#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p45 n GLY 3 N 0.00 0.58 0.16 3.38 0.00 -1.26 -4.82 105.19 103.24 1p45 n GLY 3 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1p45 n GLY 3 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1p45 n LEU 4 N -0.42 0.01 -2.08 0.99 7.94 -1.21 0.58 117.00 122.80 1p45 n LEU 4 Ca 0.00 0.26 -0.21 0.00 -1.11 0.00 0.00 56.01 54.94 1p45 n LEU 4 Cb 0.24 -0.13 0.15 0.00 0.53 0.00 0.00 43.42 44.21 1p45 n LEU 4 CO 0.00 -0.26 1.20 0.18 -1.11 0.00 0.00 177.39 177.40 1p45 n LEU 5 N -2.56 6.31 -4.68 -1.96 4.32 -1.11 -4.70 117.00 112.62 1p45 n LEU 5 Ca 0.11 -3.36 -0.43 0.00 -0.02 0.00 0.00 56.01 52.30 1p45 n LEU 5 Cb 0.47 -0.80 -0.03 0.00 -1.62 0.00 0.00 43.42 41.44 1p45 n LEU 5 CO 0.10 0.99 1.51 -0.67 -1.22 0.00 0.00 177.39 178.10 1p45 n ASP 6 N -0.93 3.96 0.00 -1.43 -0.08 2.36 -2.73 116.55 117.71 1p45 n ASP 6 Ca 0.52 0.96 0.00 0.00 -1.51 0.00 0.00 54.79 54.76 1p45 n ASP 6 Cb 1.50 -1.51 0.00 0.00 2.34 0.00 0.00 41.12 43.45 1p45 n ASP 6 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1p45 n GLY 7 N 4.33 2.57 3.36 0.27 0.00 -0.97 -4.96 105.19 109.78 1p45 n GLY 7 Ca 0.19 -0.01 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 1p45 n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p45 n LYS 8 N 0.00 0.00 -3.82 1.61 4.76 -1.10 -4.70 118.16 114.90 1p45 n LYS 8 Ca 0.00 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 1p45 n LYS 8 Cb 0.00 -0.99 -0.14 0.00 -1.84 0.00 0.00 35.03 32.06 1p45 n LYS 8 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1p45 s ARG 9 N -0.99 1.31 -0.08 1.97 3.52 -1.26 -1.08 118.95 122.34 1p45 s ARG 9 Ca 0.63 -1.87 0.05 0.00 -0.13 0.00 0.00 55.73 54.41 1p45 s ARG 9 Cb -0.89 -2.59 -0.00 0.00 -1.56 0.00 0.00 34.95 29.90 1p45 s ARG 9 CO 0.56 -1.07 -0.24 0.42 -0.81 0.00 0.00 175.30 174.16 1p45 s ILE 10 N 0.64 2.03 0.11 4.11 1.01 -0.71 -1.87 121.20 126.52 1p45 s ILE 10 Ca 0.14 -1.03 -0.19 0.00 0.00 0.00 0.00 60.65 59.58 1p45 s ILE 10 Cb -0.22 -1.74 -0.07 0.00 0.01 0.00 0.00 42.46 40.44 1p45 s ILE 10 CO -0.07 0.56 0.61 -0.22 0.00 0.00 0.00 174.94 175.81 1p45 s LEU 11 N 0.12 4.48 -0.20 2.97 1.98 -0.87 -2.43 118.68 124.72 1p45 s LEU 11 Ca -0.12 1.29 -0.02 0.00 -2.89 0.00 0.00 54.13 52.39 1p45 s LEU 11 Cb -0.16 -3.09 0.06 0.00 0.66 0.00 0.00 46.19 43.66 1p45 s LEU 11 CO 0.06 0.21 0.02 -0.69 -1.89 0.00 0.00 176.35 174.06 1p45 s VAL 12 N -1.23 0.75 0.65 1.68 1.01 0.16 -1.32 120.40 122.11 1p45 s VAL 12 Ca 0.33 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 1p45 s VAL 12 Cb -0.19 -1.20 0.07 0.00 0.00 0.00 0.00 36.38 35.06 1p45 s VAL 12 CO 0.20 -0.18 0.92 -0.55 0.00 0.00 0.00 175.10 175.48 1p45 s SER 13 N 1.75 4.80 0.00 3.32 0.15 -0.70 -2.54 113.70 120.49 1p45 s SER 13 Ca -0.02 0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1p45 s SER 13 Cb -0.17 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.49 1p45 s SER 13 CO -0.08 -1.53 0.00 0.61 1.20 0.00 0.00 173.24 173.45 1p45 n GLY 14 N -2.68 3.18 3.51 9.45 0.00 -1.09 -4.30 105.19 113.26 1p45 n GLY 14 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 1p45 n GLY 14 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1p45 n ILE 15 N -1.21 1.96 -0.27 -0.61 2.08 -1.26 -4.84 119.36 115.21 1p45 n ILE 15 Ca 0.00 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.81 1p45 n ILE 15 Cb 0.00 -0.62 0.00 0.00 -0.75 0.00 0.00 39.64 38.27 1p45 n ILE 15 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1p45 n ILE 16 N -0.05 0.00 -4.14 1.39 3.06 -1.26 -4.60 119.36 113.76 1p45 n ILE 16 Ca 0.12 0.00 -0.16 0.00 -2.50 0.00 0.00 62.75 60.22 1p45 n ILE 16 Cb 0.31 0.09 -0.05 0.00 0.54 0.00 0.00 39.64 40.54 1p45 n ILE 16 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1p45 n THR 17 N 0.00 0.00 0.17 9.51 -2.24 -1.26 -4.95 114.28 115.51 1p45 n THR 17 Ca 0.00 -1.95 0.08 0.00 -2.27 0.00 0.00 64.05 59.90 1p45 n THR 17 Cb 0.00 1.07 0.25 0.00 -2.10 0.00 0.00 70.33 69.55 1p45 n THR 17 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1p45 n ASP 18 N -1.72 3.18 -0.03 3.42 5.75 -1.26 -3.11 116.55 122.78 1p45 n ASP 18 Ca 0.04 -2.16 0.02 0.00 -0.01 0.00 0.00 54.79 52.67 1p45 n ASP 18 Cb 0.55 -0.42 -0.12 0.00 -1.03 0.00 0.00 41.12 40.10 1p45 n ASP 18 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1p45 n SER 19 N 0.89 1.42 -4.44 -1.12 3.41 -1.26 -4.85 113.62 107.67 1p45 n SER 19 Ca 0.18 0.00 -0.53 0.00 -0.26 0.00 0.00 58.87 58.26 1p45 n SER 19 Cb 0.56 1.35 -0.05 0.00 -0.26 0.00 0.00 64.21 65.81 1p45 n SER 19 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1p45 n SER 20 N -2.25 -0.69 -0.19 4.04 7.64 -1.18 -4.68 113.62 116.30 1p45 n SER 20 Ca -0.12 1.14 -0.10 0.00 1.01 0.00 0.00 58.87 60.80 1p45 n SER 20 Cb 0.65 -0.93 0.02 0.00 -1.01 0.00 0.00 64.21 62.93 1p45 n SER 20 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1p45 h ILE 21 N 1.89 1.27 -0.47 0.44 2.04 -1.94 -1.81 117.51 118.93 1p45 h ILE 21 Ca -0.38 -1.25 0.04 0.00 1.00 0.00 0.00 64.86 64.26 1p45 h ILE 21 Cb 1.43 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 1p45 h ILE 21 CO 0.60 0.45 0.32 0.00 0.00 0.00 0.00 178.15 179.52 1p45 h ALA 22 N 0.95 1.82 -0.03 1.87 0.00 -1.86 0.45 119.26 122.46 1p45 h ALA 22 Ca 0.15 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1p45 h ALA 22 Cb 0.66 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1p45 h ALA 22 CO 0.05 0.12 -0.07 0.35 0.00 0.00 0.00 179.25 179.70 1p45 h PHE 23 N 0.50 -0.17 -0.54 0.00 3.04 -1.61 0.17 116.94 118.33 1p45 h PHE 23 Ca 0.19 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.12 1p45 h PHE 23 Cb 0.15 0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.72 1p45 h PHE 23 CO -0.00 -0.11 0.21 0.45 -2.02 0.00 0.00 178.31 176.84 1p45 h HIS 24 N -0.11 0.82 -0.39 0.41 3.86 -1.07 0.30 115.15 118.98 1p45 h HIS 24 Ca 0.04 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1p45 h HIS 24 Cb 0.16 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 1p45 h HIS 24 CO -0.15 0.68 0.19 0.82 0.86 0.00 0.00 177.93 180.33 1p45 h ILE 25 N 0.73 1.16 -0.36 2.45 2.04 -0.01 -2.11 117.51 121.41 1p45 h ILE 25 Ca 0.18 -0.45 0.08 0.00 1.00 0.00 0.00 64.86 65.66 1p45 h ILE 25 Cb 0.21 0.76 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 1p45 h ILE 25 CO -0.01 0.17 -0.12 0.00 0.00 0.00 0.00 178.15 178.19 1p45 h ALA 26 N 1.05 0.19 -0.03 1.87 0.00 -0.54 -0.36 119.26 121.44 1p45 h ALA 26 Ca 0.13 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.22 1p45 h ALA 26 Cb 0.10 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1p45 h ALA 26 CO -0.02 -0.49 -0.41 -0.09 0.00 0.00 0.00 179.25 178.24 1p45 h ARG 27 N -0.04 -0.53 -0.29 0.00 2.43 -0.21 -1.81 114.38 113.93 1p45 h ARG 27 Ca 0.18 0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1p45 h ARG 27 Cb 0.32 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1p45 h ARG 27 CO -0.40 -0.35 -0.24 0.28 -1.51 0.00 0.00 179.97 177.75 1p45 h VAL 28 N -0.55 1.27 -0.90 0.20 2.07 -0.63 -0.43 116.25 117.29 1p45 h VAL 28 Ca 0.06 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1p45 h VAL 28 Cb 0.64 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1p45 h VAL 28 CO -0.33 0.42 0.50 0.00 0.02 0.00 0.00 177.57 178.18 1p45 h ALA 29 N 1.24 1.20 0.47 1.67 0.00 -0.76 -1.25 119.26 121.83 1p45 h ALA 29 Ca 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1p45 h ALA 29 Cb 0.69 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1p45 h ALA 29 CO 0.05 0.66 -0.23 1.96 0.00 0.00 0.00 179.25 181.69 1p45 h GLN 30 N 1.25 -0.61 -1.11 0.00 4.20 -0.28 -2.33 115.11 116.23 1p45 h GLN 30 Ca 0.32 0.04 0.32 0.00 0.06 0.00 0.00 58.65 59.39 1p45 h GLN 30 Cb 0.01 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 1p45 h GLN 30 CO -0.05 -0.31 0.95 0.39 -0.67 0.00 0.00 178.83 179.14 1p45 n GLU 31 N -5.22 0.00 -0.13 1.46 1.02 -0.34 -0.45 120.64 116.99 1p45 n GLU 31 Ca -0.10 0.75 0.04 0.00 -0.02 0.00 0.00 57.16 57.83 1p45 n GLU 31 Cb 0.30 -1.79 0.10 0.00 -0.02 0.00 0.00 31.44 30.03 1p45 n GLU 31 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1p45 n GLN 32 N -3.05 2.87 0.00 3.49 -0.06 -0.48 -4.90 117.38 115.24 1p45 n GLN 32 Ca 0.25 -1.92 0.00 0.00 -2.00 0.00 0.00 57.00 53.33 1p45 n GLN 32 Cb 1.29 -1.21 0.00 0.00 -4.06 0.00 0.00 30.24 26.25 1p45 n GLN 32 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1p45 n GLY 33 N 0.03 0.74 3.37 1.69 0.00 0.40 -2.74 105.19 108.69 1p45 n GLY 33 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1p45 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p45 s ALA 34 N -1.38 2.83 0.04 4.61 0.00 -1.14 -2.29 121.76 124.44 1p45 s ALA 34 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 1p45 s ALA 34 Cb 0.00 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.49 1p45 s ALA 34 CO 0.00 -0.13 1.16 -0.65 0.00 0.00 0.00 175.76 176.14 1p45 s GLN 35 N 0.98 4.45 0.32 0.00 -0.21 -0.24 -4.50 119.66 120.45 1p45 s GLN 35 Ca -0.00 1.71 0.07 0.00 0.02 0.00 0.00 55.36 57.16 1p45 s GLN 35 Cb -0.15 -3.38 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 1p45 s GLN 35 CO 0.00 -0.23 0.31 -0.51 -2.12 0.00 0.00 175.29 172.74 1p45 s LEU 36 N 1.11 3.70 -0.00 2.90 1.43 -1.26 -1.73 118.68 124.82 1p45 s LEU 36 Ca 0.57 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 1p45 s LEU 36 Cb -0.28 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1p45 s LEU 36 CO 0.29 -0.32 0.00 -0.69 0.23 0.00 0.00 176.35 175.86 1p45 s VAL 37 N -2.26 0.03 0.13 -1.59 1.01 -1.02 -4.43 120.40 112.27 1p45 s VAL 37 Ca 0.40 0.02 0.11 0.00 0.00 0.00 0.00 61.98 62.50 1p45 s VAL 37 Cb -0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.22 1p45 s VAL 37 CO 0.27 0.02 -0.26 -0.76 0.00 0.00 0.00 175.10 174.38 1p45 s LEU 38 N 0.16 2.33 0.07 3.92 1.43 -0.60 0.38 118.68 126.38 1p45 s LEU 38 Ca -0.01 -0.75 0.06 0.00 -1.03 0.00 0.00 54.13 52.40 1p45 s LEU 38 Cb -0.02 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 1p45 s LEU 38 CO -0.00 0.15 -0.17 0.42 0.23 0.00 0.00 176.35 176.98 1p45 s THR 39 N -1.15 1.32 0.16 5.49 -4.23 -1.05 -0.54 115.64 115.65 1p45 s THR 39 Ca 0.13 -1.32 -0.02 0.00 -1.18 0.00 0.00 61.69 59.31 1p45 s THR 39 Cb -0.10 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1p45 s THR 39 CO 0.06 -0.11 0.10 -0.83 -0.54 0.00 0.00 174.62 173.30 1p45 s GLY 40 N -1.66 1.15 -0.06 3.99 0.00 -1.08 -2.67 107.32 107.00 1p45 s GLY 40 Ca 0.02 -1.54 -0.09 0.00 0.00 0.00 0.00 44.72 43.11 1p45 s GLY 40 CO 0.03 -1.35 -0.18 0.33 0.00 0.00 0.00 173.10 171.93 1p45 n PHE 41 N -0.18 0.00 0.00 1.90 7.35 -1.26 -1.07 117.46 124.20 1p45 n PHE 41 Ca -0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 1p45 n PHE 41 Cb 0.65 -0.31 0.00 0.00 0.35 0.00 0.00 39.48 40.17 1p45 n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1p45 n ASP 42 N -3.90 2.04 -3.82 -2.13 4.64 -1.26 -4.72 116.55 107.40 1p45 n ASP 42 Ca -0.12 -0.03 -0.19 0.00 -1.38 0.00 0.00 54.79 53.07 1p45 n ASP 42 Cb 0.36 0.46 -0.17 0.00 -1.04 0.00 0.00 41.12 40.74 1p45 n ASP 42 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1p45 s ARG 43 N -0.87 0.45 -0.20 -0.67 3.00 -1.26 -5.08 118.95 114.33 1p45 s ARG 43 Ca 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 55.73 55.74 1p45 s ARG 43 Cb 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 34.95 34.19 1p45 s ARG 43 CO 0.00 -0.16 -0.22 1.28 0.00 0.00 0.00 175.30 176.20 1p45 n LEU 44 N 4.37 2.09 0.00 2.53 7.99 -1.26 -2.02 117.00 130.70 1p45 n LEU 44 Ca -0.21 0.10 0.00 0.00 -0.01 0.00 0.00 56.01 55.89 1p45 n LEU 44 Cb 0.50 -0.62 0.00 0.00 -0.11 0.00 0.00 43.42 43.19 1p45 n LEU 44 CO 0.19 0.59 0.00 0.54 -1.51 0.00 0.00 177.39 177.20 1p45 n ARG 45 N -3.54 0.00 0.13 3.23 5.12 -1.26 0.89 116.66 121.23 1p45 n ARG 45 Ca -0.37 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.53 1p45 n ARG 45 Cb 0.81 0.00 0.15 0.00 -1.16 0.00 0.00 32.46 32.27 1p45 n ARG 45 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1p45 h LEU 46 N 0.00 0.04 0.03 0.55 6.46 -1.99 -2.72 115.31 117.68 1p45 h LEU 46 Ca 0.00 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1p45 h LEU 46 Cb 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 39.92 1p45 h LEU 46 CO 0.00 0.66 -0.01 0.40 -0.62 0.00 0.00 178.44 178.86 1p45 h ILE 47 N 0.02 1.30 -1.02 4.05 2.04 -1.10 -3.30 117.51 119.50 1p45 h ILE 47 Ca -0.01 -1.06 0.36 0.00 1.00 0.00 0.00 64.86 65.15 1p45 h ILE 47 Cb 1.12 2.00 -0.16 0.00 -0.74 0.00 0.00 36.82 39.05 1p45 h ILE 47 CO 0.08 0.27 0.58 1.56 0.00 0.00 0.00 178.15 180.64 1p45 h GLN 48 N -0.51 0.21 0.01 2.37 1.08 0.84 1.20 115.11 120.31 1p45 h GLN 48 Ca -0.00 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.21 1p45 h GLN 48 Cb 0.47 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.81 1p45 h GLN 48 CO 0.01 0.14 -0.23 0.00 -0.95 0.00 0.00 178.83 177.80 1p45 h ARG 49 N 0.22 -0.35 -0.50 1.46 2.47 -1.62 -2.57 114.38 113.49 1p45 h ARG 49 Ca 0.77 0.02 0.02 0.00 -1.26 0.00 0.00 59.98 59.54 1p45 h ARG 49 Cb 1.88 0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 30.26 1p45 h ARG 49 CO -0.64 -0.23 0.33 0.82 0.56 0.00 0.00 179.97 180.81 1p45 h ILE 50 N -0.36 1.08 -0.01 2.04 2.04 0.13 -2.76 117.51 119.68 1p45 h ILE 50 Ca 0.06 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1p45 h ILE 50 Cb 0.44 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1p45 h ILE 50 CO -0.20 0.11 0.00 0.35 0.00 0.00 0.00 178.15 178.41 1p45 n THR 51 N -4.47 0.01 -0.05 -0.27 -2.24 -0.77 -2.61 114.28 103.88 1p45 n THR 51 Ca 0.05 -0.03 -0.18 0.00 -2.27 0.00 0.00 64.05 61.62 1p45 n THR 51 Cb 0.11 -0.31 -0.13 0.00 -2.10 0.00 0.00 70.33 67.90 1p45 n THR 51 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1p45 n ASP 52 N -0.77 1.85 0.11 3.42 10.43 -1.02 -3.90 116.55 126.67 1p45 n ASP 52 Ca 0.19 0.08 0.05 0.00 2.57 0.00 0.00 54.79 57.68 1p45 n ASP 52 Cb 0.11 -0.52 0.26 0.00 1.84 0.00 0.00 41.12 42.81 1p45 n ASP 52 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1p45 n ARG 53 N -3.32 0.07 -3.06 -1.24 1.74 -1.07 -4.67 116.66 105.10 1p45 n ARG 53 Ca -0.36 0.49 -0.27 0.00 -0.77 0.00 0.00 57.85 56.94 1p45 n ARG 53 Cb 1.03 -1.96 -0.02 0.00 -1.02 0.00 0.00 32.46 30.50 1p45 n ARG 53 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1p45 s LEU 54 N -3.67 3.88 0.00 0.55 1.02 -1.25 -5.09 118.68 114.11 1p45 s LEU 54 Ca -0.01 0.75 0.00 0.00 0.02 0.00 0.00 54.13 54.89 1p45 s LEU 54 Cb 0.03 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.61 1p45 s LEU 54 CO 0.09 -0.38 0.00 -2.65 0.02 0.00 0.00 176.35 173.43 1p45 n PRO 55 N -1.68 0.00 -0.80 1.29 -0.02 -1.26 -4.76 135.00 127.77 1p45 n PRO 55 Ca -0.01 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.25 1p45 n PRO 55 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.05 1p45 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p45 n ALA 56 N -3.00 -1.63 -2.50 3.55 0.00 -1.26 -5.04 120.51 110.63 1p45 n ALA 56 Ca 0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 53.44 52.41 1p45 n ALA 56 Cb 0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 19.45 18.91 1p45 n ALA 56 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1p45 s LYS 57 N -1.77 1.75 -0.13 0.00 3.01 -1.26 -4.94 119.74 116.40 1p45 s LYS 57 Ca 0.20 -1.82 -0.10 0.00 -1.01 0.00 0.00 55.97 53.24 1p45 s LYS 57 Cb 0.06 -1.76 0.04 0.00 -1.01 0.00 0.00 37.83 35.16 1p45 s LYS 57 CO 0.37 0.26 0.32 0.00 0.51 0.00 0.00 175.35 176.81 1p45 s ALA 58 N -2.54 -0.79 0.03 5.17 0.00 -1.26 -4.73 121.76 117.64 1p45 s ALA 58 Ca 0.31 1.02 -0.35 0.00 0.00 0.00 0.00 51.96 52.95 1p45 s ALA 58 Cb -0.02 -0.61 -0.14 0.00 0.00 0.00 0.00 23.12 22.35 1p45 s ALA 58 CO 0.16 -0.18 1.67 -2.30 0.00 0.00 0.00 175.76 175.11 1p45 n PRO 59 N 3.39 1.97 -3.92 0.00 -0.02 -1.26 -4.86 135.00 130.29 1p45 n PRO 59 Ca -0.17 0.71 -0.29 0.00 -2.02 0.00 0.00 63.50 61.73 1p45 n PRO 59 Cb 0.56 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.39 1p45 n PRO 59 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1p45 s LEU 60 N 2.15 1.87 0.05 2.45 2.96 -1.26 -1.56 118.68 125.35 1p45 s LEU 60 Ca 0.86 -0.77 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 1p45 s LEU 60 Cb -0.75 -1.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 1p45 s LEU 60 CO 0.46 -0.18 0.01 -0.76 -1.32 0.00 0.00 176.35 174.56 1p45 s LEU 61 N 1.55 3.53 0.26 -0.68 1.43 0.30 -4.95 118.68 120.11 1p45 s LEU 61 Ca -0.00 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.71 1p45 s LEU 61 Cb -0.16 -2.16 -0.09 0.00 0.03 0.00 0.00 46.19 43.80 1p45 s LEU 61 CO -0.08 0.22 1.20 -0.70 0.23 0.00 0.00 176.35 177.22 1p45 s GLU 62 N -2.03 4.50 -0.27 1.70 2.12 -1.26 -2.62 118.70 120.84 1p45 s GLU 62 Ca 0.24 1.96 -0.04 0.00 0.36 0.00 0.00 54.97 57.49 1p45 s GLU 62 Cb -0.12 -3.17 0.15 0.00 0.26 0.00 0.00 34.13 31.25 1p45 s GLU 62 CO 0.16 -0.02 0.52 -1.17 -0.54 0.00 0.00 175.26 174.20 1p45 s LEU 63 N -1.07 -1.02 -0.28 2.70 2.96 -0.23 -4.87 118.68 116.87 1p45 s LEU 63 Ca 0.49 0.82 -0.03 0.00 -0.22 0.00 0.00 54.13 55.18 1p45 s LEU 63 Cb -0.35 1.76 0.02 0.00 0.50 0.00 0.00 46.19 48.13 1p45 s LEU 63 CO 0.43 -0.26 0.00 -0.62 -1.32 0.00 0.00 176.35 174.58 1p45 s ASP 64 N 2.74 4.71 0.00 3.68 -1.08 -1.26 -4.21 116.67 121.24 1p45 s ASP 64 Ca 0.11 -0.89 0.30 0.00 -0.52 0.00 0.00 52.55 51.54 1p45 s ASP 64 Cb -0.14 -1.75 1.56 0.00 -1.46 0.00 0.00 42.92 41.13 1p45 s ASP 64 CO -0.18 -0.18 2.03 0.55 0.52 0.00 0.00 175.17 177.91 1p45 n VAL 65 N 4.73 0.00 1.50 1.11 3.14 -1.26 -1.12 118.33 126.44 1p45 n VAL 65 Ca -0.15 -0.10 0.14 0.00 -2.96 0.00 0.00 64.34 61.27 1p45 n VAL 65 Cb 0.47 -0.12 0.57 0.00 -1.06 0.00 0.00 33.84 33.69 1p45 n VAL 65 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1p45 n GLN 66 N -0.55 1.27 -3.27 1.45 6.02 -1.26 -4.83 117.38 116.20 1p45 n GLN 66 Ca 0.22 -0.63 -0.44 0.00 -0.01 0.00 0.00 57.00 56.14 1p45 n GLN 66 Cb 0.20 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.90 1p45 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1p45 s ASN 67 N -2.17 6.19 0.20 1.08 2.47 -0.27 -4.94 114.94 117.50 1p45 s ASN 67 Ca 0.35 -1.05 -0.11 0.00 0.42 0.00 0.00 52.86 52.48 1p45 s ASN 67 Cb 0.21 -2.24 0.15 0.00 -1.45 0.00 0.00 41.25 37.92 1p45 s ASN 67 CO 0.40 -0.76 1.87 -0.33 -3.72 0.00 0.00 177.10 174.56 1p45 h GLU 68 N 8.87 0.92 -0.34 0.43 4.39 -1.88 -2.23 114.58 124.73 1p45 h GLU 68 Ca -0.28 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.43 1p45 h GLU 68 Cb 1.10 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 29.49 1p45 h GLU 68 CO 0.91 0.61 0.01 1.49 -1.16 0.00 0.00 179.01 180.87 1p45 h GLU 69 N 0.94 0.11 -0.27 2.33 4.81 -1.95 -1.56 114.58 118.99 1p45 h GLU 69 Ca 0.27 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 1p45 h GLU 69 Cb -0.08 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1p45 h GLU 69 CO -0.07 0.07 0.08 0.45 -0.73 0.00 0.00 179.01 178.81 1p45 h HIS 70 N 0.11 0.43 -0.17 0.92 3.86 -1.72 -3.11 115.15 115.46 1p45 h HIS 70 Ca 0.16 -0.04 0.05 0.00 -1.16 0.00 0.00 60.37 59.37 1p45 h HIS 70 Cb 0.21 -0.12 -0.05 0.00 1.06 0.00 0.00 27.41 28.51 1p45 h HIS 70 CO -0.23 0.47 -0.13 -0.07 0.86 0.00 0.00 177.93 178.84 1p45 h LEU 71 N 0.27 -0.41 -0.94 2.43 3.38 -1.33 0.72 115.31 119.43 1p45 h LEU 71 Ca 0.09 0.09 0.28 0.00 0.09 0.00 0.00 57.88 58.42 1p45 h LEU 71 Cb 0.25 0.21 -0.16 0.00 0.09 0.00 0.00 40.66 41.04 1p45 h LEU 71 CO -0.00 -0.16 0.22 0.00 0.09 0.00 0.00 178.44 178.58 1p45 h ALA 72 N 0.99 1.39 0.00 1.53 0.00 -1.35 -1.90 119.26 119.92 1p45 h ALA 72 Ca 0.11 0.27 -0.20 0.00 0.00 0.00 0.00 54.91 55.09 1p45 h ALA 72 Cb 0.29 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1p45 h ALA 72 CO -0.25 -0.58 -1.07 0.66 0.00 0.00 0.00 179.25 178.01 1p45 h SER 73 N 0.11 0.00 -0.41 0.00 4.64 -1.37 -3.40 113.55 113.13 1p45 h SER 73 Ca 0.62 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.97 1p45 h SER 73 Cb 1.34 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.38 1p45 h SER 73 CO -0.76 0.85 -0.24 0.18 -0.87 0.00 0.00 176.83 175.99 1p45 n LEU 74 N -3.22 -0.43 -0.27 5.97 4.77 0.20 0.18 117.00 124.19 1p45 n LEU 74 Ca -0.04 0.80 -0.03 0.00 -0.03 0.00 0.00 56.01 56.72 1p45 n LEU 74 Cb 0.91 -0.13 0.08 0.00 -2.33 0.00 0.00 43.42 41.95 1p45 n LEU 74 CO 0.45 -0.63 1.17 0.00 -1.33 0.00 0.00 177.39 177.05 1p45 h ALA 75 N 0.13 0.98 -0.31 -1.18 0.00 -1.78 -1.14 119.26 115.97 1p45 h ALA 75 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1p45 h ALA 75 Cb 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1p45 h ALA 75 CO -0.38 0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.56 1p45 n GLY 76 N -1.30 -2.96 0.38 0.00 0.00 0.13 -2.42 105.19 99.01 1p45 n GLY 76 Ca 0.08 0.41 0.17 0.00 0.00 0.00 0.00 46.02 46.68 1p45 n GLY 76 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1p45 h ARG 77 N 0.00 0.56 -0.50 1.61 3.08 -0.99 -1.91 114.38 116.23 1p45 h ARG 77 Ca 0.00 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 1p45 h ARG 77 Cb 0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1p45 h ARG 77 CO 0.00 0.37 -0.15 0.28 -1.07 0.00 0.00 179.97 179.40 1p45 h VAL 78 N 0.58 1.27 -0.62 2.04 2.07 -1.11 -2.62 116.25 117.85 1p45 h VAL 78 Ca 0.55 -1.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.68 1p45 h VAL 78 Cb 1.11 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1p45 h VAL 78 CO -0.30 0.45 0.03 0.71 0.02 0.00 0.00 177.57 178.49 1p45 h THR 79 N 0.85 1.27 -0.98 2.57 1.35 -1.01 -1.98 112.91 114.97 1p45 h THR 79 Ca 0.12 -1.11 0.32 0.00 -0.55 0.00 0.00 66.41 65.19 1p45 h THR 79 Cb 0.72 0.76 -0.15 0.00 -1.73 0.00 0.00 68.15 67.75 1p45 h THR 79 CO 0.05 0.41 0.48 -0.33 -0.25 0.00 0.00 175.52 175.89 1p45 h GLU 80 N 0.98 0.25 0.00 4.72 4.39 -1.05 -0.40 114.58 123.46 1p45 h GLU 80 Ca 0.18 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1p45 h GLU 80 Cb 0.52 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1p45 h GLU 80 CO 0.03 0.16 -1.45 0.00 -1.16 0.00 0.00 179.01 176.59 1p45 n ALA 81 N -2.40 3.46 0.20 3.43 0.00 -0.98 -3.82 120.51 120.40 1p45 n ALA 81 Ca 0.30 -0.49 0.02 0.00 0.00 0.00 0.00 53.44 53.28 1p45 n ALA 81 Cb 0.96 -0.67 0.01 0.00 0.00 0.00 0.00 19.45 19.74 1p45 n ALA 81 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1p45 n ILE 82 N -1.85 0.00 0.00 0.00 -5.35 -0.78 -4.91 119.36 106.47 1p45 n ILE 82 Ca -0.00 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 1p45 n ILE 82 Cb 0.41 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.38 1p45 n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p45 n GLY 83 N 0.54 0.10 3.71 3.28 0.00 -0.17 -4.83 105.19 107.83 1p45 n GLY 83 Ca 0.02 -1.87 -0.23 0.00 0.00 0.00 0.00 46.02 43.94 1p45 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p45 s ALA 84 N -1.62 3.33 -2.04 4.61 0.00 -1.26 -3.92 121.76 120.86 1p45 s ALA 84 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.45 1p45 s ALA 84 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1p45 s ALA 84 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.47 1p45 n GLY 85 N -0.85 1.32 3.10 0.00 0.00 -1.26 -5.01 105.19 102.50 1p45 n GLY 85 Ca -0.07 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 1p45 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p45 s ASN 86 N -2.61 3.32 0.25 1.61 0.02 -1.25 -5.15 114.94 111.13 1p45 s ASN 86 Ca 0.00 -0.76 0.09 0.00 -1.02 0.00 0.00 52.86 51.16 1p45 s ASN 86 Cb 0.00 -1.47 -0.04 0.00 0.02 0.00 0.00 41.25 39.76 1p45 s ASN 86 CO 0.00 -0.04 0.04 -0.54 0.02 0.00 0.00 177.10 176.58 1p45 s LYS 87 N 1.27 2.45 0.37 -0.60 1.02 -1.26 -4.88 119.74 118.11 1p45 s LYS 87 Ca 0.03 -1.29 -0.25 0.00 0.02 0.00 0.00 55.97 54.48 1p45 s LYS 87 Cb -0.14 -2.28 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 1p45 s LYS 87 CO -0.12 0.39 1.06 -0.51 -0.92 0.00 0.00 175.35 175.25 1p45 s LEU 88 N -3.59 4.22 -0.00 3.17 1.43 -0.99 -4.77 118.68 118.16 1p45 s LEU 88 Ca 0.31 2.09 0.16 0.00 -1.03 0.00 0.00 54.13 55.66 1p45 s LEU 88 Cb -0.07 -4.07 -0.19 0.00 0.03 0.00 0.00 46.19 41.89 1p45 s LEU 88 CO 0.21 -0.43 0.64 0.47 0.23 0.00 0.00 176.35 177.47 1p45 n ASP 89 N 0.19 0.82 -3.46 2.29 8.00 -0.78 -0.02 116.55 123.58 1p45 n ASP 89 Ca 0.04 -0.76 -0.10 0.00 0.71 0.00 0.00 54.79 54.67 1p45 n ASP 89 Cb 0.49 1.10 -0.02 0.00 -0.02 0.00 0.00 41.12 42.66 1p45 n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1p45 s GLY 90 N -2.70 0.71 -0.28 0.44 0.00 -1.24 -1.70 107.32 102.54 1p45 s GLY 90 Ca 0.04 -0.97 -0.19 0.00 0.00 0.00 0.00 44.72 43.61 1p45 s GLY 90 CO 0.66 -0.59 0.74 0.14 0.00 0.00 0.00 173.10 174.06 1p45 s VAL 91 N -3.24 0.00 -0.20 1.40 1.01 -0.69 -2.06 120.40 116.62 1p45 s VAL 91 Ca 0.22 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.21 1p45 s VAL 91 Cb -0.02 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.39 1p45 s VAL 91 CO 0.13 0.00 -0.15 -0.69 0.00 0.00 0.00 175.10 174.39 1p45 s VAL 92 N 1.20 1.95 -0.63 2.92 1.01 -0.43 -1.54 120.40 124.88 1p45 s VAL 92 Ca -0.07 -1.11 -0.21 0.00 0.00 0.00 0.00 61.98 60.59 1p45 s VAL 92 Cb -0.05 -1.90 0.08 0.00 0.00 0.00 0.00 36.38 34.51 1p45 s VAL 92 CO -0.13 0.29 0.87 -2.28 0.00 0.00 0.00 175.10 173.86 1p45 s HIS 93 N 1.28 2.79 -0.40 5.22 2.46 0.64 -1.73 115.29 125.55 1p45 s HIS 93 Ca -0.00 -0.67 0.06 0.00 0.47 0.00 0.00 55.06 54.92 1p45 s HIS 93 Cb -0.16 -4.18 0.43 0.00 -0.13 0.00 0.00 32.58 28.54 1p45 s HIS 93 CO -0.10 -1.52 1.14 0.45 -2.47 0.00 0.00 174.74 172.24 1p45 n SER 94 N 7.24 4.78 -4.30 9.88 2.88 -1.26 -1.97 113.62 130.87 1p45 n SER 94 Ca -0.06 -3.73 -0.31 0.00 -1.33 0.00 0.00 58.87 53.44 1p45 n SER 94 Cb 0.44 -0.43 -0.16 0.00 -0.75 0.00 0.00 64.21 63.31 1p45 n SER 94 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1p45 s ILE 95 N -5.28 2.17 0.26 2.46 1.01 -1.26 -4.38 121.20 116.18 1p45 s ILE 95 Ca 0.49 -1.04 -0.21 0.00 0.00 0.00 0.00 60.65 59.88 1p45 s ILE 95 Cb 0.40 -1.78 0.03 0.00 0.01 0.00 0.00 42.46 41.12 1p45 s ILE 95 CO -0.13 0.57 0.71 -0.83 0.00 0.00 0.00 174.94 175.27 1p45 s GLY 96 N -0.33 -0.16 -0.23 6.18 0.00 -1.26 -4.70 107.32 106.81 1p45 s GLY 96 Ca 0.02 -0.19 -0.28 0.00 0.00 0.00 0.00 44.72 44.26 1p45 s GLY 96 CO 0.02 -0.05 1.15 -0.12 0.00 0.00 0.00 173.10 174.10 1p45 s PHE 97 N -3.87 -0.27 -0.24 1.90 5.36 -1.26 -4.98 117.98 114.61 1p45 s PHE 97 Ca 0.10 0.54 -0.13 0.00 -0.96 0.00 0.00 56.93 56.48 1p45 s PHE 97 Cb -0.05 0.45 0.08 0.00 -0.34 0.00 0.00 43.02 43.15 1p45 s PHE 97 CO 0.04 -0.20 0.59 1.41 -1.46 0.00 0.00 175.22 175.60 1p45 s MET 98 N -0.66 0.58 0.17 10.12 -2.45 -1.26 -4.22 119.30 121.58 1p45 s MET 98 Ca 0.03 1.10 -0.33 0.00 -1.25 0.00 0.00 55.69 55.24 1p45 s MET 98 Cb -0.02 0.14 -0.16 0.00 1.25 0.00 0.00 34.83 36.04 1p45 s MET 98 CO -0.05 -0.16 1.08 -2.30 1.05 0.00 0.00 175.02 174.65 1p45 n PRO 99 N 4.42 0.96 -0.56 4.11 -0.02 -1.26 -4.80 135.00 137.85 1p45 n PRO 99 Ca -0.20 0.34 0.45 0.00 -2.02 0.00 0.00 63.50 62.07 1p45 n PRO 99 Cb 0.57 -1.78 0.73 0.00 -0.02 0.00 0.00 33.50 32.99 1p45 n PRO 99 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1p45 n GLN 100 N 1.58 -0.02 -0.32 -0.52 1.13 -1.26 0.57 117.38 118.54 1p45 n GLN 100 Ca 0.15 1.18 0.09 0.00 -1.94 0.00 0.00 57.00 56.49 1p45 n GLN 100 Cb 0.24 -2.47 0.30 0.00 0.11 0.00 0.00 30.24 28.42 1p45 n GLN 100 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1p45 h THR 101 N 0.00 0.88 -0.05 5.09 2.02 -1.98 -2.70 112.91 116.17 1p45 h THR 101 Ca 0.90 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.78 1p45 h THR 101 Cb 3.17 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1p45 h THR 101 CO -0.30 0.16 0.00 0.61 0.37 0.00 0.00 175.52 176.36 1p45 n GLY 102 N -1.38 -0.10 3.44 2.16 0.00 0.19 -4.27 105.19 105.23 1p45 n GLY 102 Ca 0.18 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 1p45 n GLY 102 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1p45 n MET 103 N 0.02 0.60 0.00 1.61 0.00 -1.02 -0.81 117.12 117.51 1p45 n MET 103 Ca 0.19 -3.53 0.00 0.00 0.00 0.00 0.00 57.70 54.35 1p45 n MET 103 Cb 0.30 1.80 0.00 0.00 0.00 0.00 0.00 33.22 35.33 1p45 n MET 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1p45 n GLY 104 N -0.89 2.51 0.05 -5.12 0.00 -0.92 -3.66 105.19 97.16 1p45 n GLY 104 Ca -0.08 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.91 1p45 n GLY 104 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1p45 n ILE 105 N 0.00 0.28 -1.68 -0.61 -0.00 -1.26 -4.27 119.36 111.82 1p45 n ILE 105 Ca 0.00 -0.30 -0.59 0.00 -0.00 0.00 0.00 62.75 61.86 1p45 n ILE 105 Cb 0.00 0.02 -0.08 0.00 -0.00 0.00 0.00 39.64 39.58 1p45 n ILE 105 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1p45 n ASN 106 N -2.11 1.85 -4.65 4.38 3.02 -1.24 -4.86 115.26 111.64 1p45 n ASN 106 Ca 0.02 1.11 -0.34 0.00 -0.03 0.00 0.00 54.58 55.34 1p45 n ASN 106 Cb 0.46 -1.08 0.11 0.00 -0.61 0.00 0.00 39.78 38.66 1p45 n ASN 106 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1p45 n PRO 107 N 4.31 0.28 -0.05 3.52 -0.04 -1.26 -4.79 135.00 136.96 1p45 n PRO 107 Ca 0.25 0.16 -0.12 0.00 -0.04 0.00 0.00 63.50 63.75 1p45 n PRO 107 Cb 0.10 -2.33 -0.07 0.00 -0.04 0.00 0.00 33.50 31.16 1p45 n PRO 107 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1p45 h PHE 108 N -0.70 0.38 0.00 0.54 3.57 -1.90 -2.72 116.94 116.10 1p45 h PHE 108 Ca -0.47 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 60.94 1p45 h PHE 108 Cb 1.31 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.96 1p45 h PHE 108 CO 0.44 0.65 0.00 1.19 -2.23 0.00 0.00 178.31 178.36 1p45 n PHE 109 N -4.63 0.39 1.12 0.41 3.72 -1.26 -3.24 117.46 113.97 1p45 n PHE 109 Ca -0.06 0.17 0.12 0.00 -0.05 0.00 0.00 57.45 57.63 1p45 n PHE 109 Cb 0.30 -0.77 0.32 0.00 -0.94 0.00 0.00 39.48 38.39 1p45 n PHE 109 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1p45 n ASP 110 N -1.87 2.30 -4.67 4.37 8.00 -1.03 -4.80 116.55 118.86 1p45 n ASP 110 Ca 0.02 -1.77 -0.42 0.00 0.71 0.00 0.00 54.79 53.32 1p45 n ASP 110 Cb 0.16 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.18 1p45 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p45 s ALA 111 N -1.89 3.61 0.42 2.24 0.00 -1.20 -5.02 121.76 119.92 1p45 s ALA 111 Ca 0.34 0.72 -0.16 0.00 0.00 0.00 0.00 51.96 52.86 1p45 s ALA 111 Cb 0.20 -3.63 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 1p45 s ALA 111 CO 0.31 -1.09 0.87 -1.25 0.00 0.00 0.00 175.76 174.61 1p45 s PRO 112 N 3.10 4.02 0.43 0.00 0.04 -1.26 -4.95 135.00 136.37 1p45 s PRO 112 Ca 0.62 0.85 0.15 0.00 0.04 0.00 0.00 61.00 62.65 1p45 s PRO 112 Cb -0.28 -2.27 1.04 0.00 0.04 0.00 0.00 34.50 33.04 1p45 s PRO 112 CO 0.23 -0.05 1.95 -0.92 0.04 0.00 0.00 177.00 178.25 1p45 h TYR 113 N 1.60 0.45 -0.90 0.56 3.20 -1.99 -1.54 116.97 118.35 1p45 h TYR 113 Ca -0.48 0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.50 1p45 h TYR 113 Cb 1.18 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 39.24 1p45 h TYR 113 CO 0.62 0.20 0.58 0.00 -1.64 0.00 0.00 178.16 177.92 1p45 h ALA 114 N 1.67 1.59 -0.35 1.82 0.00 -1.99 0.36 119.26 122.38 1p45 h ALA 114 Ca 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1p45 h ALA 114 Cb 0.68 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1p45 h ALA 114 CO -0.09 0.23 0.19 -0.44 0.00 0.00 0.00 179.25 179.13 1p45 h ASP 115 N 0.93 0.43 -0.03 0.00 3.32 -1.67 -1.63 116.42 117.79 1p45 h ASP 115 Ca 0.41 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.36 1p45 h ASP 115 Cb 0.36 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1p45 h ASP 115 CO -0.18 0.40 -0.04 0.58 -1.72 0.00 0.00 179.24 178.29 1p45 h VAL 116 N 0.43 1.41 -0.85 -1.35 2.07 -0.99 -2.62 116.25 114.35 1p45 h VAL 116 Ca 0.12 -1.27 0.15 0.00 0.82 0.00 0.00 66.70 66.52 1p45 h VAL 116 Cb 0.07 2.21 -0.15 0.00 -1.52 0.00 0.00 31.29 31.90 1p45 h VAL 116 CO -0.02 0.34 -0.29 -0.24 0.02 0.00 0.00 177.57 177.38 1p45 n SER 117 N -4.78 -0.46 -0.33 0.57 2.88 0.11 -0.10 113.62 111.51 1p45 n SER 117 Ca -0.08 1.47 0.03 0.00 -1.33 0.00 0.00 58.87 58.96 1p45 n SER 117 Cb 0.29 -0.38 0.17 0.00 -0.75 0.00 0.00 64.21 63.54 1p45 n SER 117 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1p45 h LYS 118 N 0.00 0.99 -0.22 -1.46 3.64 -0.95 -1.50 116.57 117.06 1p45 h LYS 118 Ca 0.34 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 1p45 h LYS 118 Cb 0.55 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1p45 h LYS 118 CO -0.85 0.65 0.03 0.78 -2.27 0.00 0.00 179.45 177.79 1p45 h GLY 119 N 1.02 0.39 1.03 5.01 0.00 -0.16 -2.42 103.07 107.94 1p45 h GLY 119 Ca 0.41 -0.27 -0.10 0.00 0.00 0.00 0.00 47.33 47.37 1p45 h GLY 119 CO -0.20 0.25 -0.13 -2.22 0.00 0.00 0.00 176.54 174.24 1p45 h ILE 120 N 0.16 1.27 -0.30 2.60 2.04 -0.63 0.25 117.51 122.90 1p45 h ILE 120 Ca 0.07 -1.26 0.05 0.00 1.00 0.00 0.00 64.86 64.72 1p45 h ILE 120 Cb 0.34 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1p45 h ILE 120 CO 0.01 0.43 0.02 -0.74 0.00 0.00 0.00 178.15 177.86 1p45 h HIS 121 N 0.70 0.02 0.10 1.37 2.76 -1.24 0.02 115.15 118.88 1p45 h HIS 121 Ca 0.11 0.02 -0.26 0.00 -2.20 0.00 0.00 60.37 58.03 1p45 h HIS 121 Cb 0.68 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.67 1p45 h HIS 121 CO 0.05 -0.03 -1.24 0.82 -1.30 0.00 0.00 177.93 176.24 1p45 h ILE 122 N 0.12 1.49 -0.46 6.26 2.04 -1.13 -2.41 117.51 123.41 1p45 h ILE 122 Ca 0.14 -3.11 0.00 0.00 1.00 0.00 0.00 64.86 62.90 1p45 h ILE 122 Cb 0.18 2.89 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1p45 h ILE 122 CO -0.22 0.89 0.00 -1.20 0.00 0.00 0.00 178.15 177.62 1p45 n SER 123 N -3.47 3.57 0.00 1.72 7.64 0.85 -4.47 113.62 119.46 1p45 n SER 123 Ca -0.08 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 57.81 1p45 n SER 123 Cb 1.01 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.91 1p45 n SER 123 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p45 n ALA 124 N 1.52 0.00 -0.32 -0.43 0.00 -0.09 -4.72 120.51 116.47 1p45 n ALA 124 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.75 1p45 n ALA 124 Cb 0.61 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.28 1p45 n ALA 124 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1p45 n TYR 125 N -0.40 0.50 0.24 0.00 4.19 -0.66 -1.88 117.16 119.14 1p45 n TYR 125 Ca 0.00 1.11 0.08 0.00 3.31 0.00 0.00 57.90 62.40 1p45 n TYR 125 Cb 0.00 -1.13 0.61 0.00 0.49 0.00 0.00 39.34 39.30 1p45 n TYR 125 CO 0.00 0.00 0.00 0.66 0.91 0.00 0.00 176.86 178.43 1p45 h SER 126 N 0.00 0.00 -0.77 2.98 4.64 -1.65 0.50 113.55 119.25 1p45 h SER 126 Ca 0.52 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.94 1p45 h SER 126 Cb 0.98 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.02 1p45 h SER 126 CO -0.89 0.14 0.51 0.22 -0.87 0.00 0.00 176.83 175.94 1p45 h TYR 127 N 0.00 0.72 0.18 4.77 3.20 -1.69 0.31 116.97 124.46 1p45 h TYR 127 Ca -0.00 0.02 -0.23 0.00 3.14 0.00 0.00 58.73 61.65 1p45 h TYR 127 Cb 0.29 -0.23 0.03 0.00 1.54 0.00 0.00 36.73 38.35 1p45 h TYR 127 CO 0.00 0.33 -1.02 0.00 -1.64 0.00 0.00 178.16 175.83 1p45 h ALA 128 N 1.61 -0.11 0.07 1.82 0.00 -0.15 -1.95 119.26 120.56 1p45 h ALA 128 Ca 0.36 -0.74 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1p45 h ALA 128 Cb 0.51 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1p45 h ALA 128 CO -0.14 0.47 -0.15 0.66 0.00 0.00 0.00 179.25 180.10 1p45 h SER 129 N -0.20 -0.41 -0.86 0.00 4.64 -1.31 0.17 113.55 115.58 1p45 h SER 129 Ca -0.18 0.05 0.21 0.00 -0.47 0.00 0.00 61.79 61.40 1p45 h SER 129 Cb 1.80 0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 64.00 1p45 h SER 129 CO 0.19 -0.21 0.58 -0.03 -0.87 0.00 0.00 176.83 176.49 1p45 h MET 130 N -0.28 0.27 0.20 4.77 -1.53 -0.43 0.19 114.93 118.12 1p45 h MET 130 Ca 0.03 -0.02 -0.28 0.00 -3.44 0.00 0.00 59.70 55.99 1p45 h MET 130 Cb 0.31 -0.06 0.03 0.00 -0.55 0.00 0.00 31.60 31.32 1p45 h MET 130 CO -0.09 0.18 -1.27 0.00 0.14 0.00 0.00 176.91 175.86 1p45 h ALA 131 N 1.61 -0.08 -0.66 0.39 0.00 -0.96 -2.91 119.26 116.65 1p45 h ALA 131 Ca 0.44 -0.85 0.14 0.00 0.00 0.00 0.00 54.91 54.63 1p45 h ALA 131 Cb 1.26 0.21 -0.11 0.00 0.00 0.00 0.00 17.79 19.15 1p45 h ALA 131 CO -0.12 0.63 -0.01 -0.22 0.00 0.00 0.00 179.25 179.53 1p45 h LYS 132 N -0.08 0.10 -0.27 0.00 3.64 0.52 -1.53 116.57 118.94 1p45 h LYS 132 Ca -0.23 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.04 1p45 h LYS 132 Cb 1.94 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.73 1p45 h LYS 132 CO 0.20 0.07 -0.26 0.00 -2.27 0.00 0.00 179.45 177.19 1p45 h ALA 133 N 1.62 1.04 0.00 5.00 0.00 -0.78 -3.39 119.26 122.74 1p45 h ALA 133 Ca 0.35 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1p45 h ALA 133 Cb 0.58 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1p45 h ALA 133 CO -0.58 0.58 -1.31 1.28 0.00 0.00 0.00 179.25 179.21 1p45 n LEU 134 N -4.11 0.29 -0.31 0.00 4.77 -0.92 -4.28 117.00 112.44 1p45 n LEU 134 Ca -0.00 -0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 55.74 1p45 n LEU 134 Cb 0.42 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.62 1p45 n LEU 134 CO 0.43 0.07 1.16 -0.07 -1.33 0.00 0.00 177.39 177.65 1p45 h LEU 135 N 0.00 1.08 -1.56 2.23 3.38 -1.49 -2.64 115.31 116.31 1p45 h LEU 135 Ca 0.00 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1p45 h LEU 135 Cb 0.57 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1p45 h LEU 135 CO 0.00 0.88 0.38 -0.65 0.09 0.00 0.00 178.44 179.13 1p45 h PRO 136 N 1.21 0.53 -1.74 1.13 0.11 -1.80 -1.92 132.00 129.52 1p45 h PRO 136 Ca 0.30 -0.03 -0.70 0.00 0.11 0.00 0.00 66.00 65.68 1p45 h PRO 136 Cb 0.04 -0.12 -0.33 0.00 0.11 0.00 0.00 31.00 30.70 1p45 h PRO 136 CO -0.05 0.35 0.41 0.44 -0.21 0.00 0.00 178.00 178.94 1p45 n ILE 137 N -4.47 3.17 -4.35 4.15 -5.35 -1.02 -4.98 119.36 106.50 1p45 n ILE 137 Ca 0.08 -4.42 -0.19 0.00 -0.27 0.00 0.00 62.75 57.95 1p45 n ILE 137 Cb 0.23 -1.24 -0.14 0.00 -1.74 0.00 0.00 39.64 36.75 1p45 n ILE 137 CO 0.00 0.00 0.00 -0.32 -1.76 0.00 0.00 176.55 174.47 1p45 s MET 138 N -3.87 0.86 0.45 6.28 1.75 -0.72 -2.34 119.30 121.70 1p45 s MET 138 Ca 0.52 -0.64 -0.02 0.00 -1.25 0.00 0.00 55.69 54.29 1p45 s MET 138 Cb 0.43 -0.84 -0.02 0.00 2.84 0.00 0.00 34.83 37.24 1p45 s MET 138 CO -0.30 0.21 0.70 -0.80 -0.65 0.00 0.00 175.02 174.18 1p45 s ASN 139 N -0.91 6.11 0.76 1.11 0.01 0.97 -4.88 114.94 118.10 1p45 s ASN 139 Ca 0.01 0.62 -0.16 0.00 -0.71 0.00 0.00 52.86 52.63 1p45 s ASN 139 Cb -0.07 -1.97 -0.04 0.00 0.41 0.00 0.00 41.25 39.58 1p45 s ASN 139 CO 0.01 -0.57 0.41 -2.65 -1.51 0.00 0.00 177.10 172.79 1p45 n PRO 140 N -2.11 0.19 -1.67 -0.60 -0.02 -1.24 -3.24 135.00 126.30 1p45 n PRO 140 Ca -0.00 0.10 -0.16 0.00 -2.02 0.00 0.00 63.50 61.42 1p45 n PRO 140 Cb 0.56 -1.75 -0.05 0.00 -0.02 0.00 0.00 33.50 32.24 1p45 n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p45 n GLY 141 N 1.76 1.14 0.40 -1.23 0.00 -0.19 -4.98 105.19 102.08 1p45 n GLY 141 Ca 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 1p45 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p45 n GLY 142 N -1.03 2.27 3.58 -0.02 0.00 -1.17 -4.94 105.19 103.89 1p45 n GLY 142 Ca -0.17 -2.15 -0.16 0.00 0.00 0.00 0.00 46.02 43.55 1p45 n GLY 142 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p45 s SER 143 N -1.36 -0.71 0.04 1.61 0.15 -0.69 -1.52 113.70 111.21 1p45 s SER 143 Ca 0.05 1.16 0.07 0.00 0.70 0.00 0.00 55.95 57.93 1p45 s SER 143 Cb -0.00 1.10 -0.02 0.00 -1.71 0.00 0.00 66.02 65.39 1p45 s SER 143 CO 0.03 -0.39 -0.20 -0.63 1.20 0.00 0.00 173.24 173.25 1p45 s ILE 144 N -0.23 1.61 -0.04 6.45 1.01 -0.65 -1.70 121.20 127.64 1p45 s ILE 144 Ca -0.04 -1.14 -0.02 0.00 0.00 0.00 0.00 60.65 59.45 1p45 s ILE 144 Cb -0.03 -1.39 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1p45 s ILE 144 CO 0.04 0.22 0.08 -0.69 0.00 0.00 0.00 174.94 174.60 1p45 s VAL 145 N -0.76 -0.03 0.26 2.92 1.01 -0.59 -2.15 120.40 121.06 1p45 s VAL 145 Ca 0.07 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.21 1p45 s VAL 145 Cb -0.09 -0.14 -0.06 0.00 0.00 0.00 0.00 36.38 36.10 1p45 s VAL 145 CO 0.01 0.05 -0.00 -0.83 0.00 0.00 0.00 175.10 174.33 1p45 s GLY 146 N 0.69 1.72 -0.27 4.51 0.00 -0.78 -0.26 107.32 112.93 1p45 s GLY 146 Ca -0.05 -1.85 -0.09 0.00 0.00 0.00 0.00 44.72 42.72 1p45 s GLY 146 CO -0.03 -1.73 0.14 1.06 0.00 0.00 0.00 173.10 172.54 1p45 s MET 147 N -3.84 3.83 0.23 2.90 -1.94 -0.83 -1.81 119.30 117.83 1p45 s MET 147 Ca 0.30 -0.38 0.07 0.00 -1.71 0.00 0.00 55.69 53.96 1p45 s MET 147 Cb 0.06 -3.52 -0.04 0.00 2.01 0.00 0.00 34.83 33.34 1p45 s MET 147 CO 0.11 -0.18 0.16 0.34 -0.01 0.00 0.00 175.02 175.44 1p45 s ASP 148 N 1.70 5.45 -0.09 3.03 2.15 0.14 -4.91 116.67 124.13 1p45 s ASP 148 Ca 0.07 -0.24 0.01 0.00 0.43 0.00 0.00 52.55 52.81 1p45 s ASP 148 Cb -0.16 -1.38 0.02 0.00 -0.30 0.00 0.00 42.92 41.11 1p45 s ASP 148 CO 0.08 -0.00 -0.09 0.12 -0.17 0.00 0.00 175.17 175.11 1p45 s PHE 149 N -2.02 1.44 -0.08 -5.34 5.36 -1.26 -1.25 117.98 114.83 1p45 s PHE 149 Ca 0.32 -0.64 -0.33 0.00 -0.96 0.00 0.00 56.93 55.32 1p45 s PHE 149 Cb -0.08 -1.15 -0.10 0.00 -0.34 0.00 0.00 43.02 41.35 1p45 s PHE 149 CO 0.24 -0.41 1.96 -3.47 -1.46 0.00 0.00 175.22 172.07 1p45 n ASP 150 N 4.50 3.59 -1.75 6.13 2.03 -1.26 -4.87 116.55 124.92 1p45 n ASP 150 Ca -0.17 0.86 0.07 0.00 0.52 0.00 0.00 54.79 56.08 1p45 n ASP 150 Cb 0.51 -1.43 0.39 0.00 -0.72 0.00 0.00 41.12 39.87 1p45 n ASP 150 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1p45 n PRO 151 N 7.18 4.58 0.24 -0.67 -0.04 -1.26 -4.68 135.00 140.35 1p45 n PRO 151 Ca 0.23 -3.11 0.08 0.00 -0.04 0.00 0.00 63.50 60.66 1p45 n PRO 151 Cb 0.34 -2.18 0.61 0.00 -0.04 0.00 0.00 33.50 32.23 1p45 n PRO 151 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1p45 h SER 152 N 3.78 0.02 -3.85 3.54 0.02 -1.95 -3.43 113.55 111.69 1p45 h SER 152 Ca 0.00 -0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 1p45 h SER 152 Cb 1.87 -0.01 -0.20 0.00 0.14 0.00 0.00 62.40 64.20 1p45 h SER 152 CO 0.44 0.04 -0.76 -0.13 -1.14 0.00 0.00 176.83 175.27 1p45 s ARG 153 N -5.05 2.29 0.96 3.45 0.52 -1.26 -5.13 118.95 114.73 1p45 s ARG 153 Ca -0.05 -0.86 -0.12 0.00 -0.52 0.00 0.00 55.73 54.18 1p45 s ARG 153 Cb 0.17 -2.32 0.17 0.00 0.52 0.00 0.00 34.95 33.48 1p45 s ARG 153 CO 0.68 0.57 1.09 0.00 0.02 0.00 0.00 175.30 177.65 1p45 s ALA 154 N -0.93 1.10 0.21 2.13 0.00 -1.26 -5.06 121.76 117.95 1p45 s ALA 154 Ca 0.15 -0.08 -0.23 0.00 0.00 0.00 0.00 51.96 51.80 1p45 s ALA 154 Cb -0.11 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 19.85 1p45 s ALA 154 CO 0.06 -2.72 0.86 0.00 0.00 0.00 0.00 175.76 173.95 1p45 s MET 155 N -4.84 1.46 0.47 0.00 0.23 -1.26 -5.14 119.30 110.21 1p45 s MET 155 Ca 0.65 -0.81 -0.01 0.00 -1.03 0.00 0.00 55.69 54.49 1p45 s MET 155 Cb -0.20 0.49 -0.00 0.00 -1.53 0.00 0.00 34.83 33.60 1p45 s MET 155 CO 0.58 -0.67 0.70 -1.25 -2.03 0.00 0.00 175.02 172.35 1p45 s PRO 156 N -3.52 3.07 0.00 3.16 0.04 -1.26 -4.36 135.00 132.14 1p45 s PRO 156 Ca 0.12 -0.41 0.00 0.00 0.04 0.00 0.00 61.00 60.75 1p45 s PRO 156 Cb -0.03 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1p45 s PRO 156 CO 0.04 -0.31 0.00 0.00 0.04 0.00 0.00 177.00 176.77 1p45 n ALA 157 N -2.14 0.00 0.30 8.56 0.00 -1.26 -4.64 120.51 121.33 1p45 n ALA 157 Ca 0.02 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.64 1p45 n ALA 157 Cb 0.58 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.83 1p45 n ALA 157 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1p45 h TYR 158 N 0.00 0.00 0.00 0.00 -0.00 -1.90 -2.45 116.97 112.62 1p45 h TYR 158 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1p45 h TYR 158 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1p45 h TYR 158 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.25 1p45 n ASN 159 N -2.98 0.00 0.21 -2.11 3.02 -1.26 0.15 115.26 112.29 1p45 n ASN 159 Ca -0.00 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.70 1p45 n ASN 159 Cb 0.23 0.00 0.73 0.00 -0.61 0.00 0.00 39.78 40.13 1p45 n ASN 159 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1p45 h TRP 160 N 0.00 0.00 0.00 3.10 4.06 -1.30 -2.08 115.95 119.74 1p45 h TRP 160 Ca 0.00 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.90 1p45 h TRP 160 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1p45 h TRP 160 CO 0.00 0.00 -0.24 1.98 -3.56 0.00 0.00 178.44 176.62 1p45 h MET 161 N 0.00 0.00 -0.51 0.49 4.05 -0.44 -1.18 114.93 117.34 1p45 h MET 161 Ca 0.00 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1p45 h MET 161 Cb 0.17 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.95 1p45 h MET 161 CO 0.00 0.24 0.24 1.15 0.23 0.00 0.00 176.91 178.76 1p45 h THR 162 N 0.00 1.20 -0.60 -0.77 2.02 -1.06 -0.39 112.91 113.31 1p45 h THR 162 Ca -0.00 -0.57 -0.07 0.00 0.77 0.00 0.00 66.41 66.54 1p45 h THR 162 Cb 0.56 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1p45 h THR 162 CO 0.03 0.22 0.10 0.58 0.37 0.00 0.00 175.52 176.83 1p45 h VAL 163 N 0.68 1.25 -0.16 3.16 2.07 -1.43 -1.08 116.25 120.73 1p45 h VAL 163 Ca 0.17 -0.96 -0.08 0.00 0.82 0.00 0.00 66.70 66.65 1p45 h VAL 163 Cb 0.13 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1p45 h VAL 163 CO -0.02 0.36 -0.27 0.00 0.02 0.00 0.00 177.57 177.66 1p45 h ALA 164 N 1.20 1.24 0.00 1.67 0.00 -0.52 -2.36 119.26 120.49 1p45 h ALA 164 Ca 0.19 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1p45 h ALA 164 Cb 0.39 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1p45 h ALA 164 CO 0.01 0.50 -0.42 0.87 0.00 0.00 0.00 179.25 180.21 1p45 h LYS 165 N 0.27 0.00 -0.22 0.00 1.79 -0.24 0.16 116.57 118.32 1p45 h LYS 165 Ca 0.04 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.34 1p45 h LYS 165 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1p45 h LYS 165 CO 0.05 0.42 -0.55 0.77 -1.08 0.00 0.00 179.45 179.06 1p45 h SER 166 N 0.00 0.87 -0.48 0.86 0.02 -0.73 -2.17 113.55 111.92 1p45 h SER 166 Ca -0.00 -0.56 -0.09 0.00 -0.84 0.00 0.00 61.79 60.29 1p45 h SER 166 Cb 1.14 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 1p45 h SER 166 CO 0.05 1.28 -0.03 0.00 -1.14 0.00 0.00 176.83 176.99 1p45 h ALA 167 N 0.61 0.95 -0.60 3.77 0.00 -1.21 -2.73 119.26 120.05 1p45 h ALA 167 Ca -0.00 -0.30 0.11 0.00 0.00 0.00 0.00 54.91 54.71 1p45 h ALA 167 Cb 1.16 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1p45 h ALA 167 CO 0.12 0.63 0.15 1.25 0.00 0.00 0.00 179.25 181.40 1p45 h LEU 168 N 0.84 0.05 -1.06 0.00 6.46 -0.37 0.18 115.31 121.42 1p45 h LEU 168 Ca 0.15 0.10 -0.09 0.00 -0.12 0.00 0.00 57.88 57.92 1p45 h LEU 168 Cb 0.54 0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.59 1p45 h LEU 168 CO 0.03 0.04 -0.36 -0.33 -0.62 0.00 0.00 178.44 177.20 1p45 h GLU 169 N 0.29 0.21 0.40 1.25 5.08 -1.12 0.30 114.58 120.99 1p45 h GLU 169 Ca 0.31 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1p45 h GLU 169 Cb 0.45 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1p45 h GLU 169 CO -0.38 0.55 -0.19 1.03 -1.00 0.00 0.00 179.01 179.02 1p45 h SER 170 N 0.18 -0.45 -0.72 1.42 0.87 -0.85 -2.72 113.55 111.28 1p45 h SER 170 Ca 0.02 0.02 0.09 0.00 -1.23 0.00 0.00 61.79 60.69 1p45 h SER 170 Cb 0.72 0.12 -0.10 0.00 -0.44 0.00 0.00 62.40 62.69 1p45 h SER 170 CO 0.05 -0.14 -0.34 0.52 -0.53 0.00 0.00 176.83 176.40 1p45 n VAL 171 N -4.48 -0.43 -0.34 2.23 0.31 -0.20 -1.21 118.33 114.22 1p45 n VAL 171 Ca -0.07 1.71 0.15 0.00 -0.01 0.00 0.00 64.34 66.13 1p45 n VAL 171 Cb 0.21 -2.20 0.37 0.00 -0.91 0.00 0.00 33.84 31.31 1p45 n VAL 171 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 1p45 h ASN 172 N 0.00 0.70 1.51 4.52 -1.24 -0.15 0.17 115.58 121.09 1p45 h ASN 172 Ca 0.19 0.10 0.00 0.00 0.71 0.00 0.00 56.30 57.30 1p45 h ASN 172 Cb 0.37 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.40 1p45 h ASN 172 CO -0.70 0.21 -0.23 0.03 -1.29 0.00 0.00 177.43 175.46 1p45 h ARG 173 N 0.66 0.00 -0.08 6.67 3.08 -0.86 -2.06 114.38 121.80 1p45 h ARG 173 Ca 0.59 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.56 1p45 h ARG 173 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.10 1p45 h ARG 173 CO -0.38 0.00 -0.24 0.74 -1.07 0.00 0.00 179.97 179.02 1p45 h PHE 174 N 0.00 0.40 -0.63 3.04 0.04 -0.45 -3.10 116.94 116.23 1p45 h PHE 174 Ca 0.00 -0.16 0.02 0.00 2.80 0.00 0.00 57.97 60.63 1p45 h PHE 174 Cb 0.87 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.92 1p45 h PHE 174 CO 0.00 0.85 0.41 0.28 -0.60 0.00 0.00 178.31 179.26 1p45 h VAL 175 N -0.18 1.13 -0.88 -0.55 2.07 -0.69 0.41 116.25 117.56 1p45 h VAL 175 Ca -0.01 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.30 1p45 h VAL 175 Cb 0.86 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1p45 h VAL 175 CO 0.05 0.15 0.56 0.00 0.02 0.00 0.00 177.57 178.34 1p45 h ALA 176 N 1.62 1.21 -0.67 1.67 0.00 -1.43 0.39 119.26 122.05 1p45 h ALA 176 Ca 0.24 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1p45 h ALA 176 Cb -0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1p45 h ALA 176 CO -0.06 0.32 0.35 0.00 0.00 0.00 0.00 179.25 179.86 1p45 h ARG 177 N 1.02 0.93 -0.05 0.00 3.08 -0.15 -2.69 114.38 116.53 1p45 h ARG 177 Ca 0.38 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.31 1p45 h ARG 177 Cb 0.15 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1p45 h ARG 177 CO -0.17 0.69 -0.05 0.93 -1.07 0.00 0.00 179.97 180.31 1p45 h GLU 178 N 0.93 0.11 0.00 0.04 4.39 0.03 -3.25 114.58 116.84 1p45 h GLU 178 Ca 0.24 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1p45 h GLU 178 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1p45 h GLU 178 CO -0.04 0.58 0.10 0.00 -1.16 0.00 0.00 179.01 178.49 1p45 h ALA 179 N 0.53 1.08 0.00 3.43 0.00 -0.17 -2.80 119.26 121.33 1p45 h ALA 179 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1p45 h ALA 179 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1p45 h ALA 179 CO 0.01 -0.08 -1.03 0.41 0.00 0.00 0.00 179.25 178.57 1p45 n GLY 180 N -1.24 -1.19 0.27 0.00 0.00 -1.03 -0.43 105.19 101.58 1p45 n GLY 180 Ca -0.02 -0.42 0.14 0.00 0.00 0.00 0.00 46.02 45.72 1p45 n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p45 h LYS 181 N 0.00 0.00 -0.17 1.61 1.57 -1.65 -2.90 116.57 115.02 1p45 h LYS 181 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1p45 h LYS 181 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1p45 h LYS 181 CO 0.00 0.10 0.00 0.66 -0.57 0.00 0.00 179.45 179.64 1p45 n TYR 182 N -3.51 0.21 -1.52 -1.35 4.02 -0.89 -4.95 117.16 109.17 1p45 n TYR 182 Ca -0.02 -0.10 -0.11 0.00 -0.01 0.00 0.00 57.90 57.66 1p45 n TYR 182 Cb 0.24 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.52 1p45 n TYR 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1p45 n GLY 183 N 1.29 0.94 3.80 2.72 0.00 -1.10 -3.73 105.19 109.12 1p45 n GLY 183 Ca 0.17 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 1p45 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p45 s VAL 184 N -2.45 5.00 0.30 1.61 1.01 0.43 -1.02 120.40 125.28 1p45 s VAL 184 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 1p45 s VAL 184 Cb 0.00 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1p45 s VAL 184 CO 0.00 0.56 0.51 -0.13 0.00 0.00 0.00 175.10 176.03 1p45 s ARG 185 N -1.14 3.51 -0.13 2.72 0.52 -0.58 -3.92 118.95 119.93 1p45 s ARG 185 Ca 0.16 -0.33 -0.06 0.00 -0.52 0.00 0.00 55.73 54.99 1p45 s ARG 185 Cb -0.12 -2.71 0.06 0.00 0.52 0.00 0.00 34.95 32.70 1p45 s ARG 185 CO 0.06 0.22 0.28 0.45 0.02 0.00 0.00 175.30 176.33 1p45 s SER 186 N -3.76 -0.12 0.06 0.23 0.15 -1.26 -1.64 113.70 107.36 1p45 s SER 186 Ca 0.40 0.62 -0.19 0.00 0.70 0.00 0.00 55.95 57.48 1p45 s SER 186 Cb -0.10 0.59 0.04 0.00 -1.71 0.00 0.00 66.02 64.84 1p45 s SER 186 CO 0.33 -0.19 0.44 0.20 1.20 0.00 0.00 173.24 175.22 1p45 s ASN 187 N 1.68 -0.31 0.35 5.45 -0.87 -0.91 -0.42 114.94 119.91 1p45 s ASN 187 Ca -0.06 -0.03 0.08 0.00 -1.57 0.00 0.00 52.86 51.28 1p45 s ASN 187 Cb -0.11 0.45 -0.04 0.00 -0.02 0.00 0.00 41.25 41.54 1p45 s ASN 187 CO -0.09 -0.72 0.18 -0.76 -2.57 0.00 0.00 177.10 173.14 1p45 s LEU 188 N -2.18 3.32 -0.31 0.60 1.02 0.36 -1.86 118.68 119.63 1p45 s LEU 188 Ca -0.03 -0.74 0.01 0.00 0.02 0.00 0.00 54.13 53.39 1p45 s LEU 188 Cb -0.00 -1.82 0.09 0.00 0.02 0.00 0.00 46.19 44.48 1p45 s LEU 188 CO -0.04 -0.34 0.05 -0.69 0.02 0.00 0.00 176.35 175.35 1p45 s VAL 189 N -2.42 1.51 -0.45 -1.59 1.01 -0.75 -1.19 120.40 116.51 1p45 s VAL 189 Ca 0.39 -1.70 -0.28 0.00 0.00 0.00 0.00 61.98 60.39 1p45 s VAL 189 Cb -0.03 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1p45 s VAL 189 CO 0.24 -0.54 1.82 0.00 0.00 0.00 0.00 175.10 176.62 1p45 s ALA 190 N 1.32 2.56 0.20 5.51 0.00 0.28 0.26 121.76 131.88 1p45 s ALA 190 Ca 0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 51.89 1p45 s ALA 190 Cb -0.18 -4.14 -0.04 0.00 0.00 0.00 0.00 23.12 18.76 1p45 s ALA 190 CO -0.15 -3.19 0.39 0.00 0.00 0.00 0.00 175.76 172.81 1p45 s ALA 191 N 7.86 3.83 0.89 0.00 0.00 -0.38 -0.78 121.76 133.19 1p45 s ALA 191 Ca 0.74 -0.85 -0.13 0.00 0.00 0.00 0.00 51.96 51.72 1p45 s ALA 191 Cb -0.18 -1.98 0.13 0.00 0.00 0.00 0.00 23.12 21.09 1p45 s ALA 191 CO 0.28 0.42 1.20 0.20 0.00 0.00 0.00 175.76 177.86 1p45 s GLY 192 N -3.21 1.63 0.43 0.00 0.00 -0.80 -4.68 107.32 100.69 1p45 s GLY 192 Ca 0.38 -0.77 -0.23 0.00 0.00 0.00 0.00 44.72 44.11 1p45 s GLY 192 CO 0.29 -0.17 1.04 2.56 0.00 0.00 0.00 173.10 176.82 1p45 s PRO 193 N -5.57 4.06 -0.02 2.90 0.05 -1.26 -4.96 135.00 130.20 1p45 s PRO 193 Ca 0.66 1.45 -0.01 0.00 0.05 0.00 0.00 61.00 63.15 1p45 s PRO 193 Cb -0.10 -2.39 0.01 0.00 0.05 0.00 0.00 34.50 32.06 1p45 s PRO 193 CO 0.51 -0.22 0.04 0.42 0.05 0.00 0.00 177.00 177.80 1p45 s ILE 194 N -1.78 -0.01 -0.78 0.56 1.01 -1.26 -4.46 121.20 114.48 1p45 s ILE 194 Ca 0.61 0.04 -0.26 0.00 0.00 0.00 0.00 60.65 61.05 1p45 s ILE 194 Cb -0.20 -0.07 -0.00 0.00 0.01 0.00 0.00 42.46 42.20 1p45 s ILE 194 CO 0.25 0.02 1.68 -0.60 0.00 0.00 0.00 174.94 176.28 1p45 s ARG 195 N 0.25 2.90 0.04 2.79 6.06 0.18 -4.90 118.95 126.27 1p45 s ARG 195 Ca -0.02 -0.10 0.01 0.00 -2.50 0.00 0.00 55.73 53.12 1p45 s ARG 195 Cb -0.03 -4.67 -0.03 0.00 0.06 0.00 0.00 34.95 30.29 1p45 s ARG 195 CO -0.01 -2.67 -0.06 0.95 -2.50 0.00 0.00 175.30 171.02 1p45 s THR 196 N 7.86 0.40 -0.64 4.11 -4.23 -1.26 -4.85 115.64 117.02 1p45 s THR 196 Ca 0.57 -1.13 0.25 0.00 -1.18 0.00 0.00 61.69 60.19 1p45 s THR 196 Cb -0.08 -0.63 0.24 0.00 1.34 0.00 0.00 72.50 73.37 1p45 s THR 196 CO 0.09 -0.49 1.64 -0.07 -0.54 0.00 0.00 174.62 175.25 1p45 h LEU 197 N 4.35 0.00 -5.70 4.79 3.38 -1.92 -0.27 115.31 119.95 1p45 h LEU 197 Ca -0.34 -0.04 -0.41 0.00 0.09 0.00 0.00 57.88 57.18 1p45 h LEU 197 Cb 1.20 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.97 1p45 h LEU 197 CO 0.44 0.02 2.42 0.00 0.09 0.00 0.00 178.44 181.41 1p45 n ALA 198 N -1.87 4.11 0.07 1.53 0.00 -1.26 0.63 120.51 123.72 1p45 n ALA 198 Ca 0.05 -2.11 0.00 0.00 0.00 0.00 0.00 53.44 51.38 1p45 n ALA 198 Cb 0.45 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.81 1p45 n ALA 198 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1p45 n MET 199 N 4.86 0.00 0.00 0.00 0.00 -0.11 -4.77 117.12 117.09 1p45 n MET 199 Ca 0.42 0.00 0.04 0.00 0.00 0.00 0.00 57.70 58.16 1p45 n MET 199 Cb 0.18 0.00 0.25 0.00 0.00 0.00 0.00 33.22 33.65 1p45 n MET 199 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1p45 n SER 200 N -2.76 0.00 0.00 6.12 7.64 -1.14 -2.62 113.62 120.85 1p45 n SER 200 Ca 0.00 -1.31 0.00 0.00 1.01 0.00 0.00 58.87 58.57 1p45 n SER 200 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1p45 n SER 200 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p45 n ALA 201 N -0.67 0.00 0.00 -0.43 0.00 0.20 -4.35 120.51 115.27 1p45 n ALA 201 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1p45 n ALA 201 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1p45 n ALA 201 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1p45 n ILE 202 N -0.08 0.00 0.00 0.00 -0.00 -1.08 -3.00 119.36 115.20 1p45 n ILE 202 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1p45 n ILE 202 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1p45 n ILE 202 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1p45 n VAL 203 N 0.00 0.00 -1.90 1.39 3.14 -1.12 -3.49 118.33 116.34 1p45 n VAL 203 Ca 0.00 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.37 1p45 n VAL 203 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.77 1p45 n VAL 203 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1p45 n GLY 204 N 0.09 -4.62 3.43 7.55 0.00 -1.24 -3.88 105.19 106.53 1p45 n GLY 204 Ca 0.00 0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 1p45 n GLY 204 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p45 s GLY 205 N -0.38 1.57 -0.04 -0.02 0.00 -1.16 -4.45 107.32 102.84 1p45 s GLY 205 Ca -0.04 -1.93 0.00 0.00 0.00 0.00 0.00 44.72 42.75 1p45 s GLY 205 CO 0.11 1.81 0.00 0.00 0.00 0.00 0.00 173.10 175.02 1p45 n ALA 206 N 6.99 -0.01 -1.22 3.20 0.00 -1.26 -4.72 120.51 123.49 1p45 n ALA 206 Ca -0.06 0.01 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 1p45 n ALA 206 Cb 0.44 -0.28 -0.07 0.00 0.00 0.00 0.00 19.45 19.55 1p45 n ALA 206 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p45 n LEU 207 N -0.15 -1.15 0.00 0.00 4.32 -1.25 -0.03 117.00 118.74 1p45 n LEU 207 Ca -0.00 -1.43 0.00 0.00 -0.02 0.00 0.00 56.01 54.55 1p45 n LEU 207 Cb 0.08 -0.83 0.00 0.00 -1.62 0.00 0.00 43.42 41.05 1p45 n LEU 207 CO 0.01 -1.98 0.00 0.61 -1.22 0.00 0.00 177.39 174.81 1p45 n GLY 208 N 5.09 -0.15 4.83 -0.72 0.00 -1.26 -4.06 105.19 108.91 1p45 n GLY 208 Ca 0.22 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1p45 n GLY 208 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1p45 n GLU 209 N 0.00 0.00 0.30 1.61 0.00 0.95 -4.55 120.64 118.95 1p45 n GLU 209 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.21 1p45 n GLU 209 Cb 0.00 -0.70 0.24 0.00 0.00 0.00 0.00 31.44 30.98 1p45 n GLU 209 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 1p45 h GLU 210 N 0.00 0.00 -0.41 5.31 4.22 -1.91 -3.17 114.58 118.62 1p45 h GLU 210 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1p45 h GLU 210 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1p45 h GLU 210 CO 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 179.01 176.83 1p45 n ALA 211 N -1.58 2.39 0.29 2.92 0.00 -1.26 -2.35 120.51 120.91 1p45 n ALA 211 Ca -0.01 -1.03 -0.12 0.00 0.00 0.00 0.00 53.44 52.28 1p45 n ALA 211 Cb 0.76 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 19.37 1p45 n ALA 211 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1p45 h GLY 212 N 3.95 -0.81 0.00 0.00 0.00 -1.93 -3.35 103.07 100.93 1p45 h GLY 212 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1p45 h GLY 212 CO 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 176.54 176.25 1p45 n ALA 213 N -2.71 0.00 0.13 3.60 0.00 -1.25 -0.71 120.51 119.57 1p45 n ALA 213 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1p45 n ALA 213 Cb 0.31 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1p45 n ALA 213 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1p45 n GLN 214 N -0.48 0.13 0.01 0.00 0.00 -0.99 -1.36 117.38 114.69 1p45 n GLN 214 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1p45 n GLN 214 Cb 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 30.24 29.17 1p45 n GLN 214 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1p45 n ILE 215 N 0.43 0.11 -0.23 1.69 5.41 -1.08 -4.36 119.36 121.33 1p45 n ILE 215 Ca 0.00 0.04 -0.02 0.00 1.00 0.00 0.00 62.75 63.76 1p45 n ILE 215 Cb 0.03 -1.40 0.04 0.00 -0.71 0.00 0.00 39.64 37.60 1p45 n ILE 215 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1p45 h GLN 216 N 0.00 -0.09 -0.07 0.38 4.15 -0.19 -1.40 115.11 117.90 1p45 h GLN 216 Ca 0.00 0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.34 1p45 h GLN 216 Cb 0.80 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 1p45 h GLN 216 CO 0.00 -0.06 -0.37 -0.07 -1.93 0.00 0.00 178.83 176.41 1p45 h LEU 217 N -0.09 0.14 -0.22 -2.39 3.38 -1.48 -0.64 115.31 114.02 1p45 h LEU 217 Ca 0.29 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1p45 h LEU 217 Cb 0.55 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1p45 h LEU 217 CO -0.72 0.50 0.14 0.25 0.09 0.00 0.00 178.44 178.70 1p45 h LEU 218 N 0.12 0.26 -1.62 1.67 5.85 -1.66 -1.87 115.31 118.05 1p45 h LEU 218 Ca 0.01 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1p45 h LEU 218 Cb 0.71 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1p45 h LEU 218 CO 0.05 0.20 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.21 1p45 h GLU 219 N 0.29 0.00 0.00 1.25 4.81 -0.41 -1.88 114.58 118.65 1p45 h GLU 219 Ca 0.08 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 1p45 h GLU 219 Cb -0.02 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1p45 h GLU 219 CO -0.02 0.06 -0.61 0.93 -0.73 0.00 0.00 179.01 178.64 1p45 h GLU 220 N 0.00 0.00 -0.24 1.92 5.08 -1.15 -3.12 114.58 117.07 1p45 h GLU 220 Ca -0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1p45 h GLU 220 Cb 0.48 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1p45 h GLU 220 CO 0.01 0.39 -0.14 0.41 -1.00 0.00 0.00 179.01 178.67 1p45 n GLY 221 N 1.59 -0.88 0.13 -3.84 0.00 -0.71 -1.09 105.19 100.38 1p45 n GLY 221 Ca -0.14 0.34 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 1p45 n GLY 221 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1p45 h TRP 222 N 0.00 0.67 -0.75 1.61 2.91 -1.48 -2.18 115.95 116.73 1p45 h TRP 222 Ca 0.04 -0.47 -0.03 0.00 1.13 0.00 0.00 58.89 59.55 1p45 h TRP 222 Cb 0.10 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 28.68 1p45 h TRP 222 CO -0.33 1.36 0.33 0.22 -1.03 0.00 0.00 178.44 179.00 1p45 h ASP 223 N 0.12 0.99 0.39 2.65 1.82 -1.39 -0.68 116.42 120.32 1p45 h ASP 223 Ca -0.17 -0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.33 1p45 h ASP 223 Cb 1.99 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 41.75 1p45 h ASP 223 CO 0.22 0.86 -0.19 -0.61 -1.61 0.00 0.00 179.24 177.92 1p45 h GLN 224 N 1.07 -0.50 -0.73 0.28 4.15 -0.89 -3.04 115.11 115.46 1p45 h GLN 224 Ca 0.26 0.03 0.17 0.00 0.77 0.00 0.00 58.65 59.88 1p45 h GLN 224 Cb 0.15 0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 1p45 h GLN 224 CO -0.03 -0.33 0.50 0.00 -1.93 0.00 0.00 178.83 177.04 1p45 h ARG 225 N -0.55 0.25 -6.33 1.69 3.08 -1.44 -3.43 114.38 107.66 1p45 h ARG 225 Ca -0.05 -0.02 -0.54 0.00 0.07 0.00 0.00 59.98 59.44 1p45 h ARG 225 Cb 0.40 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.33 1p45 h ARG 225 CO 0.09 0.17 1.14 0.00 -1.07 0.00 0.00 179.97 180.29 1p45 s ALA 226 N -5.26 2.70 0.46 0.04 0.00 -0.26 -4.51 121.76 114.93 1p45 s ALA 226 Ca -0.07 -0.75 0.25 0.00 0.00 0.00 0.00 51.96 51.38 1p45 s ALA 226 Cb 0.21 -4.16 1.27 0.00 0.00 0.00 0.00 23.12 20.44 1p45 s ALA 226 CO 0.76 -3.13 1.83 -1.35 0.00 0.00 0.00 175.76 173.86 1p45 h PRO 227 N 11.58 0.23 -0.40 0.00 0.11 -1.75 1.05 132.00 142.80 1p45 h PRO 227 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1p45 h PRO 227 Cb 1.10 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1p45 h PRO 227 CO 1.20 0.15 0.00 0.44 -0.21 0.00 0.00 178.00 179.58 1p45 n ILE 228 N -4.43 0.53 0.00 4.15 -5.35 -1.25 -5.06 119.36 107.94 1p45 n ILE 228 Ca 0.22 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 1p45 n ILE 228 Cb 0.91 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 39.52 1p45 n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p45 n GLY 229 N 1.42 -1.31 3.00 3.28 0.00 0.36 -5.00 105.19 106.94 1p45 n GLY 229 Ca 0.19 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 1p45 n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1p45 s TRP 230 N -3.12 -0.28 -0.39 1.61 -0.11 -1.26 -4.77 118.94 110.61 1p45 s TRP 230 Ca 0.00 0.70 -0.09 0.00 1.22 0.00 0.00 56.10 57.93 1p45 s TRP 230 Cb 0.00 -0.02 0.06 0.00 -1.50 0.00 0.00 33.47 32.01 1p45 s TRP 230 CO 0.00 -0.23 0.22 1.21 -4.62 0.00 0.00 176.95 173.53 1p45 s ASN 231 N 1.42 5.60 0.00 5.86 3.84 -1.26 -4.42 114.94 125.99 1p45 s ASN 231 Ca -0.07 -1.31 0.15 0.00 0.21 0.00 0.00 52.86 51.84 1p45 s ASN 231 Cb -0.11 -1.97 0.66 0.00 -0.55 0.00 0.00 41.25 39.28 1p45 s ASN 231 CO -0.08 -0.46 1.48 0.80 -2.79 0.00 0.00 177.10 176.05 1p45 n MET 232 N 4.92 0.03 -0.27 0.43 0.00 -1.26 -2.71 117.12 118.26 1p45 n MET 232 Ca -0.11 0.23 0.10 0.00 -0.00 0.00 0.00 57.70 57.91 1p45 n MET 232 Cb 0.44 -1.50 0.26 0.00 0.00 0.00 0.00 33.22 32.42 1p45 n MET 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1p45 n LYS 233 N -1.47 2.33 -3.50 2.12 5.02 -1.26 -0.64 118.16 120.75 1p45 n LYS 233 Ca 0.04 -2.05 -0.27 0.00 -2.02 0.00 0.00 58.31 54.01 1p45 n LYS 233 Cb 0.17 -1.46 -0.14 0.00 -0.02 0.00 0.00 35.03 33.59 1p45 n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1p45 s ASP 234 N -1.09 3.11 0.14 4.39 2.15 -1.10 -4.92 116.67 119.35 1p45 s ASP 234 Ca 0.39 -1.35 0.24 0.00 0.43 0.00 0.00 52.55 52.26 1p45 s ASP 234 Cb 0.20 -0.20 0.93 0.00 -0.30 0.00 0.00 42.92 43.55 1p45 s ASP 234 CO 0.27 -0.41 1.75 0.00 -0.17 0.00 0.00 175.17 176.61 1p45 n ALA 235 N 5.05 2.05 0.14 3.66 0.00 -1.26 -4.22 120.51 125.93 1p45 n ALA 235 Ca -0.02 -0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.44 1p45 n ALA 235 Cb 0.42 -1.41 0.47 0.00 0.00 0.00 0.00 19.45 18.93 1p45 n ALA 235 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1p45 h THR 236 N 0.00 1.11 -0.35 0.00 1.35 -1.94 -0.60 112.91 112.48 1p45 h THR 236 Ca 0.00 -0.45 -0.05 0.00 -0.55 0.00 0.00 66.41 65.36 1p45 h THR 236 Cb 0.52 1.02 -0.02 0.00 -1.73 0.00 0.00 68.15 67.94 1p45 h THR 236 CO 0.00 0.15 0.00 -0.65 -0.25 0.00 0.00 175.52 174.77 1p45 h PRO 237 N 0.22 0.55 -0.11 4.72 0.11 -1.99 0.26 132.00 135.74 1p45 h PRO 237 Ca 0.05 -0.12 -0.16 0.00 0.11 0.00 0.00 66.00 65.88 1p45 h PRO 237 Cb 0.19 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 1p45 h PRO 237 CO 0.01 0.57 -0.61 -0.39 -0.21 0.00 0.00 178.00 177.36 1p45 h VAL 238 N 0.52 1.36 -0.45 3.15 -1.51 -1.44 -2.93 116.25 114.96 1p45 h VAL 238 Ca 0.11 -1.95 -0.11 0.00 -1.23 0.00 0.00 66.70 63.52 1p45 h VAL 238 Cb 0.33 1.94 -0.02 0.00 -2.13 0.00 0.00 31.29 31.42 1p45 h VAL 238 CO 0.01 0.59 -0.17 0.00 -1.23 0.00 0.00 177.57 176.77 1p45 h ALA 239 N 1.05 0.85 0.00 5.19 0.00 -0.40 -2.32 119.26 123.64 1p45 h ALA 239 Ca -0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1p45 h ALA 239 Cb 1.15 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1p45 h ALA 239 CO 0.11 0.64 -0.19 0.87 0.00 0.00 0.00 179.25 180.68 1p45 h LYS 240 N 0.76 0.00 0.10 0.00 1.57 -0.52 -1.96 116.57 116.52 1p45 h LYS 240 Ca 0.11 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.67 1p45 h LYS 240 Cb 0.70 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.03 1p45 h LYS 240 CO 0.05 0.19 -0.93 1.15 -0.57 0.00 0.00 179.45 179.34 1p45 h THR 241 N 0.00 1.40 -0.44 -0.16 2.02 -1.24 -1.93 112.91 112.56 1p45 h THR 241 Ca -0.00 -2.38 0.05 0.00 0.77 0.00 0.00 66.41 64.85 1p45 h THR 241 Cb 0.50 2.84 -0.04 0.00 -1.74 0.00 0.00 68.15 69.70 1p45 h THR 241 CO 0.02 0.70 0.19 0.58 0.37 0.00 0.00 175.52 177.38 1p45 h VAL 242 N -0.04 0.92 -0.20 3.16 2.07 -1.22 -1.88 116.25 119.05 1p45 h VAL 242 Ca -0.14 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1p45 h VAL 242 Cb 1.66 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1p45 h VAL 242 CO 0.18 0.07 -0.01 0.00 0.02 0.00 0.00 177.57 177.82 1p45 h ALA 244 N 1.71 0.41 -0.42 0.00 0.00 -0.91 0.36 119.26 120.42 1p45 h ALA 244 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1p45 h ALA 244 Cb 0.22 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1p45 h ALA 244 CO 0.01 -0.33 0.16 -0.07 0.00 0.00 0.00 179.25 179.01 1p45 h LEU 245 N 0.19 0.59 -2.05 0.00 3.38 -0.26 -2.71 115.31 114.45 1p45 h LEU 245 Ca 0.19 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.03 1p45 h LEU 245 Cb 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1p45 h LEU 245 CO -0.25 0.60 0.11 -0.07 0.09 0.00 0.00 178.44 178.92 1p45 h LEU 246 N 0.53 0.00 -9.98 1.67 3.38 -0.35 -3.43 115.31 107.13 1p45 h LEU 246 Ca 0.14 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.73 1p45 h LEU 246 Cb 0.21 0.00 0.22 0.00 0.09 0.00 0.00 40.66 41.17 1p45 h LEU 246 CO -0.01 0.00 -0.15 -0.55 0.09 0.00 0.00 178.44 177.82 1p45 s SER 247 N -6.69 -1.32 0.00 -0.43 0.15 0.12 -4.81 113.70 100.71 1p45 s SER 247 Ca -0.05 0.92 0.25 0.00 0.70 0.00 0.00 55.95 57.76 1p45 s SER 247 Cb 0.17 -1.30 0.38 0.00 -1.71 0.00 0.00 66.02 63.56 1p45 s SER 247 CO 0.67 -5.53 1.37 0.47 1.20 0.00 0.00 173.24 171.41 1p45 n ASP 248 N -5.75 2.68 0.00 5.45 8.00 -1.26 -4.61 116.55 121.05 1p45 n ASP 248 Ca 0.12 -1.89 0.14 0.00 0.71 0.00 0.00 54.79 53.87 1p45 n ASP 248 Cb 0.60 -0.00 0.72 0.00 -0.02 0.00 0.00 41.12 42.42 1p45 n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1p45 n TRP 249 N 1.10 0.00 -3.19 1.24 7.02 -1.26 -2.99 117.44 119.35 1p45 n TRP 249 Ca 0.15 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.37 1p45 n TRP 249 Cb 0.55 -0.25 -0.06 0.00 -2.42 0.00 0.00 31.31 29.13 1p45 n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1p45 n LEU 250 N -1.25 3.45 -0.03 -0.99 7.99 -1.26 -4.94 117.00 119.97 1p45 n LEU 250 Ca 0.14 -5.43 0.15 0.00 -0.01 0.00 0.00 56.01 50.86 1p45 n LEU 250 Cb 0.21 -0.38 0.73 0.00 -0.11 0.00 0.00 43.42 43.87 1p45 n LEU 250 CO 0.21 2.20 0.99 -0.81 -1.51 0.00 0.00 177.39 178.46 1p45 n PRO 251 N 0.42 0.56 -0.54 3.23 -0.04 -1.16 -3.42 135.00 134.05 1p45 n PRO 251 Ca 0.29 -0.07 0.06 0.00 -0.04 0.00 0.00 63.50 63.75 1p45 n PRO 251 Cb 0.44 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.53 1p45 n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p45 n ALA 252 N -1.16 2.81 -3.57 0.55 0.00 -1.26 -5.01 120.51 112.87 1p45 n ALA 252 Ca 0.15 -2.67 -0.32 0.00 0.00 0.00 0.00 53.44 50.60 1p45 n ALA 252 Cb 0.24 -0.43 -0.17 0.00 0.00 0.00 0.00 19.45 19.09 1p45 n ALA 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1p45 s THR 253 N -2.27 2.00 0.12 0.00 -1.32 -1.22 -5.12 115.64 107.82 1p45 s THR 253 Ca 0.31 -0.95 -0.12 0.00 -1.21 0.00 0.00 61.69 59.71 1p45 s THR 253 Cb 0.30 -1.76 0.02 0.00 -1.51 0.00 0.00 72.50 69.54 1p45 s THR 253 CO -0.04 0.54 0.31 -0.89 -2.21 0.00 0.00 174.62 172.33 1p45 s THR 254 N 0.73 0.10 0.00 5.08 2.01 -1.26 -4.56 115.64 117.73 1p45 s THR 254 Ca -0.10 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.00 1p45 s THR 254 Cb -0.16 -1.32 0.00 0.00 0.01 0.00 0.00 72.50 71.03 1p45 s THR 254 CO 0.00 -0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.11 1p45 n GLY 255 N -0.16 0.48 3.59 4.40 0.00 0.44 -4.96 105.19 108.98 1p45 n GLY 255 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1p45 n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1p45 s ASP 256 N -2.01 3.41 -0.15 1.61 -1.08 -1.23 -4.58 116.67 112.64 1p45 s ASP 256 Ca 0.00 -1.45 -0.01 0.00 -0.52 0.00 0.00 52.55 50.56 1p45 s ASP 256 Cb 0.00 -0.06 0.04 0.00 -1.46 0.00 0.00 42.92 41.44 1p45 s ASP 256 CO 0.00 -0.61 -0.02 -0.63 0.52 0.00 0.00 175.17 174.43 1p45 s ILE 257 N -2.95 0.78 -0.16 4.11 1.01 -1.26 -0.49 121.20 122.23 1p45 s ILE 257 Ca 0.29 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.43 1p45 s ILE 257 Cb 0.07 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.47 1p45 s ILE 257 CO 0.14 0.09 0.18 -0.63 0.00 0.00 0.00 174.94 174.72 1p45 s ILE 258 N 1.78 5.39 -0.54 2.92 1.09 -0.33 -4.92 121.20 126.59 1p45 s ILE 258 Ca 0.02 0.30 -0.18 0.00 -1.10 0.00 0.00 60.65 59.69 1p45 s ILE 258 Cb -0.15 -3.50 0.09 0.00 -1.06 0.00 0.00 42.46 37.84 1p45 s ILE 258 CO -0.07 0.48 0.59 -0.31 -0.10 0.00 0.00 174.94 175.53 1p45 s TYR 259 N -0.04 3.10 -1.04 3.97 1.51 -1.26 0.99 117.35 124.58 1p45 s TYR 259 Ca 0.12 -0.89 -0.03 0.00 -1.01 0.00 0.00 57.07 55.26 1p45 s TYR 259 Cb -0.12 -3.70 0.31 0.00 -0.11 0.00 0.00 41.96 38.34 1p45 s TYR 259 CO 0.01 -1.09 1.54 0.00 -1.11 0.00 0.00 175.55 174.91 1p45 n ALA 260 N 5.91 5.38 -0.90 3.71 0.00 0.04 -4.68 120.51 129.97 1p45 n ALA 260 Ca -0.10 -4.75 0.05 0.00 0.00 0.00 0.00 53.44 48.64 1p45 n ALA 260 Cb 0.43 -2.22 0.07 0.00 0.00 0.00 0.00 19.45 17.74 1p45 n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1p45 n ASP 261 N 0.89 1.74 -0.09 0.00 5.75 -1.25 -1.91 116.55 121.67 1p45 n ASP 261 Ca 0.32 -2.47 -0.01 0.00 -0.01 0.00 0.00 54.79 52.61 1p45 n ASP 261 Cb 0.32 -0.25 -0.00 0.00 -1.03 0.00 0.00 41.12 40.16 1p45 n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1p45 n GLY 262 N -0.87 0.45 2.24 6.12 0.00 -1.26 -2.92 105.19 108.96 1p45 n GLY 262 Ca 0.08 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 1p45 n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p45 n GLY 263 N -2.68 0.52 0.29 -0.02 0.00 -1.26 -2.91 105.19 99.14 1p45 n GLY 263 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 1p45 n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p45 h ALA 264 N 0.81 0.91 -0.01 4.61 0.00 -1.76 -3.13 119.26 120.70 1p45 h ALA 264 Ca -0.31 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1p45 h ALA 264 Cb 1.07 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1p45 h ALA 264 CO 0.41 0.44 0.01 1.12 0.00 0.00 0.00 179.25 181.23 1p45 h HIS 265 N 0.98 0.00 0.00 0.00 2.07 -1.90 -1.49 115.15 114.81 1p45 h HIS 265 Ca 0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.77 1p45 h HIS 265 Cb 0.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.05 1p45 h HIS 265 CO 0.00 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.11 1p45 n THR 266 N -3.68 0.00 -4.34 6.12 -2.24 -1.18 -4.85 114.28 104.10 1p45 n THR 266 Ca -0.03 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.55 1p45 n THR 266 Cb 0.09 -0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 67.86 1p45 n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1p45 s GLN 267 N -2.00 0.93 -0.23 -0.78 -1.52 -0.56 -5.04 119.66 110.45 1p45 s GLN 267 Ca 0.28 -0.77 -0.02 0.00 -1.95 0.00 0.00 55.36 52.90 1p45 s GLN 267 Cb 0.13 -0.94 -0.14 0.00 -0.22 0.00 0.00 33.01 31.85 1p45 s GLN 267 CO 0.22 0.23 -0.24 -0.11 -0.25 0.00 0.00 175.29 175.14 1p45 n LEU 268 N 1.86 2.62 0.00 2.90 7.94 -1.26 -4.99 117.00 126.07 1p45 n LEU 268 Ca -0.18 -0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 1p45 n LEU 268 Cb 0.55 -0.78 0.00 0.00 0.53 0.00 0.00 43.42 43.72 1p45 n LEU 268 CO 0.23 0.78 0.00 0.00 -1.11 0.00 0.00 177.39 177.28