66 121.76 1lth s GLN 91 Ca 0.00 1.53 -0.29 0.00 0.05 0.00 0.00 55.36 56.65 1lth s GLN 91 Cb 0.00 -3.49 0.01 0.00 1.10 0.00 0.00 33.01 30.63 1lth s GLN 91 CO 0.00 -0.26 1.05 -1.12 -0.55 0.00 0.00 175.29 174.41 1lth s SER 92 N 1.16 7.04 0.55 6.67 0.01 -1.26 -4.50 113.70 123.37 1lth s SER 92 Ca 0.53 1.26 0.09 0.00 1.31 0.00 0.00 55.95 59.14 1lth s SER 92 Cb -0.23 -2.54 0.49 0.00 0.21 0.00 0.00 66.02 63.95 1lth s SER 92 CO 0.24 -0.73 1.21 0.08 0.41 0.00 0.00 173.24 174.44 1lth h ARG 93 N 7.66 0.00 0.00 12.44 0.11 -1.96 -0.27 114.38 132.37 1lth h ARG 93 Ca -0.20 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.88 1lth h ARG 93 Cb 1.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.14 1lth h ARG 93 CO 0.99 0.00 0.00 1.28 0.10 0.00 0.00 179.97 182.34 1lth n LEU 94 N -2.38 0.05 0.19 0.08 4.77 -1.26 -1.70 117.00 116.75 1lth n LEU 94 Ca -0.01 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.61 1lth n LEU 94 Cb 0.71 -0.52 0.22 0.00 -2.33 0.00 0.00 43.42 41.50 1lth n LEU 94 CO 0.04 -0.42 0.81 -0.33 -1.33 0.00 0.00 177.39 176.16 1lth h GLU 95 N 0.00 0.00 -0.00 3.23 5.08 -1.44 -3.29 114.58 118.16 1lth h GLU 95 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lth h GLU 95 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1lth h GLU 95 CO 0.00 0.00 -0.00 1.28 -1.00 0.00 0.00 179.01 179.29 1lth n LEU 96 N -2.91 0.03 -0.09 1.33 4.77 -0.69 -4.14 117.00 115.30 1lth n LEU 96 Ca 0.04 0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 56.03 1lth n LEU 96 Cb 0.51 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1lth n LEU 96 CO 0.33 0.00 0.94 0.58 -1.33 0.00 0.00 177.39 177.92 1lth h VAL 97 N 0.04 0.93 -0.84 4.08 2.07 -1.76 0.95 116.25 121.72 1lth h VAL 97 Ca 0.00 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.47 1lth h VAL 97 Cb 0.10 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 1lth h VAL 97 CO 0.00 0.05 0.53 1.23 0.02 0.00 0.00 177.57 179.40 1lth h GLY 98 N 0.27 1.23 1.37 2.17 0.00 -1.89 0.37 103.07 106.59 1lth h GLY 98 Ca 0.14 -0.40 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 1lth h GLY 98 CO -0.14 0.33 -0.56 0.00 0.00 0.00 0.00 176.54 176.17 1lth h ALA 99 N 1.36 0.61 0.00 3.60 0.00 -1.65 -2.85 119.26 120.34 1lth h ALA 99 Ca 0.34 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1lth h ALA 99 Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1lth h ALA 99 CO -0.13 0.69 -0.00 1.15 0.00 0.00 0.00 179.25 180.96 1lth h THR 100 N 0.50 1.11 -0.96 0.00 2.02 -0.40 -1.85 112.91 113.33 1lth h THR 100 Ca 0.01 -0.34 0.15 0.00 0.77 0.00 0.00 66.41 66.99 1lth h THR 100 Cb 1.13 1.35 -0.08 0.00 -1.74 0.00 0.00 68.15 68.81 1lth h THR 100 CO 0.11 0.09 0.61 0.58 0.37 0.00 0.00 175.52 177.28 1lth h VAL 101 N -0.15 0.82 -0.31 3.16 2.07 -0.27 -1.14 116.25 120.42 1lth h VAL 101 Ca -0.00 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 1lth h VAL 101 Cb 0.15 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 1lth h VAL 101 CO 0.00 0.14 -0.02 0.78 0.02 0.00 0.00 177.57 178.49 1lth h ASN 102 N 0.79 0.56 0.02 0.57 2.35 -1.20 -2.52 115.58 116.15 1lth h ASN 102 Ca 0.50 -0.32 -0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1lth h ASN 102 Cb 0.73 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.94 1lth h ASN 102 CO -0.27 0.75 -0.01 0.40 -1.65 0.00 0.00 177.43 176.66 1lth h ILE 103 N 0.36 1.01 -0.99 2.81 1.08 -0.42 -2.84 117.51 118.52 1lth h ILE 103 Ca 0.09 -0.10 0.10 0.00 -0.39 0.00 0.00 64.86 64.56 1lth h ILE 103 Cb 0.48 1.08 -0.08 0.00 -3.07 0.00 0.00 36.82 35.23 1lth h ILE 103 CO 0.02 0.02 0.63 -0.07 -0.69 0.00 0.00 178.15 178.06 1lth h LEU 104 N -0.07 0.93 -0.88 1.44 3.38 -1.33 -0.90 115.31 117.89 1lth h LEU 104 Ca -0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1lth h LEU 104 Cb 0.06 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1lth h LEU 104 CO 0.00 0.53 0.08 0.29 0.09 0.00 0.00 178.44 179.43 1lth n LYS 105 N -4.57 0.09 -0.04 1.13 5.02 -0.95 -1.13 118.16 117.70 1lth n LYS 105 Ca 0.18 0.56 -0.09 0.00 -2.02 0.00 0.00 58.31 56.94 1lth n LYS 105 Cb 0.31 -1.86 -0.03 0.00 -0.02 0.00 0.00 35.03 33.43 1lth n LYS 105 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lth n ALA 106 N -1.63 1.86 0.03 7.82 0.00 -0.37 -4.73 120.51 123.49 1lth n ALA 106 Ca -0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 1lth n ALA 106 Cb 0.10 0.18 -0.04 0.00 0.00 0.00 0.00 19.45 19.68 1lth n ALA 106 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1lth h ILE 107 N -0.57 0.67 -0.33 0.00 3.07 -1.42 -3.31 117.51 115.63 1lth h ILE 107 Ca -0.12 0.00 0.05 0.00 1.55 0.00 0.00 64.86 66.34 1lth h ILE 107 Cb 0.80 0.67 -0.08 0.00 -0.27 0.00 0.00 36.82 37.94 1lth h ILE 107 CO -0.07 0.00 -0.52 0.24 -1.05 0.00 0.00 178.15 176.75 1lth h MET 108 N -0.19 -0.42 -0.92 0.16 2.86 -1.37 0.63 114.93 115.68 1lth h MET 108 Ca 0.06 0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.83 1lth h MET 108 Cb 0.28 0.09 -0.07 0.00 0.06 0.00 0.00 31.60 31.96 1lth h MET 108 CO -0.16 -0.28 0.59 -1.00 1.06 0.00 0.00 176.91 177.12 1lth h PRO 109 N -0.43 0.89 -0.11 -0.22 0.13 -1.78 -0.83 132.00 129.64 1lth h PRO 109 Ca 0.08 -0.05 -0.20 0.00 -0.87 0.00 0.00 66.00 64.95 1lth h PRO 109 Cb 0.62 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.55 1lth h PRO 109 CO -0.54 0.59 -0.75 -0.91 -0.23 0.00 0.00 178.00 176.15 1lth h ASN 110 N 0.92 0.70 0.00 1.44 4.21 -1.26 -3.06 115.58 118.54 1lth h ASN 110 Ca 0.43 -0.46 0.00 0.00 1.21 0.00 0.00 56.30 57.48 1lth h ASN 110 Cb 0.41 -0.21 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1lth h ASN 110 CO -0.19 1.23 0.00 0.18 -1.29 0.00 0.00 177.43 177.36 1lth n LEU 111 N -3.88 0.06 0.10 1.61 4.77 0.07 -1.72 117.00 118.00 1lth n LEU 111 Ca -0.06 0.86 0.05 0.00 -0.03 0.00 0.00 56.01 56.83 1lth n LEU 111 Cb 0.73 -0.43 0.24 0.00 -2.33 0.00 0.00 43.42 41.62 1lth n LEU 111 CO 0.50 -0.43 0.68 0.52 -1.33 0.00 0.00 177.39 177.33 1lth n VAL 112 N -1.80 0.95 -0.06 4.08 0.31 -0.35 0.83 118.33 122.28 1lth n VAL 112 Ca 0.00 0.65 -0.21 0.00 -0.01 0.00 0.00 64.34 64.77 1lth n VAL 112 Cb 0.00 -1.65 -0.12 0.00 -0.91 0.00 0.00 33.84 31.16 1lth n VAL 112 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1lth h LYS 113 N 0.00 0.08 0.00 5.55 3.64 -1.51 -3.03 116.57 121.31 1lth h LYS 113 Ca 0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1lth h LYS 113 Cb 0.42 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1lth h LYS 113 CO 0.00 1.07 -0.10 0.28 -2.27 0.00 0.00 179.45 178.42 1lth h VAL 114 N -0.74 0.00 -1.91 2.00 2.07 0.23 -3.37 116.25 114.53 1lth h VAL 114 Ca -0.29 -0.87 -0.53 0.00 0.82 0.00 0.00 66.70 65.82 1lth h VAL 114 Cb 1.43 1.82 -0.38 0.00 -1.52 0.00 0.00 31.29 32.64 1lth h VAL 114 CO -0.09 0.00 -1.09 0.00 0.02 0.00 0.00 177.57 176.41 1lth n ALA 115 N -2.03 2.20 0.21 1.67 0.00 0.24 -2.58 120.51 120.23 1lth n ALA 115 Ca 0.04 -3.31 0.10 0.00 0.00 0.00 0.00 53.44 50.27 1lth n ALA 115 Cb 0.51 -0.85 0.34 0.00 0.00 0.00 0.00 19.45 19.45 1lth n ALA 115 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1lth h PRO 116 N 3.88 0.00 0.00 0.00 0.13 -1.71 -3.33 132.00 130.97 1lth h PRO 116 Ca 0.06 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.17 1lth h PRO 116 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 1lth h PRO 116 CO 0.46 0.22 -1.11 0.09 -0.23 0.00 0.00 178.00 177.42 1lth n ASN 117 N -3.26 0.82 -4.62 1.44 3.02 -1.26 -4.95 115.26 106.44 1lth n ASN 117 Ca 0.01 0.32 -0.33 0.00 -0.03 0.00 0.00 54.58 54.56 1lth n ASN 117 Cb 0.50 0.46 0.13 0.00 -0.61 0.00 0.00 39.78 40.27 1lth n ASN 117 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lth n ALA 118 N -2.22 -0.74 -1.95 5.41 0.00 -1.25 -4.99 120.51 114.77 1lth n ALA 118 Ca -0.02 -0.42 -0.36 0.00 0.00 0.00 0.00 53.44 52.65 1lth n ALA 118 Cb 0.60 -2.13 -0.06 0.00 0.00 0.00 0.00 19.45 17.85 1lth n ALA 118 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1lth s ILE 119 N -2.27 4.42 -0.19 0.00 -1.09 -0.87 -4.89 121.20 116.31 1lth s ILE 119 Ca 0.69 1.47 -0.02 0.00 -2.23 0.00 0.00 60.65 60.56 1lth s ILE 119 Cb -0.27 -3.85 -0.00 0.00 -1.58 0.00 0.00 42.46 36.76 1lth s ILE 119 CO 0.56 0.06 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.91 1lth s TYR 120 N -1.71 2.88 -0.24 3.97 2.02 0.13 -0.79 117.35 123.61 1lth s TYR 120 Ca 0.50 -1.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.16 1lth s TYR 120 Cb -0.15 -2.00 0.06 0.00 -0.40 0.00 0.00 41.96 39.47 1lth s TYR 120 CO 0.20 -0.53 -0.03 1.41 -1.57 0.00 0.00 175.55 175.03 1lth s MET 121 N 1.17 1.43 0.43 -0.62 -2.45 -0.15 -1.69 119.30 117.43 1lth s MET 121 Ca 0.02 -0.97 -0.22 0.00 -1.25 0.00 0.00 55.69 53.27 1lth s MET 121 Cb -0.14 -2.52 -0.10 0.00 1.25 0.00 0.00 34.83 33.32 1lth s MET 121 CO -0.03 -0.65 1.00 -0.51 1.05 0.00 0.00 175.02 175.88 1lth s LEU 122 N 1.44 4.00 -0.15 4.11 1.02 -1.23 -2.80 118.68 125.07 1lth s LEU 122 Ca -0.03 1.86 0.02 0.00 0.02 0.00 0.00 54.13 55.99 1lth s LEU 122 Cb -0.19 -4.41 -0.11 0.00 0.02 0.00 0.00 46.19 41.51 1lth s LEU 122 CO -0.08 -0.48 -0.12 -0.38 0.02 0.00 0.00 176.35 175.31 1lth n ILE 123 N -0.48 0.90 -0.67 -0.59 2.08 0.16 -1.20 119.36 119.56 1lth n ILE 123 Ca 0.07 -0.36 -0.24 0.00 0.56 0.00 0.00 62.75 62.78 1lth n ILE 123 Cb 0.52 -1.02 -0.02 0.00 -0.75 0.00 0.00 39.64 38.37 1lth n ILE 123 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1lth n THR 124 N -2.91 0.82 -3.68 1.39 -1.04 -1.14 -4.39 114.28 103.33 1lth n THR 124 Ca -0.27 -0.20 -0.28 0.00 -2.04 0.00 0.00 64.05 61.25 1lth n THR 124 Cb 0.81 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.28 1lth n THR 124 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1lth s ASN 125 N -0.41 6.40 0.20 8.00 0.01 -1.26 -0.99 114.94 126.89 1lth s ASN 125 Ca 0.32 0.44 -0.30 0.00 -0.71 0.00 0.00 52.86 52.61 1lth s ASN 125 Cb -0.46 -2.03 -0.09 0.00 0.41 0.00 0.00 41.25 39.08 1lth s ASN 125 CO 0.27 -0.03 1.39 -2.16 -1.51 0.00 0.00 177.10 175.06 1lth s PRO 126 N -3.22 4.32 0.09 -0.60 0.04 -1.25 -4.74 135.00 129.63 1lth s PRO 126 Ca 0.39 2.17 -0.15 0.00 0.04 0.00 0.00 61.00 63.45 1lth s PRO 126 Cb -0.11 -3.17 -0.11 0.00 0.04 0.00 0.00 34.50 31.14 1lth s PRO 126 CO 0.28 -0.38 1.37 -0.24 0.04 0.00 0.00 177.00 178.07 1lth h VAL 127 N 3.79 1.32 -0.65 -0.36 3.04 -1.27 -0.87 116.25 121.25 1lth h VAL 127 Ca -0.44 -1.58 0.12 0.00 -1.01 0.00 0.00 66.70 63.78 1lth h VAL 127 Cb 1.21 1.76 -0.09 0.00 -2.01 0.00 0.00 31.29 32.17 1lth h VAL 127 CO 0.80 0.50 0.20 0.44 -1.01 0.00 0.00 177.57 178.50 1lth h ASP 128 N 0.37 0.14 0.64 3.17 3.32 -1.85 0.36 116.42 122.56 1lth h ASP 128 Ca 0.02 0.10 -0.24 0.00 0.02 0.00 0.00 57.03 56.94 1lth h ASP 128 Cb 0.96 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1lth h ASP 128 CO 0.09 0.07 -1.06 0.40 -1.72 0.00 0.00 179.24 177.01 1lth h ILE 129 N 0.35 1.52 -0.21 0.35 2.04 -1.79 -2.55 117.51 117.21 1lth h ILE 129 Ca 0.34 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 63.28 1lth h ILE 129 Cb 0.49 2.73 -0.01 0.00 -0.74 0.00 0.00 36.82 39.29 1lth h ILE 129 CO -0.38 0.85 0.13 0.00 0.00 0.00 0.00 178.15 178.75 1lth h ALA 130 N 0.78 0.27 0.02 1.87 0.00 -0.10 0.74 119.26 122.83 1lth h ALA 130 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1lth h ALA 130 Cb 1.76 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1lth h ALA 130 CO 0.17 -0.24 -0.14 1.15 0.00 0.00 0.00 179.25 180.18 1lth h THR 131 N 0.27 0.00 -0.93 0.00 2.02 -0.38 -2.25 112.91 111.65 1lth h THR 131 Ca 0.08 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.53 1lth h THR 131 Cb -0.01 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.24 1lth h THR 131 CO -0.02 0.00 0.17 -0.74 0.37 0.00 0.00 175.52 175.31 1lth h HIS 132 N -0.19 0.22 -0.21 3.16 6.17 -1.02 0.65 115.15 123.94 1lth h HIS 132 Ca 0.00 0.06 -0.03 0.00 0.71 0.00 0.00 60.37 61.11 1lth h HIS 132 Cb 0.19 0.05 -0.01 0.00 2.52 0.00 0.00 27.41 30.17 1lth h HIS 132 CO -0.37 -0.34 0.00 0.28 0.71 0.00 0.00 177.93 178.21 1lth h VAL 133 N 0.09 1.25 0.00 5.26 2.07 -0.74 -2.55 116.25 121.64 1lth h VAL 133 Ca 0.60 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1lth h VAL 133 Cb 1.28 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.47 1lth h VAL 133 CO -0.78 0.27 -0.06 0.00 0.02 0.00 0.00 177.57 177.02 1lth h ALA 134 N 0.79 1.12 -0.03 1.67 0.00 -0.29 0.45 119.26 122.98 1lth h ALA 134 Ca 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1lth h ALA 134 Cb 0.40 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1lth h ALA 134 CO 0.01 0.07 -0.01 0.37 0.00 0.00 0.00 179.25 179.69 1lth h GLN 135 N 0.00 0.06 0.00 0.00 -0.00 -1.17 -2.79 115.11 111.21 1lth h GLN 135 Ca -0.00 -0.03 -0.08 0.00 -0.00 0.00 0.00 58.65 58.55 1lth h GLN 135 Cb 0.31 -0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.78 1lth h GLN 135 CO 0.01 0.44 -0.36 -0.22 0.00 0.00 0.00 178.83 178.70 1lth h LYS 136 N -0.32 0.00 0.00 1.69 1.63 -0.86 -0.68 116.57 118.03 1lth h LYS 136 Ca 0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1lth h LYS 136 Cb 0.42 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.05 1lth h LYS 136 CO 0.00 0.36 -0.53 -0.11 -3.45 0.00 0.00 179.45 175.73 1lth n LEU 137 N -3.59 0.66 0.00 5.20 7.94 0.15 -4.33 117.00 123.03 1lth n LEU 137 Ca -0.00 0.24 0.00 0.00 -1.11 0.00 0.00 56.01 55.14 1lth n LEU 137 Cb 0.49 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 44.22 1lth n LEU 137 CO 0.37 -0.04 -0.42 0.35 -1.11 0.00 0.00 177.39 176.54 1lth n THR 138 N -2.03 0.00 -1.27 1.96 -2.24 -1.06 -4.74 114.28 104.90 1lth n THR 138 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1lth n THR 138 Cb 0.42 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 1lth n THR 138 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lth n GLY 139 N 2.61 -0.37 2.86 3.38 0.00 -0.26 -5.10 105.19 108.31 1lth n GLY 139 Ca 0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 1lth n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lth s LEU 140 N -1.12 1.28 0.59 0.99 1.43 -1.24 -5.11 118.68 115.50 1lth s LEU 140 Ca 0.00 -0.09 -0.18 0.00 -1.03 0.00 0.00 54.13 52.84 1lth s LEU 140 Cb 0.00 -0.35 -0.08 0.00 0.03 0.00 0.00 46.19 45.79 1lth s LEU 140 CO 0.00 -0.07 0.54 -0.81 0.23 0.00 0.00 176.35 176.24 1lth n PRO 141 N 4.05 0.50 0.00 1.29 -0.04 -1.26 -4.79 135.00 134.76 1lth n PRO 141 Ca -0.26 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1lth n PRO 141 Cb 0.51 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1lth n PRO 141 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1lth n GLU 142 N -0.16 0.00 0.00 0.54 1.02 -1.26 -1.42 120.64 119.35 1lth n GLU 142 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1lth n GLU 142 Cb 0.48 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 1lth n GLU 142 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1lth n ASN 143 N 0.48 2.95 0.08 1.62 6.94 -1.26 -4.50 115.26 121.57 1lth n ASN 143 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 54.58 54.61 1lth n ASN 143 Cb 0.00 0.00 0.48 0.00 -2.36 0.00 0.00 39.78 37.90 1lth n ASN 143 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1lth h GLN 144 N 0.00 0.37 -3.42 -3.83 4.15 -1.47 -2.39 115.11 108.51 1lth h GLN 144 Ca 0.00 -0.03 -0.57 0.00 0.77 0.00 0.00 58.65 58.82 1lth h GLN 144 Cb 0.83 -0.08 -0.40 0.00 0.21 0.00 0.00 27.48 28.04 1lth h GLN 144 CO 0.00 0.26 -0.76 -1.50 -1.93 0.00 0.00 178.83 174.90 1lth s ILE 145 N -5.31 0.69 0.00 2.39 2.07 -1.24 0.22 121.20 120.01 1lth s ILE 145 Ca -0.07 -1.23 0.00 0.00 -1.41 0.00 0.00 60.65 57.93 1lth s ILE 145 Cb 0.17 -1.51 0.00 0.00 0.13 0.00 0.00 42.46 41.25 1lth s ILE 145 CO 0.71 -0.66 0.00 2.22 -1.91 0.00 0.00 174.94 175.31 1lth n PHE 146 N 4.93 0.00 -3.62 3.50 -1.74 -0.68 -4.74 117.46 115.11 1lth n PHE 146 Ca -0.03 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.73 1lth n PHE 146 Cb 0.42 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.37 1lth n PHE 146 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 1lth s GLY 147 N -0.56 -0.34 0.00 4.97 0.00 0.46 -3.50 107.32 108.35 1lth s GLY 147 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.09 1lth s GLY 147 CO 0.00 0.09 0.20 -1.26 0.00 0.00 0.00 173.10 172.14 1lth n SER 148 N 0.36 0.00 0.00 1.64 2.88 -0.34 0.23 113.62 118.39 1lth n SER 148 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1lth n SER 148 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1lth n SER 148 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1lth n GLY 149 N -0.64 1.77 0.98 0.46 0.00 -1.26 -3.66 105.19 102.83 1lth n GLY 149 Ca 0.00 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.19 1lth n GLY 149 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lth n THR 150 N 0.00 1.04 -0.25 2.61 -2.24 -1.13 -4.53 114.28 109.78 1lth n THR 150 Ca 0.00 -1.96 -0.06 0.00 -2.27 0.00 0.00 64.05 59.76 1lth n THR 150 Cb 0.00 0.38 0.05 0.00 -2.10 0.00 0.00 70.33 68.65 1lth n THR 150 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1lth h ASN 151 N 0.88 0.91 0.07 3.42 -1.24 -1.45 0.12 115.58 118.30 1lth h ASN 151 Ca -0.11 -0.15 -0.00 0.00 0.71 0.00 0.00 56.30 56.75 1lth h ASN 151 Cb 1.44 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 40.25 1lth h ASN 151 CO 0.05 0.81 -0.03 0.25 -1.29 0.00 0.00 177.43 177.21 1lth h LEU 152 N 0.96 -0.08 -0.84 0.34 5.85 -1.83 0.55 115.31 120.26 1lth h LEU 152 Ca 0.23 -0.11 0.14 0.00 0.84 0.00 0.00 57.88 58.99 1lth h LEU 152 Cb 0.15 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.11 1lth h LEU 152 CO -0.03 0.06 0.43 0.44 -0.34 0.00 0.00 178.44 179.00 1lth h ASP 153 N -0.22 0.52 -0.15 1.25 3.32 -1.85 -0.44 116.42 118.85 1lth h ASP 153 Ca -0.01 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1lth h ASP 153 Cb 0.18 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1lth h ASP 153 CO 0.02 0.22 0.07 0.28 -1.72 0.00 0.00 179.24 178.10 1lth h SER 154 N 0.62 0.21 -0.35 6.45 0.02 0.81 -2.49 113.55 118.82 1lth h SER 154 Ca 0.45 -0.15 0.10 0.00 -0.84 0.00 0.00 61.79 61.35 1lth h SER 154 Cb 0.63 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 1lth h SER 154 CO -0.36 0.30 0.25 0.00 -1.14 0.00 0.00 176.83 175.88 1lth h ALA 155 N 0.92 2.31 -0.04 3.77 0.00 0.16 -1.46 119.26 124.92 1lth h ALA 155 Ca 0.05 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 1lth h ALA 155 Cb 0.15 0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1lth h ALA 155 CO -0.01 -0.41 -0.94 0.00 0.00 0.00 0.00 179.25 177.90 1lth h ARG 156 N 0.01 0.65 0.92 0.00 3.08 -1.04 -2.30 114.38 115.70 1lth h ARG 156 Ca 0.16 -0.64 -0.04 0.00 0.07 0.00 0.00 59.98 59.53 1lth h ARG 156 Cb 0.64 0.17 0.01 0.00 0.08 0.00 0.00 29.97 30.87 1lth h ARG 156 CO -0.00 1.24 -0.46 1.25 -1.07 0.00 0.00 179.97 180.93 1lth h LEU 157 N 0.39 -1.10 -1.28 3.04 5.85 -0.84 -1.80 115.31 119.57 1lth h LEU 157 Ca -0.09 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.79 1lth h LEU 157 Cb 1.58 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 42.83 1lth h LEU 157 CO 0.18 -0.76 0.56 0.03 -0.34 0.00 0.00 178.44 178.10 1lth h ARG 158 N -1.26 0.73 0.51 1.25 3.08 -1.52 0.02 114.38 117.20 1lth h ARG 158 Ca -0.13 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1lth h ARG 158 Cb 0.97 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.86 1lth h ARG 158 CO 0.19 0.48 -0.25 0.35 -1.07 0.00 0.00 179.97 179.68 1lth h PHE 159 N 0.75 -0.64 -0.45 3.04 3.57 -1.22 -1.32 116.94 120.68 1lth h PHE 159 Ca 0.41 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.86 1lth h PHE 159 Cb 0.56 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 1lth h PHE 159 CO -0.00 -0.38 0.10 -0.07 -2.23 0.00 0.00 178.31 175.73 1lth h LEU 160 N -0.72 0.62 -0.69 0.59 3.38 -0.78 0.13 115.31 117.84 1lth h LEU 160 Ca -0.07 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 1lth h LEU 160 Cb 0.54 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1lth h LEU 160 CO 0.12 0.62 -0.08 0.40 0.09 0.00 0.00 178.44 179.59 1lth h ILE 161 N 0.65 1.26 -0.06 1.22 2.04 -1.03 0.24 117.51 121.83 1lth h ILE 161 Ca 0.15 -1.20 0.01 0.00 1.00 0.00 0.00 64.86 64.82 1lth h ILE 161 Cb 0.26 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1lth h ILE 161 CO -0.00 0.42 0.01 0.00 0.00 0.00 0.00 178.15 178.58 1lth h ALA 162 N 1.06 0.06 -0.38 1.87 0.00 -0.00 0.12 119.26 121.99 1lth h ALA 162 Ca 0.14 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1lth h ALA 162 Cb 0.61 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1lth h ALA 162 CO 0.04 -0.46 0.13 0.37 0.00 0.00 0.00 179.25 179.33 1lth h GLN 163 N 0.04 0.53 0.26 0.00 4.15 -0.66 -1.75 115.11 117.68 1lth h GLN 163 Ca 0.03 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 1lth h GLN 163 Cb 0.02 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.61 1lth h GLN 163 CO -0.04 0.46 -0.12 0.37 -1.93 0.00 0.00 178.83 177.57 1lth h GLN 164 N 0.53 -0.33 0.00 1.69 -0.00 0.67 -3.37 115.11 114.30 1lth h GLN 164 Ca 0.13 0.02 -0.11 0.00 -0.00 0.00 0.00 58.65 58.70 1lth h GLN 164 Cb 0.14 0.08 -0.02 0.00 0.00 0.00 0.00 27.48 27.68 1lth h GLN 164 CO -0.01 0.01 -0.50 1.79 0.00 0.00 0.00 178.83 180.12 1lth h THR 165 N -0.91 0.98 0.00 2.39 1.35 -0.79 -3.46 112.91 112.47 1lth h THR 165 Ca -0.04 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.79 1lth h THR 165 Cb 0.50 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1lth h THR 165 CO 0.06 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.43 1lth n GLY 166 N 0.76 1.00 3.55 5.82 0.00 -0.67 -4.43 105.19 111.22 1lth n GLY 166 Ca 0.01 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1lth n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lth s VAL 167 N -2.00 3.19 0.08 1.61 1.01 -1.17 -5.09 120.40 118.04 1lth s VAL 167 Ca 0.00 -1.33 -0.31 0.00 0.00 0.00 0.00 61.98 60.34 1lth s VAL 167 Cb 0.00 -2.48 -0.07 0.00 0.00 0.00 0.00 36.38 33.83 1lth s VAL 167 CO 0.00 0.12 1.40 0.21 0.00 0.00 0.00 175.10 176.83 1lth s ASN 168 N -2.15 6.83 0.59 3.32 3.84 -1.26 -4.57 114.94 121.54 1lth s ASN 168 Ca 0.20 2.27 0.29 0.00 0.21 0.00 0.00 52.86 55.82 1lth s ASN 168 Cb -0.11 -2.58 1.46 0.00 -0.55 0.00 0.00 41.25 39.47 1lth s ASN 168 CO 0.12 -0.68 1.87 1.62 -2.79 0.00 0.00 177.10 177.25 1lth h VAL 169 N 4.47 0.32 0.00 -5.21 3.04 -1.90 0.04 116.25 117.01 1lth h VAL 169 Ca -0.41 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1lth h VAL 169 Cb 1.20 0.59 0.00 0.00 -2.01 0.00 0.00 31.29 31.07 1lth h VAL 169 CO 0.88 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 177.73 1lth n LYS 170 N -3.64 0.04 0.00 4.17 5.02 -1.26 -2.19 118.16 120.30 1lth n LYS 170 Ca 0.08 0.27 0.08 0.00 -2.02 0.00 0.00 58.31 56.73 1lth n LYS 170 Cb 0.69 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.16 1lth n LYS 170 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1lth n ASN 171 N -1.45 1.40 -4.75 4.39 5.03 -0.00 -4.93 115.26 114.95 1lth n ASN 171 Ca 0.03 -1.20 -0.38 0.00 0.87 0.00 0.00 54.58 53.91 1lth n ASN 171 Cb 0.13 0.65 -0.06 0.00 -1.02 0.00 0.00 39.78 39.48 1lth n ASN 171 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1lth s VAL 172 N -2.20 5.16 -0.43 2.41 1.01 -0.93 -4.37 120.40 121.04 1lth s VAL 172 Ca 0.12 0.88 0.09 0.00 0.00 0.00 0.00 61.98 63.06 1lth s VAL 172 Cb 0.14 -3.77 0.41 0.00 0.00 0.00 0.00 36.38 33.15 1lth s VAL 172 CO 0.52 0.39 1.01 1.41 0.00 0.00 0.00 175.10 178.43 1lth n HIS 173 N 3.26 2.70 -2.77 5.22 8.25 -0.98 -4.92 115.22 125.98 1lth n HIS 173 Ca -0.09 -3.27 -0.31 0.00 -0.26 0.00 0.00 57.72 53.79 1lth n HIS 173 Cb 0.52 -0.26 -0.04 0.00 1.12 0.00 0.00 29.99 31.33 1lth n HIS 173 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1lth s ALA 174 N -3.33 3.23 0.48 -1.41 0.00 -1.26 -4.00 121.76 115.48 1lth s ALA 174 Ca 0.42 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.42 1lth s ALA 174 Cb 0.39 -2.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 1lth s ALA 174 CO -0.12 0.00 0.03 0.71 0.00 0.00 0.00 175.76 176.38 1lth s TYR 175 N -2.36 1.90 -0.17 0.00 1.51 -1.26 -4.74 117.35 112.23 1lth s TYR 175 Ca 0.55 -0.99 -0.04 0.00 -1.01 0.00 0.00 57.07 55.57 1lth s TYR 175 Cb -0.10 -1.54 0.08 0.00 -0.11 0.00 0.00 41.96 40.30 1lth s TYR 175 CO 0.27 0.15 0.28 0.42 -1.11 0.00 0.00 175.55 175.55 1lth s ILE 176 N -2.93 -0.43 0.39 2.71 1.01 -1.26 -2.05 121.20 118.64 1lth s ILE 176 Ca 0.12 0.11 0.08 0.00 0.00 0.00 0.00 60.65 60.95 1lth s ILE 176 Cb 0.02 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 41.90 1lth s ILE 176 CO 0.06 -0.01 0.35 0.00 0.00 0.00 0.00 174.94 175.34 1lth s ALA 177 N 2.42 3.99 0.00 9.38 0.00 -0.39 -4.75 121.76 132.41 1lth s ALA 177 Ca 0.04 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.19 1lth s ALA 177 Cb -0.14 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1lth s ALA 177 CO -0.11 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1lth n GLY 178 N -1.49 0.04 3.71 0.00 0.00 0.95 -1.06 105.19 107.34 1lth n GLY 178 Ca 0.02 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 1lth n GLY 178 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lth s GLU 179 N 0.00 4.33 -1.15 1.61 2.12 -1.26 -3.25 118.70 121.11 1lth s GLU 179 Ca 0.00 2.04 -0.20 0.00 0.36 0.00 0.00 54.97 57.17 1lth s GLU 179 Cb 0.00 -3.26 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 1lth s GLU 179 CO 0.00 -0.42 1.96 1.58 -0.54 0.00 0.00 175.26 177.84 1lth n HIS 180 N 3.96 3.07 -1.82 5.30 -0.00 -1.26 -3.89 115.22 120.57 1lth n HIS 180 Ca 0.11 -2.21 0.00 0.00 -0.00 0.00 0.00 57.72 55.62 1lth n HIS 180 Cb 0.43 -2.33 0.00 0.00 -0.00 0.00 0.00 29.99 28.09 1lth n HIS 180 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1lth n GLY 181 N 4.94 2.32 0.14 1.57 0.00 -1.26 -4.79 105.19 108.11 1lth n GLY 181 Ca 0.49 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1lth n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lth n ASP 182 N 0.00 0.64 -1.51 1.61 9.92 -1.26 -3.42 116.55 122.54 1lth n ASP 182 Ca 0.00 0.68 -0.12 0.00 -0.53 0.00 0.00 54.79 54.82 1lth n ASP 182 Cb 0.00 -0.81 0.16 0.00 -0.64 0.00 0.00 41.12 39.84 1lth n ASP 182 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1lth n SER 183 N -2.24 3.38 -4.78 -2.24 3.41 -1.26 -5.04 113.62 104.86 1lth n SER 183 Ca 0.01 -3.77 -0.33 0.00 -0.26 0.00 0.00 58.87 54.52 1lth n SER 183 Cb 0.19 -0.66 0.04 0.00 -0.26 0.00 0.00 64.21 63.52 1lth n SER 183 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1lth s GLU 184 N -3.36 2.93 -0.37 4.33 2.02 -1.22 -4.50 118.70 118.53 1lth s GLU 184 Ca 0.49 1.38 -0.02 0.00 0.02 0.00 0.00 54.97 56.84 1lth s GLU 184 Cb 0.43 -1.97 0.09 0.00 0.10 0.00 0.00 34.13 32.78 1lth s GLU 184 CO 0.01 -1.15 0.12 0.08 0.02 0.00 0.00 175.26 174.35 1lth s VAL 185 N -2.30 3.09 -0.53 2.63 1.01 -0.23 -4.97 120.40 119.10 1lth s VAL 185 Ca 0.67 -1.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.48 1lth s VAL 185 Cb -0.20 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.18 1lth s VAL 185 CO 0.39 -0.50 1.19 -2.84 0.00 0.00 0.00 175.10 173.34 1lth s PRO 186 N 1.15 3.59 -1.52 2.72 0.02 -1.26 -1.27 135.00 138.43 1lth s PRO 186 Ca 0.05 0.41 -0.11 0.00 0.02 0.00 0.00 61.00 61.36 1lth s PRO 186 Cb -0.21 -3.98 -0.01 0.00 0.02 0.00 0.00 34.50 30.32 1lth s PRO 186 CO -0.04 -1.57 2.56 1.28 -0.33 0.00 0.00 177.00 178.90 1lth n LEU 187 N 8.26 7.80 0.25 -5.54 4.77 -0.87 -4.68 117.00 126.98 1lth n LEU 187 Ca 0.10 -4.31 0.18 0.00 -0.03 0.00 0.00 56.01 51.95 1lth n LEU 187 Cb 0.49 -1.59 0.88 0.00 -2.33 0.00 0.00 43.42 40.87 1lth n LEU 187 CO 0.72 1.62 1.15 -0.50 -1.33 0.00 0.00 177.39 179.05 1lth h TRP 188 N 5.46 0.00 -0.32 -1.77 4.06 -1.92 -2.29 115.95 119.17 1lth h TRP 188 Ca 0.71 0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.69 1lth h TRP 188 Cb 0.46 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.56 1lth h TRP 188 CO 1.65 0.00 -0.33 1.49 -3.56 0.00 0.00 178.44 177.69 1lth h GLU 189 N 0.00 -0.18 -0.05 0.49 4.81 -1.90 -2.37 114.58 115.38 1lth h GLU 189 Ca 0.06 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1lth h GLU 189 Cb 0.55 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1lth h GLU 189 CO -0.00 -0.12 0.00 -1.13 -0.73 0.00 0.00 179.01 177.03 1lth n SER 190 N -4.29 0.92 -4.63 1.04 3.41 -0.87 -4.72 113.62 104.49 1lth n SER 190 Ca -0.01 -1.43 -0.43 0.00 -0.26 0.00 0.00 58.87 56.74 1lth n SER 190 Cb 0.19 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 1lth n SER 190 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lth s ALA 191 N -1.94 3.29 0.13 7.33 0.00 -0.89 -4.77 121.76 124.90 1lth s ALA 191 Ca 0.37 0.19 0.07 0.00 0.00 0.00 0.00 51.96 52.58 1lth s ALA 191 Cb 0.19 -3.82 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 1lth s ALA 191 CO 0.30 -1.91 -0.16 0.95 0.00 0.00 0.00 175.76 174.94 1lth s THR 192 N 4.80 1.46 -0.38 0.00 -4.23 -1.26 -0.12 115.64 115.91 1lth s THR 192 Ca 0.62 -1.72 0.01 0.00 -1.18 0.00 0.00 61.69 59.42 1lth s THR 192 Cb -0.19 -1.58 0.13 0.00 1.34 0.00 0.00 72.50 72.20 1lth s THR 192 CO 0.26 -0.35 0.19 -0.63 -0.54 0.00 0.00 174.62 173.55 1lth s ILE 193 N -1.97 1.01 -0.43 2.99 1.01 -1.12 -2.31 121.20 120.39 1lth s ILE 193 Ca 0.10 -2.04 -0.01 0.00 0.00 0.00 0.00 60.65 58.69 1lth s ILE 193 Cb -0.06 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 40.68 1lth s ILE 193 CO 0.04 -0.84 0.36 0.61 0.00 0.00 0.00 174.94 175.11 1lth n GLY 194 N 4.04 0.31 4.19 6.18 0.00 -1.26 -3.69 105.19 114.96 1lth n GLY 194 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1lth n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lth n GLY 195 N -1.02 1.05 3.57 -0.02 0.00 -1.26 -4.91 105.19 102.59 1lth n GLY 195 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1lth n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lth s VAL 196 N 0.00 3.08 0.58 1.61 1.01 -1.24 -4.95 120.40 120.49 1lth s VAL 196 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 1lth s VAL 196 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1lth s VAL 196 CO 0.00 -0.14 1.33 -2.84 0.00 0.00 0.00 175.10 173.45 1lth s PRO 197 N 7.36 2.95 0.09 2.72 0.02 -1.26 -2.79 135.00 144.09 1lth s PRO 197 Ca 0.94 2.16 -0.21 0.00 0.02 0.00 0.00 61.00 63.91 1lth s PRO 197 Cb -0.22 -2.11 -0.06 0.00 0.02 0.00 0.00 34.50 32.13 1lth s PRO 197 CO 0.29 -1.32 1.36 1.98 -0.33 0.00 0.00 177.00 178.97 1lth h MET 198 N 1.15 -0.16 -1.13 5.54 4.05 -0.76 0.22 114.93 123.84 1lth h MET 198 Ca -0.51 0.01 0.36 0.00 -0.28 0.00 0.00 59.70 59.28 1lth h MET 198 Cb 1.31 0.04 -0.13 0.00 -0.80 0.00 0.00 31.60 32.02 1lth h MET 198 CO 0.56 -0.11 0.69 0.66 0.23 0.00 0.00 176.91 178.94 1lth h SER 199 N -0.17 0.39 -0.72 1.39 4.64 -1.84 0.35 113.55 117.60 1lth h SER 199 Ca 0.07 0.15 -0.28 0.00 -0.47 0.00 0.00 61.79 61.25 1lth h SER 199 Cb 0.35 0.11 -0.17 0.00 -0.31 0.00 0.00 62.40 62.38 1lth h SER 199 CO -0.47 -0.12 0.36 0.47 -0.87 0.00 0.00 176.83 176.20 1lth n ASP 200 N -4.84 4.15 -4.70 4.97 8.00 0.77 -4.94 116.55 119.96 1lth n ASP 200 Ca 0.33 -3.16 -0.42 0.00 0.71 0.00 0.00 54.79 52.24 1lth n ASP 200 Cb 1.14 -0.74 -0.03 0.00 -0.02 0.00 0.00 41.12 41.47 1lth n ASP 200 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1lth s TRP 201 N -2.70 3.23 -0.41 1.24 -0.11 0.12 -4.81 118.94 115.51 1lth s TRP 201 Ca 0.48 1.19 -0.24 0.00 1.22 0.00 0.00 56.10 58.74 1lth s TRP 201 Cb 0.39 -3.46 0.02 0.00 -1.50 0.00 0.00 33.47 28.92 1lth s TRP 201 CO 0.11 -1.47 0.83 0.99 -4.62 0.00 0.00 176.95 172.79 1lth s THR 202 N 1.81 4.63 0.37 5.86 2.01 -1.26 -4.68 115.64 124.39 1lth s THR 202 Ca 0.58 0.78 -0.28 0.00 0.31 0.00 0.00 61.69 63.09 1lth s THR 202 Cb -0.27 -4.30 -0.10 0.00 0.01 0.00 0.00 72.50 67.83 1lth s THR 202 CO 0.25 -0.61 1.36 -2.16 -0.69 0.00 0.00 174.62 172.78 1lth s PRO 203 N 3.34 4.13 0.45 4.92 0.04 -1.26 -4.95 135.00 141.67 1lth s PRO 203 Ca 0.33 2.31 -0.25 0.00 0.04 0.00 0.00 61.00 63.43 1lth s PRO 203 Cb -0.12 -2.92 -0.08 0.00 0.04 0.00 0.00 34.50 31.41 1lth s PRO 203 CO 0.21 -0.41 1.35 -0.11 0.04 0.00 0.00 177.00 178.07 1lth n LEU 204 N 0.44 4.68 -4.60 -3.56 7.94 -1.26 -4.85 117.00 115.79 1lth n LEU 204 Ca 0.02 1.09 -0.49 0.00 -1.11 0.00 0.00 56.01 55.51 1lth n LEU 204 Cb 0.42 -1.55 -0.05 0.00 0.53 0.00 0.00 43.42 42.77 1lth n LEU 204 CO 0.59 -0.45 0.85 -2.65 -1.11 0.00 0.00 177.39 174.62 1lth n PRO 205 N -0.21 1.32 -0.55 1.96 -0.01 -1.26 -0.32 135.00 135.93 1lth n PRO 205 Ca 0.07 0.47 0.00 0.00 -0.01 0.00 0.00 63.50 64.03 1lth n PRO 205 Cb 0.41 -2.06 0.00 0.00 -0.01 0.00 0.00 33.50 31.84 1lth n PRO 205 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1lth n GLY 206 N 2.32 0.75 3.30 -1.23 0.00 -1.26 -5.04 105.19 104.03 1lth n GLY 206 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 1lth n GLY 206 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1lth s HIS 207 N -2.51 1.52 0.37 1.61 3.76 0.57 -5.15 115.29 115.46 1lth s HIS 207 Ca 0.00 -0.63 0.07 0.00 -0.15 0.00 0.00 55.06 54.35 1lth s HIS 207 Cb 0.00 -0.74 -0.00 0.00 1.11 0.00 0.00 32.58 32.95 1lth s HIS 207 CO 0.00 0.23 0.50 -0.51 -0.85 0.00 0.00 174.74 174.11 1lth s ASP 208 N -3.11 5.79 0.43 1.40 1.11 -1.26 -4.62 116.67 116.41 1lth s ASP 208 Ca 0.18 -0.31 -0.15 0.00 0.18 0.00 0.00 52.55 52.46 1lth s ASP 208 Cb -0.00 -0.98 -0.08 0.00 1.07 0.00 0.00 42.92 42.93 1lth s ASP 208 CO 0.04 -0.56 0.87 -2.16 1.18 0.00 0.00 175.17 174.53 1lth s PRO 209 N -4.23 3.94 -1.26 8.23 0.04 -1.26 -4.74 135.00 135.71 1lth s PRO 209 Ca 0.49 0.77 -0.13 0.00 0.04 0.00 0.00 61.00 62.17 1lth s PRO 209 Cb -0.09 -2.28 0.15 0.00 0.04 0.00 0.00 34.50 32.32 1lth s PRO 209 CO 0.32 -0.09 1.67 -0.11 0.04 0.00 0.00 177.00 178.83 1lth n LEU 210 N -1.16 5.78 -4.90 -3.56 7.94 -1.26 -4.89 117.00 114.94 1lth n LEU 210 Ca 0.05 -4.44 -0.29 0.00 -1.11 0.00 0.00 56.01 50.22 1lth n LEU 210 Cb 0.54 -1.59 0.05 0.00 0.53 0.00 0.00 43.42 42.94 1lth n LEU 210 CO 0.45 0.90 0.67 1.51 -1.11 0.00 0.00 177.39 179.81 1lth s ASP 211 N 2.36 5.39 0.26 1.96 1.47 -1.26 -4.71 116.67 122.15 1lth s ASP 211 Ca 0.43 0.93 -0.02 0.00 1.18 0.00 0.00 52.55 55.08 1lth s ASP 211 Cb 0.03 -1.76 0.54 0.00 -0.34 0.00 0.00 42.92 41.39 1lth s ASP 211 CO 0.01 -1.30 1.72 0.00 0.68 0.00 0.00 175.17 176.28 1lth h ALA 212 N -0.52 1.18 -0.11 2.11 0.00 -1.96 0.37 119.26 120.32 1lth h ALA 212 Ca -0.45 0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.60 1lth h ALA 212 Cb 1.26 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1lth h ALA 212 CO 0.63 -0.23 -0.20 -0.44 0.00 0.00 0.00 179.25 179.01 1lth h ASP 213 N 0.45 -0.65 -0.63 0.00 3.32 -1.98 0.61 116.42 117.54 1lth h ASP 213 Ca 0.46 0.08 0.08 0.00 0.02 0.00 0.00 57.03 57.67 1lth h ASP 213 Cb 0.74 0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.52 1lth h ASP 213 CO -0.44 -0.15 0.42 0.50 -1.72 0.00 0.00 179.24 177.85 1lth h LYS 214 N -0.16 0.55 0.50 3.56 1.63 -1.76 -2.23 116.57 118.66 1lth h LYS 214 Ca 0.02 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 1lth h LYS 214 Cb 0.22 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1lth h LYS 214 CO -0.19 0.36 -0.24 -0.09 -3.45 0.00 0.00 179.45 175.84 1lth h ARG 215 N 0.57 -0.65 -0.83 1.90 2.43 0.24 0.18 114.38 118.22 1lth h ARG 215 Ca 0.28 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.56 1lth h ARG 215 Cb 0.37 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 30.00 1lth h ARG 215 CO -0.09 -0.34 0.51 1.49 -1.51 0.00 0.00 179.97 180.03 1lth h GLU 216 N -0.95 0.90 -0.43 0.20 4.22 0.14 0.12 114.58 118.79 1lth h GLU 216 Ca -0.07 -0.05 0.06 0.00 0.08 0.00 0.00 59.36 59.38 1lth h GLU 216 Cb 0.60 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1lth h GLU 216 CO 0.11 0.59 0.12 1.49 -2.18 0.00 0.00 179.01 179.15 1lth h GLU 217 N 0.93 0.26 -0.82 1.92 4.22 -1.18 0.31 114.58 120.21 1lth h GLU 217 Ca 0.36 -0.02 0.07 0.00 0.08 0.00 0.00 59.36 59.85 1lth h GLU 217 Cb 0.18 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 1lth h GLU 217 CO -0.18 0.17 0.50 0.82 -2.18 0.00 0.00 179.01 178.14 1lth h ILE 218 N 0.26 1.01 0.00 2.32 2.04 -0.11 -1.85 117.51 121.19 1lth h ILE 218 Ca 0.20 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 1lth h ILE 218 Cb 0.23 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1lth h ILE 218 CO -0.24 0.16 -0.01 -0.74 0.00 0.00 0.00 178.15 177.33 1lth h HIS 219 N 0.90 0.00 0.17 1.37 -0.00 0.21 -2.64 115.15 115.16 1lth h HIS 219 Ca 0.36 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.73 1lth h HIS 219 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1lth h HIS 219 CO -0.04 0.01 -0.08 1.96 -0.00 0.00 0.00 177.93 179.77 1lth h GLN 220 N 0.00 -0.22 -0.96 5.26 1.08 0.29 -3.14 115.11 117.42 1lth h GLN 220 Ca -0.00 0.02 0.15 0.00 -1.45 0.00 0.00 58.65 57.37 1lth h GLN 220 Cb 0.27 0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 27.66 1lth h GLN 220 CO 0.00 0.16 0.61 0.93 -0.95 0.00 0.00 178.83 179.58 1lth h GLU 221 N -0.93 0.77 -0.29 1.46 5.08 -1.38 -0.27 114.58 119.02 1lth h GLU 221 Ca -0.02 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1lth h GLU 221 Cb 0.48 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1lth h GLU 221 CO 0.04 0.51 0.17 0.28 -1.00 0.00 0.00 179.01 179.00 1lth h VAL 222 N 0.79 1.11 0.00 3.13 2.07 -1.54 0.61 116.25 122.43 1lth h VAL 222 Ca 0.51 -0.29 -0.11 0.00 0.82 0.00 0.00 66.70 67.63 1lth h VAL 222 Cb 0.73 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1lth h VAL 222 CO -0.27 0.11 -0.52 0.07 0.02 0.00 0.00 177.57 176.98 1lth h LYS 223 N 0.36 0.00 -0.00 1.57 2.10 -1.38 -3.09 116.57 116.13 1lth h LYS 223 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1lth h LYS 223 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 1lth h LYS 223 CO -0.02 0.52 -0.17 0.09 -2.00 0.00 0.00 179.45 177.87 1lth n ASN 224 N -3.36 0.60 -0.17 7.07 3.02 -0.16 -4.40 115.26 117.86 1lth n ASN 224 Ca 0.01 -0.59 -0.11 0.00 -0.03 0.00 0.00 54.58 53.86 1lth n ASN 224 Cb 0.68 -0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.76 1lth n ASN 224 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lth h ALA 225 N 3.56 -0.55 -0.46 5.41 0.00 0.29 -0.62 119.26 126.89 1lth h ALA 225 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1lth h ALA 225 Cb 0.41 1.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.16 1lth h ALA 225 CO 0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 179.25 178.31 1lth h ALA 226 N 0.29 0.43 -0.62 0.00 0.00 -1.83 -0.96 119.26 116.57 1lth h ALA 226 Ca 0.13 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 1lth h ALA 226 Cb 0.58 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1lth h ALA 226 CO -0.64 -0.39 0.02 1.88 0.00 0.00 0.00 179.25 180.12 1lth h TYR 227 N 0.11 1.17 0.00 0.00 0.05 -1.70 0.15 116.97 116.75 1lth h TYR 227 Ca 0.23 -0.19 -0.05 0.00 0.05 0.00 0.00 58.73 58.76 1lth h TYR 227 Cb 0.34 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 1lth h TYR 227 CO -0.30 1.02 -0.26 -0.22 -1.05 0.00 0.00 178.16 177.35 1lth h LYS 228 N 0.99 0.00 0.13 4.88 3.64 -0.39 -2.64 116.57 123.18 1lth h LYS 228 Ca 0.18 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.37 1lth h LYS 228 Cb 0.54 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1lth h LYS 228 CO 0.03 0.26 -0.87 0.82 -2.27 0.00 0.00 179.45 177.42 1lth h ILE 229 N 0.00 1.46 -0.64 2.00 2.04 -0.68 -3.32 117.51 118.37 1lth h ILE 229 Ca -0.00 -2.52 0.01 0.00 1.00 0.00 0.00 64.86 63.35 1lth h ILE 229 Cb 0.46 3.15 -0.03 0.00 -0.74 0.00 0.00 36.82 39.66 1lth h ILE 229 CO 0.03 0.71 0.42 0.40 0.00 0.00 0.00 178.15 179.72 1lth h ILE 230 N -0.39 1.15 0.00 -0.67 2.04 -0.68 0.65 117.51 119.62 1lth h ILE 230 Ca -0.16 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1lth h ILE 230 Cb 1.64 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1lth h ILE 230 CO 0.14 0.15 0.00 0.78 0.00 0.00 0.00 178.15 179.22 1lth h ASN 231 N 0.85 0.00 0.00 1.72 2.35 -1.58 0.08 115.58 119.00 1lth h ASN 231 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 1lth h ASN 231 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1lth h ASN 231 CO -0.05 0.00 -1.22 0.61 -1.65 0.00 0.00 177.43 175.12 1lth n GLY 232 N -0.71 -0.32 0.15 2.83 0.00 0.05 -4.80 105.19 102.40 1lth n GLY 232 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1lth n GLY 232 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1lth n LYS 233 N -1.70 0.00 0.00 1.61 2.85 -0.22 -5.04 118.16 115.67 1lth n LYS 233 Ca -0.01 -0.25 0.00 0.00 -1.05 0.00 0.00 58.31 57.00 1lth n LYS 233 Cb 0.23 -0.19 0.00 0.00 -0.65 0.00 0.00 35.03 34.42 1lth n LYS 233 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1lth n GLY 234 N 0.00 2.11 3.57 2.58 0.00 0.01 -4.85 105.19 108.61 1lth n GLY 234 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1lth n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lth s ALA 235 N -0.70 -0.91 -0.05 4.61 0.00 -1.26 -4.80 121.76 118.65 1lth s ALA 235 Ca 0.00 -0.29 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1lth s ALA 235 Cb 0.00 0.88 -0.00 0.00 0.00 0.00 0.00 23.12 24.00 1lth s ALA 235 CO 0.00 -0.84 -0.17 0.95 0.00 0.00 0.00 175.76 175.70 1lth s THR 236 N -3.89 1.46 0.00 0.00 -4.23 -1.26 -4.58 115.64 103.14 1lth s THR 236 Ca 0.11 -0.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1lth s THR 236 Cb -0.02 -1.27 0.00 0.00 1.34 0.00 0.00 72.50 72.56 1lth s THR 236 CO -0.01 0.42 0.00 -0.46 -0.54 0.00 0.00 174.62 174.04 1lth n ASN 237 N 3.25 0.00 0.09 3.99 6.94 -1.26 -4.69 115.26 123.59 1lth n ASN 237 Ca -0.19 0.00 -0.04 0.00 -0.02 0.00 0.00 54.58 54.33 1lth n ASN 237 Cb 0.53 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.93 1lth n ASN 237 CO 0.00 0.00 0.00 1.88 -1.03 0.00 0.00 177.26 178.11 1lth h TYR 238 N 0.00 -0.23 -0.79 -2.53 0.05 -1.94 -1.58 116.97 109.95 1lth h TYR 238 Ca 0.00 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 58.91 1lth h TYR 238 Cb 0.00 0.08 -0.09 0.00 1.01 0.00 0.00 36.73 37.73 1lth h TYR 238 CO 0.00 -0.14 0.37 0.00 -1.05 0.00 0.00 178.16 177.34 1lth h ALA 239 N -1.77 1.14 0.00 3.88 0.00 -1.99 -1.43 119.26 119.08 1lth h ALA 239 Ca -0.03 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1lth h ALA 239 Cb 0.19 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1lth h ALA 239 CO 0.04 -0.13 -0.44 0.97 0.00 0.00 0.00 179.25 179.69 1lth h ILE 240 N 0.55 0.98 -0.46 0.00 6.09 -1.92 0.53 117.51 123.28 1lth h ILE 240 Ca 0.42 -1.73 -0.09 0.00 -1.37 0.00 0.00 64.86 62.09 1lth h ILE 240 Cb 0.59 2.04 -0.01 0.00 0.47 0.00 0.00 36.82 39.91 1lth h ILE 240 CO -0.36 0.43 -0.07 1.23 -3.07 0.00 0.00 178.15 176.31 1lth h GLY 241 N 2.22 0.93 0.79 8.18 0.00 -0.22 -0.28 103.07 114.69 1lth h GLY 241 Ca -0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.59 1lth h GLY 241 CO 0.06 0.67 0.00 -0.33 0.00 0.00 0.00 176.54 176.94 1lth h MET 242 N 0.70 0.00 -0.57 4.80 2.86 -1.04 -1.72 114.93 119.96 1lth h MET 242 Ca 0.12 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1lth h MET 242 Cb 0.60 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 1lth h MET 242 CO 0.04 0.21 0.38 1.03 1.06 0.00 0.00 176.91 179.63 1lth h SER 243 N -0.20 0.65 -0.10 1.22 0.87 -0.69 0.52 113.55 115.81 1lth h SER 243 Ca 0.00 -0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.44 1lth h SER 243 Cb 0.21 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1lth h SER 243 CO -0.00 0.47 -0.35 1.23 -0.53 0.00 0.00 176.83 177.65 1lth h GLY 244 N 0.77 0.47 1.12 5.77 0.00 -1.02 -1.65 103.07 108.53 1lth h GLY 244 Ca 0.21 -0.61 0.05 0.00 0.00 0.00 0.00 47.33 46.98 1lth h GLY 244 CO -0.05 0.55 0.45 -2.08 0.00 0.00 0.00 176.54 175.41 1lth h VAL 245 N -0.01 1.04 0.19 4.60 2.07 -0.27 0.44 116.25 124.31 1lth h VAL 245 Ca -0.01 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.26 1lth h VAL 245 Cb 0.98 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1lth h VAL 245 CO 0.07 0.14 -0.23 -0.78 0.02 0.00 0.00 177.57 176.79 1lth h ASP 246 N 0.75 -0.63 -0.69 0.57 3.58 0.23 -2.16 116.42 118.07 1lth h ASP 246 Ca 0.29 0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.76 1lth h ASP 246 Cb 0.20 0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.44 1lth h ASP 246 CO -0.09 -0.33 0.29 0.40 -2.88 0.00 0.00 179.24 176.62 1lth h ILE 247 N -0.47 1.24 -0.77 2.25 2.04 -0.21 -2.46 117.51 119.13 1lth h ILE 247 Ca 0.01 -0.75 0.07 0.00 1.00 0.00 0.00 64.86 65.19 1lth h ILE 247 Cb 0.46 0.39 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 1lth h ILE 247 CO -0.08 0.30 0.45 0.40 0.00 0.00 0.00 178.15 179.22 1lth h ILE 248 N 1.03 0.97 0.36 -0.67 2.04 0.20 -2.04 117.51 119.39 1lth h ILE 248 Ca 0.24 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1lth h ILE 248 Cb 0.19 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1lth h ILE 248 CO -0.02 0.15 -0.17 -0.08 0.00 0.00 0.00 178.15 178.02 1lth h GLU 249 N 0.80 -0.46 -0.79 2.37 4.22 -0.95 0.81 114.58 120.58 1lth h GLU 249 Ca 0.35 0.03 0.19 0.00 0.08 0.00 0.00 59.36 60.01 1lth h GLU 249 Cb 0.24 0.11 -0.12 0.00 0.50 0.00 0.00 28.75 29.47 1lth h GLU 249 CO -0.20 -0.24 0.17 0.00 -2.18 0.00 0.00 179.01 176.56 1lth h ALA 250 N -0.00 1.03 0.36 2.92 0.00 -1.10 0.63 119.26 123.09 1lth h ALA 250 Ca -0.05 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1lth h ALA 250 Cb 0.44 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1lth h ALA 250 CO 0.08 -0.39 -0.17 0.28 0.00 0.00 0.00 179.25 179.05 1lth h VAL 251 N 0.22 0.00 -0.28 0.00 2.07 -1.23 -2.79 116.25 114.24 1lth h VAL 251 Ca 0.46 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1lth h VAL 251 Cb 0.84 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1lth h VAL 251 CO -0.58 0.00 0.19 -0.07 0.02 0.00 0.00 177.57 177.13 1lth h LEU 252 N -1.08 0.24 -3.62 2.57 3.38 -0.30 -1.88 115.31 114.61 1lth h LEU 252 Ca -0.05 -0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.54 1lth h LEU 252 Cb 0.37 -0.06 -0.22 0.00 0.09 0.00 0.00 40.66 40.83 1lth h LEU 252 CO 0.08 0.17 0.48 1.41 0.09 0.00 0.00 178.44 180.66 1lth n HIS 253 N -4.49 2.49 -3.92 1.13 8.25 0.17 -4.90 115.22 113.95 1lth n HIS 253 Ca 0.02 -1.49 -0.31 0.00 -0.26 0.00 0.00 57.72 55.68 1lth n HIS 253 Cb 0.15 -0.79 0.00 0.00 1.12 0.00 0.00 29.99 30.48 1lth n HIS 253 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1lth n ASP 254 N -0.69 -4.14 -0.01 0.41 -0.08 -0.74 -4.88 116.55 106.42 1lth n ASP 254 Ca 0.47 -0.78 -0.13 0.00 -1.51 0.00 0.00 54.79 52.84 1lth n ASP 254 Cb 1.44 -3.35 -0.00 0.00 2.34 0.00 0.00 41.12 41.55 1lth n ASP 254 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1lth h THR 255 N -1.66 1.31 -4.10 5.18 1.35 -1.65 -3.44 112.91 109.90 1lth h THR 255 Ca -0.56 -1.89 -0.38 0.00 -0.55 0.00 0.00 66.41 63.03 1lth h THR 255 Cb 1.36 1.85 0.05 0.00 -1.73 0.00 0.00 68.15 69.68 1lth h THR 255 CO 0.69 0.59 -0.57 0.59 -0.25 0.00 0.00 175.52 176.57 1lth n ASN 256 N -3.94 -5.86 -4.90 5.36 3.02 0.46 -4.99 115.26 104.41 1lth n ASN 256 Ca -0.05 -0.25 -0.29 0.00 -0.03 0.00 0.00 54.58 53.97 1lth n ASN 256 Cb 0.66 -4.70 -0.02 0.00 -0.61 0.00 0.00 39.78 35.11 1lth n ASN 256 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1lth s ARG 257 N -5.57 3.65 -0.19 3.52 0.52 -1.09 -4.77 118.95 115.02 1lth s ARG 257 Ca 0.26 0.23 -0.06 0.00 -0.52 0.00 0.00 55.73 55.65 1lth s ARG 257 Cb -0.12 -2.45 -0.03 0.00 0.52 0.00 0.00 34.95 32.87 1lth s ARG 257 CO 0.32 -0.03 0.02 0.42 0.02 0.00 0.00 175.30 176.05 1lth s ILE 258 N -2.44 4.31 0.04 1.52 1.01 -1.26 -0.94 121.20 123.44 1lth s ILE 258 Ca 0.48 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.93 1lth s ILE 258 Cb -0.10 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 1lth s ILE 258 CO 0.36 0.45 -0.04 -0.76 0.00 0.00 0.00 174.94 174.95 1lth s LEU 259 N 0.63 2.33 -0.62 2.97 1.02 -0.08 -4.96 118.68 119.97 1lth s LEU 259 Ca 0.01 -0.68 -0.27 0.00 0.02 0.00 0.00 54.13 53.21 1lth s LEU 259 Cb -0.14 0.07 -0.01 0.00 0.02 0.00 0.00 46.19 46.13 1lth s LEU 259 CO 0.02 -0.38 1.76 -2.84 0.02 0.00 0.00 176.35 174.93 1lth s PRO 260 N -2.32 2.76 0.00 1.29 0.02 -1.26 0.12 135.00 135.61 1lth s PRO 260 Ca -0.07 0.52 0.00 0.00 0.02 0.00 0.00 61.00 61.47 1lth s PRO 260 Cb -0.04 -4.34 0.00 0.00 0.02 0.00 0.00 34.50 30.14 1lth s PRO 260 CO -0.03 -2.59 0.00 1.33 -0.33 0.00 0.00 177.00 175.38 1lth n VAL 261 N 7.09 0.00 -4.66 3.83 0.24 -1.21 -1.90 118.33 121.71 1lth n VAL 261 Ca 0.18 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.15 1lth n VAL 261 Cb 0.51 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.74 1lth n VAL 261 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1lth s SER 262 N -0.89 3.93 0.28 -1.34 1.04 0.14 -2.73 113.70 114.13 1lth s SER 262 Ca 0.00 -0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.02 1lth s SER 262 Cb 0.00 -1.61 -0.01 0.00 0.10 0.00 0.00 66.02 64.50 1lth s SER 262 CO 0.00 0.13 0.36 -0.94 0.98 0.00 0.00 173.24 173.78 1lth s SER 263 N 0.54 0.54 -0.72 7.02 1.04 -1.11 0.17 113.70 121.19 1lth s SER 263 Ca -0.09 -1.35 -0.27 0.00 0.48 0.00 0.00 55.95 54.73 1lth s SER 263 Cb -0.16 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.54 1lth s SER 263 CO 0.04 -1.11 1.39 -0.32 0.98 0.00 0.00 173.24 174.22 1lth s MET 264 N -3.64 3.08 0.34 4.02 -2.45 -1.26 -1.77 119.30 117.63 1lth s MET 264 Ca 0.32 -0.09 -0.29 0.00 -1.25 0.00 0.00 55.69 54.38 1lth s MET 264 Cb 0.02 -4.23 -0.11 0.00 1.25 0.00 0.00 34.83 31.75 1lth s MET 264 CO 0.16 -2.27 1.52 -0.51 1.05 0.00 0.00 175.02 174.97 1lth s LEU 265 N 6.38 4.33 -0.43 4.11 1.43 -0.03 -4.90 118.68 129.58 1lth s LEU 265 Ca 0.41 3.00 0.03 0.00 -1.03 0.00 0.00 54.13 56.54 1lth s LEU 265 Cb -0.09 -3.66 0.12 0.00 0.03 0.00 0.00 46.19 42.60 1lth s LEU 265 CO 0.16 -0.88 0.19 -1.59 0.23 0.00 0.00 176.35 174.46 1lth s LYS 266 N -1.50 1.48 -0.72 1.70 -2.85 -1.26 -2.39 119.74 114.19 1lth s LYS 266 Ca 0.56 -2.06 -0.01 0.00 -1.00 0.00 0.00 55.97 53.47 1lth s LYS 266 Cb -0.47 -2.81 -0.01 0.00 -2.06 0.00 0.00 37.83 32.49 1lth s LYS 266 CO 0.57 -1.07 0.61 -0.25 0.10 0.00 0.00 175.35 175.31 1lth n ASP 267 N 3.73 -2.69 -4.51 0.03 8.00 -1.25 -4.98 116.55 114.88 1lth n ASP 267 Ca 0.05 -0.40 -0.42 0.00 0.71 0.00 0.00 54.79 54.73 1lth n ASP 267 Cb 0.36 -3.38 -0.03 0.00 -0.02 0.00 0.00 41.12 38.05 1lth n ASP 267 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1lth s PHE 268 N -3.23 2.61 -1.56 1.24 5.36 -1.19 -4.20 117.98 117.02 1lth s PHE 268 Ca 0.07 -0.64 -0.09 0.00 -0.96 0.00 0.00 56.93 55.31 1lth s PHE 268 Cb -0.01 -4.48 0.07 0.00 -0.34 0.00 0.00 43.02 38.26 1lth s PHE 268 CO 0.45 -1.81 0.56 0.72 -1.46 0.00 0.00 175.22 173.69 1lth n HIS 269 N 8.24 -1.67 0.00 10.12 8.25 -1.26 -0.45 115.22 138.46 1lth n HIS 269 Ca 0.12 0.76 0.00 0.00 -0.26 0.00 0.00 57.72 58.34 1lth n HIS 269 Cb 0.48 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 28.28 1lth n HIS 269 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lth n GLY 270 N -1.76 3.05 3.56 -1.41 0.00 -1.26 -4.93 105.19 102.44 1lth n GLY 270 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 1lth n GLY 270 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lth s ILE 271 N -1.28 3.28 -0.04 -0.61 1.01 0.41 -4.73 121.20 119.23 1lth s ILE 271 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 60.65 60.45 1lth s ILE 271 Cb 0.00 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 1lth s ILE 271 CO 0.00 -0.58 -0.24 -0.55 0.00 0.00 0.00 174.94 173.57 1lth s SER 272 N 8.92 2.92 -0.87 3.58 0.15 -1.26 -3.19 113.70 123.95 1lth s SER 272 Ca 0.78 -0.47 -0.04 0.00 0.70 0.00 0.00 55.95 56.92 1lth s SER 272 Cb -0.08 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 1lth s SER 272 CO 0.04 0.27 0.53 0.47 1.20 0.00 0.00 173.24 175.75 1lth n ASP 273 N 2.74 -4.45 -4.35 5.45 9.92 -1.01 -4.98 116.55 119.88 1lth n ASP 273 Ca -0.17 -0.24 -0.24 0.00 -0.53 0.00 0.00 54.79 53.61 1lth n ASP 273 Cb 0.52 -3.18 -0.12 0.00 -0.64 0.00 0.00 41.12 37.70 1lth n ASP 273 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1lth s ILE 274 N -3.05 1.94 -0.42 0.53 1.01 -1.26 -4.99 121.20 114.96 1lth s ILE 274 Ca 0.26 -1.86 -0.08 0.00 0.00 0.00 0.00 60.65 58.98 1lth s ILE 274 Cb -0.12 -1.86 0.09 0.00 0.01 0.00 0.00 42.46 40.58 1lth s ILE 274 CO 0.33 -0.20 0.25 0.00 0.00 0.00 0.00 174.94 175.32 1lth s MET 276 N 1.36 1.42 -0.22 0.00 0.00 -0.73 -4.53 119.30 116.60 1lth s MET 276 Ca 0.04 -1.06 -0.16 0.00 0.00 0.00 0.00 55.69 54.51 1lth s MET 276 Cb -0.23 0.48 -0.04 0.00 0.00 0.00 0.00 34.83 35.04 1lth s MET 276 CO 0.00 -0.59 0.39 -1.12 0.00 0.00 0.00 175.02 173.70 1lth s SER 277 N -2.94 6.38 0.14 1.11 0.01 -1.20 -2.74 113.70 114.46 1lth s SER 277 Ca 0.15 0.44 0.05 0.00 1.31 0.00 0.00 55.95 57.90 1lth s SER 277 Cb -0.00 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 1lth s SER 277 CO 0.02 -0.11 -0.11 0.68 0.41 0.00 0.00 173.24 174.13 1lth s VAL 278 N 1.56 1.19 -0.82 3.43 -7.23 -1.10 -0.03 120.40 117.39 1lth s VAL 278 Ca 0.18 -1.99 -0.22 0.00 -1.81 0.00 0.00 61.98 58.13 1lth s VAL 278 Cb -0.15 -1.77 -0.18 0.00 0.56 0.00 0.00 36.38 34.83 1lth s VAL 278 CO 0.08 -0.69 2.37 -2.65 -0.31 0.00 0.00 175.10 173.90 1lth n PRO 279 N -0.06 0.46 -3.10 4.82 -0.02 -1.26 -3.33 135.00 132.52 1lth n PRO 279 Ca -0.11 -0.56 -0.24 0.00 -2.02 0.00 0.00 63.50 60.56 1lth n PRO 279 Cb 0.60 -3.01 -0.00 0.00 -0.02 0.00 0.00 33.50 31.07 1lth n PRO 279 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1lth s THR 280 N 11.15 4.72 -0.14 3.45 2.01 0.12 -2.59 115.64 134.36 1lth s THR 280 Ca 1.04 -0.33 -0.03 0.00 0.31 0.00 0.00 61.69 62.68 1lth s THR 280 Cb -0.33 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 1lth s THR 280 CO 0.22 -0.55 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.32 1lth s LEU 281 N -4.49 3.15 0.03 4.42 2.96 -0.41 -0.91 118.68 123.43 1lth s LEU 281 Ca 0.44 -0.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.28 1lth s LEU 281 Cb -0.10 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 1lth s LEU 281 CO 0.39 0.19 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.61 1lth s LEU 282 N 0.23 2.15 0.00 -0.68 1.43 -0.11 -1.46 118.68 120.23 1lth s LEU 282 Ca -0.04 -0.53 -0.06 0.00 -1.03 0.00 0.00 54.13 52.47 1lth s LEU 282 Cb -0.14 -1.14 0.03 0.00 0.03 0.00 0.00 46.19 44.96 1lth s LEU 282 CO 0.03 0.22 0.52 -0.46 0.23 0.00 0.00 176.35 176.89 1lth n ASN 283 N 1.93 -1.48 0.22 2.29 0.23 -1.13 -0.40 115.26 116.92 1lth n ASN 283 Ca -0.17 -2.44 0.15 0.00 -0.53 0.00 0.00 54.58 51.59 1lth n ASN 283 Cb 0.52 2.58 0.77 0.00 -2.08 0.00 0.00 39.78 41.58 1lth n ASN 283 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1lth h ARG 284 N 0.00 0.00 -0.76 -3.83 9.65 -1.71 0.25 114.38 117.98 1lth h ARG 284 Ca -0.25 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.51 1lth h ARG 284 Cb 1.00 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.51 1lth h ARG 284 CO 0.32 0.00 0.15 1.04 2.80 0.00 0.00 179.97 184.29 1lth n GLN 285 N -2.53 3.54 0.00 0.20 1.13 -1.26 -4.90 117.38 113.56 1lth n GLN 285 Ca -0.01 -2.50 0.00 0.00 -1.94 0.00 0.00 57.00 52.54 1lth n GLN 285 Cb 0.07 -2.07 0.00 0.00 0.11 0.00 0.00 30.24 28.35 1lth n GLN 285 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1lth n GLY 286 N 0.13 0.37 3.55 1.08 0.00 0.88 -4.52 105.19 106.68 1lth n GLY 286 Ca 0.30 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 1lth n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lth s VAL 287 N 0.00 3.31 0.03 1.61 1.01 -0.90 -2.83 120.40 122.63 1lth s VAL 287 Ca 0.00 0.10 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 1lth s VAL 287 Cb 0.00 -3.80 -0.15 0.00 0.00 0.00 0.00 36.38 32.43 1lth s VAL 287 CO 0.00 -0.77 1.21 -1.13 0.00 0.00 0.00 175.10 174.41 1lth h ASN 288 N 15.09 -0.84 -4.51 3.32 -0.73 -1.54 -3.43 115.58 122.93 1lth h ASN 288 Ca -0.20 0.03 0.09 0.00 1.87 0.00 0.00 56.30 58.09 1lth h ASN 288 Cb 1.15 0.22 -0.18 0.00 0.27 0.00 0.00 38.32 39.78 1lth h ASN 288 CO 1.20 -0.51 0.49 0.20 -0.37 0.00 0.00 177.43 178.45 1lth s ASN 289 N -4.12 -0.38 -0.16 1.15 0.01 -1.23 -5.02 114.94 105.19 1lth s ASN 289 Ca -0.15 0.16 -0.08 0.00 -0.71 0.00 0.00 52.86 52.08 1lth s ASN 289 Cb 0.01 0.37 -0.04 0.00 0.41 0.00 0.00 41.25 42.00 1lth s ASN 289 CO 0.44 -0.54 0.13 -0.89 -1.51 0.00 0.00 177.10 174.73 1lth s THR 290 N -2.43 5.42 -0.11 1.60 2.01 -1.26 -1.29 115.64 119.58 1lth s THR 290 Ca 0.02 0.19 -0.15 0.00 0.31 0.00 0.00 61.69 62.05 1lth s THR 290 Cb -0.01 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.04 1lth s THR 290 CO -0.05 0.53 0.38 -0.63 -0.69 0.00 0.00 174.62 174.16 1lth s ILE 291 N -0.33 5.21 -1.17 1.82 -1.09 -1.07 -4.98 121.20 119.59 1lth s ILE 291 Ca 0.11 0.75 -0.09 0.00 -2.23 0.00 0.00 60.65 59.19 1lth s ILE 291 Cb -0.12 -3.71 0.23 0.00 -1.58 0.00 0.00 42.46 37.29 1lth s ILE 291 CO 0.01 0.41 1.44 0.59 -1.23 0.00 0.00 174.94 176.16 1lth n ASN 292 N 3.18 5.56 -4.64 3.58 4.13 -1.26 -4.54 115.26 121.28 1lth n ASN 292 Ca -0.11 -3.12 -0.45 0.00 1.68 0.00 0.00 54.58 52.58 1lth n ASN 292 Cb 0.52 -1.43 -0.02 0.00 -1.54 0.00 0.00 39.78 37.31 1lth n ASN 292 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 1lth n THR 293 N 3.03 1.24 -1.52 3.41 -1.04 -1.26 -4.83 114.28 113.30 1lth n THR 293 Ca 0.31 -0.31 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 1lth n THR 293 Cb 0.38 -1.28 -0.08 0.00 -1.82 0.00 0.00 70.33 67.53 1lth n THR 293 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1lth n PRO 294 N 1.57 0.68 -4.15 -2.82 -0.02 -1.26 -4.94 135.00 124.06 1lth n PRO 294 Ca 0.11 0.02 -0.35 0.00 -2.02 0.00 0.00 63.50 61.27 1lth n PRO 294 Cb 0.31 -2.68 -0.13 0.00 -0.02 0.00 0.00 33.50 30.97 1lth n PRO 294 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1lth s VAL 295 N 10.72 3.64 0.63 -1.45 1.01 -1.26 -4.56 120.40 129.13 1lth s VAL 295 Ca 1.13 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 62.53 1lth s VAL 295 Cb -0.61 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 1lth s VAL 295 CO 0.36 0.45 1.11 -0.44 0.00 0.00 0.00 175.10 176.58 1lth s SER 296 N 1.00 5.28 0.54 3.32 0.01 -1.26 -4.69 113.70 117.89 1lth s SER 296 Ca 0.01 2.02 0.40 0.00 1.31 0.00 0.00 55.95 59.69 1lth s SER 296 Cb -0.15 -2.56 1.60 0.00 0.21 0.00 0.00 66.02 65.13 1lth s SER 296 CO 0.01 -1.52 1.73 0.44 0.41 0.00 0.00 173.24 174.31 1lth h ASP 297 N 0.29 0.02 0.32 2.44 3.32 -1.99 0.98 116.42 121.79 1lth h ASP 297 Ca -0.47 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 1lth h ASP 297 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1lth h ASP 297 CO 0.55 -0.00 -0.15 0.50 -1.72 0.00 0.00 179.24 178.41 1lth h LYS 298 N 0.01 -0.41 -0.63 3.56 3.64 -1.99 -2.53 116.57 118.22 1lth h LYS 298 Ca 0.69 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 60.21 1lth h LYS 298 Cb 2.72 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 34.59 1lth h LYS 298 CO -0.03 -0.27 0.43 0.93 -2.27 0.00 0.00 179.45 178.24 1lth h GLU 299 N -0.57 0.35 -0.01 1.90 5.08 -1.25 0.62 114.58 120.70 1lth h GLU 299 Ca -0.04 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 1lth h GLU 299 Cb 0.32 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1lth h GLU 299 CO 0.07 0.23 -0.55 1.25 -1.00 0.00 0.00 179.01 179.01 1lth h LEU 300 N 0.36 0.03 0.97 1.33 5.85 -1.12 0.68 115.31 123.42 1lth h LEU 300 Ca 0.30 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.95 1lth h LEU 300 Cb 0.68 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.71 1lth h LEU 300 CO -0.08 0.57 -0.47 0.00 -0.34 0.00 0.00 178.44 178.13 1lth h ALA 301 N 1.43 -1.31 -0.95 1.25 0.00 0.64 0.49 119.26 120.81 1lth h ALA 301 Ca -0.00 -0.29 0.15 0.00 0.00 0.00 0.00 54.91 54.77 1lth h ALA 301 Cb 0.98 0.51 -0.08 0.00 0.00 0.00 0.00 17.79 19.19 1lth h ALA 301 CO 0.07 -1.22 0.60 0.00 0.00 0.00 0.00 179.25 178.70 1lth h ALA 302 N -1.30 1.73 0.00 0.00 0.00 -0.94 0.36 119.26 119.11 1lth h ALA 302 Ca -0.13 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1lth h ALA 302 Cb 1.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1lth h ALA 302 CO 0.22 0.00 -0.01 1.25 0.00 0.00 0.00 179.25 180.71 1lth h LEU 303 N 0.78 0.00 0.02 0.00 5.85 0.60 -2.64 115.31 119.93 1lth h LEU 303 Ca 0.49 -0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.95 1lth h LEU 303 Cb 0.70 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 1lth h LEU 303 CO -0.25 0.00 -1.34 0.50 -0.34 0.00 0.00 178.44 177.01 1lth h LYS 304 N 0.00 0.04 -0.97 1.25 3.64 0.12 -3.09 116.57 117.56 1lth h LYS 304 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1lth h LYS 304 Cb 0.82 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 1lth h LYS 304 CO 0.00 0.84 0.61 0.00 -2.27 0.00 0.00 179.45 178.63 1lth h ARG 305 N 0.01 1.30 -0.38 1.90 3.08 -0.97 0.25 114.38 119.56 1lth h ARG 305 Ca -0.15 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.73 1lth h ARG 305 Cb 1.90 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 31.65 1lth h ARG 305 CO 0.12 0.88 -0.07 0.66 -1.07 0.00 0.00 179.97 180.49 1lth h SER 306 N 1.32 0.72 -0.03 7.04 4.64 -1.61 -2.30 113.55 123.34 1lth h SER 306 Ca 0.35 -0.35 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1lth h SER 306 Cb -0.10 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.78 1lth h SER 306 CO -0.07 0.91 -0.02 0.00 -0.87 0.00 0.00 176.83 176.77 1lth h ALA 307 N 0.84 1.77 0.51 5.18 0.00 -1.31 -2.32 119.26 123.93 1lth h ALA 307 Ca 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1lth h ALA 307 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1lth h ALA 307 CO 0.03 0.18 -0.25 0.93 0.00 0.00 0.00 179.25 180.15 1lth h GLU 308 N 0.15 -0.66 -0.89 0.00 5.08 -0.04 -3.21 114.58 115.02 1lth h GLU 308 Ca 0.04 0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.51 1lth h GLU 308 Cb 0.15 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 1lth h GLU 308 CO 0.00 -0.43 0.55 1.15 -1.00 0.00 0.00 179.01 179.29 1lth h THR 309 N -0.71 1.04 0.47 1.13 2.02 -0.91 -1.89 112.91 114.06 1lth h THR 309 Ca -0.07 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 1lth h THR 309 Cb 0.54 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1lth h THR 309 CO 0.12 0.18 -0.27 -0.07 0.37 0.00 0.00 175.52 175.85 1lth h LEU 310 N 1.00 -0.66 -1.25 2.58 3.38 -1.46 0.56 115.31 119.47 1lth h LEU 310 Ca 0.39 0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.64 1lth h LEU 310 Cb 0.18 0.18 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 1lth h LEU 310 CO -0.18 -0.42 0.64 0.11 0.09 0.00 0.00 178.44 178.68 1lth h LYS 311 N -0.68 0.46 0.19 1.13 1.57 -1.55 0.31 116.57 118.01 1lth h LYS 311 Ca -0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1lth h LYS 311 Cb 0.54 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1lth h LYS 311 CO 0.08 0.30 -0.15 1.49 -0.57 0.00 0.00 179.45 180.61 1lth h GLU 312 N 0.47 -0.31 -0.94 3.15 4.81 -0.85 0.24 114.58 121.16 1lth h GLU 312 Ca 0.60 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.85 1lth h GLU 312 Cb 1.38 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 1lth h GLU 312 CO -0.35 -0.21 0.57 1.15 -0.73 0.00 0.00 179.01 179.44 1lth h THR 313 N -0.33 1.26 0.00 0.32 2.02 -0.46 -2.45 112.91 113.28 1lth h THR 313 Ca -0.03 -0.55 -0.06 0.00 0.77 0.00 0.00 66.41 66.54 1lth h THR 313 Cb 0.27 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 1lth h THR 313 CO 0.01 0.27 -0.29 0.00 0.37 0.00 0.00 175.52 175.88 1lth h ALA 314 N 1.33 1.35 -0.19 6.16 0.00 -0.31 -2.56 119.26 125.03 1lth h ALA 314 Ca 0.34 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.77 1lth h ALA 314 Cb -0.06 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1lth h ALA 314 CO -0.06 0.36 -0.72 0.00 0.00 0.00 0.00 179.25 178.83 1lth h ALA 315 N 1.71 0.35 0.00 0.00 0.00 -0.04 -2.14 119.26 119.13 1lth h ALA 315 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1lth h ALA 315 Cb 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1lth h ALA 315 CO 0.04 0.68 0.00 1.04 0.00 0.00 0.00 179.25 181.01 1lth n GLN 316 N -3.96 0.02 0.00 0.00 6.02 -0.97 -0.79 117.38 117.71 1lth n GLN 316 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 1lth n GLN 316 Cb 0.72 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.98 1lth n GLN 316 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1lth n PHE 317 N -0.48 0.00 -2.20 1.08 3.72 -1.15 -5.03 117.46 113.40 1lth n PHE 317 Ca 0.00 -0.04 -0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1lth n PHE 317 Cb 0.00 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1lth n PHE 317 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lth n GLY 318 N -0.04 0.60 0.00 1.37 0.00 0.03 -5.12 105.19 102.03 1lth n GLY 318 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1lth n GLY 318 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01