#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 0.04 0.27 1.09 0.00 -1.26 -4.52 105.19 100.82 1p45 n GLY 3 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 1p45 n GLY 3 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1p45 h LEU 4 N 0.00 0.59 -2.93 0.99 3.38 -1.96 -3.01 115.31 112.36 1p45 h LEU 4 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1p45 h LEU 4 Cb 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1p45 h LEU 4 CO 0.00 0.37 0.00 0.18 0.09 0.00 0.00 178.44 179.08 1p45 n LEU 5 N -4.77 2.65 -4.60 1.67 4.32 0.49 -4.77 117.00 111.99 1p45 n LEU 5 Ca 0.10 -2.04 -0.59 0.00 -0.02 0.00 0.00 56.01 53.46 1p45 n LEU 5 Cb 0.19 -0.17 -0.08 0.00 -1.62 0.00 0.00 43.42 41.74 1p45 n LEU 5 CO 0.29 0.66 1.44 0.47 -1.22 0.00 0.00 177.39 179.02 1p45 n ASP 6 N 0.14 1.90 0.00 -1.43 10.43 -0.97 -1.23 116.55 125.39 1p45 n ASP 6 Ca 0.08 0.92 0.00 0.00 2.57 0.00 0.00 54.79 58.36 1p45 n ASP 6 Cb 0.38 -1.08 0.00 0.00 1.84 0.00 0.00 41.12 42.26 1p45 n ASP 6 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1p45 n GLY 7 N 5.08 0.68 3.67 0.44 0.00 -0.98 -5.01 105.19 109.07 1p45 n GLY 7 Ca 0.34 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.02 1p45 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p45 s LYS 8 N -0.58 2.92 -0.14 1.61 1.02 -0.36 -4.91 119.74 119.30 1p45 s LYS 8 Ca 0.00 -0.46 -0.04 0.00 0.02 0.00 0.00 55.97 55.49 1p45 s LYS 8 Cb 0.00 -2.74 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 1p45 s LYS 8 CO 0.00 0.69 0.02 1.03 -0.92 0.00 0.00 175.35 176.16 1p45 s ARG 9 N -0.97 3.54 -0.09 1.68 0.52 -1.26 -1.32 118.95 121.06 1p45 s ARG 9 Ca 0.14 -0.41 -0.03 0.00 -0.52 0.00 0.00 55.73 54.91 1p45 s ARG 9 Cb -0.11 -2.99 0.05 0.00 0.52 0.00 0.00 34.95 32.42 1p45 s ARG 9 CO 0.03 0.42 0.17 0.42 0.02 0.00 0.00 175.30 176.37 1p45 s ILE 10 N -0.10 -0.25 0.34 1.52 1.01 -0.57 -0.76 121.20 122.40 1p45 s ILE 10 Ca 0.05 0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.77 1p45 s ILE 10 Cb -0.13 -0.30 -0.10 0.00 0.01 0.00 0.00 42.46 41.95 1p45 s ILE 10 CO 0.02 0.14 0.97 -0.22 0.00 0.00 0.00 174.94 175.85 1p45 s LEU 11 N 2.15 4.29 -0.27 2.97 0.20 -0.50 -2.11 118.68 125.41 1p45 s LEU 11 Ca 0.01 1.89 -0.02 0.00 0.69 0.00 0.00 54.13 56.70 1p45 s LEU 11 Cb -0.12 -4.06 0.12 0.00 -0.43 0.00 0.00 46.19 41.70 1p45 s LEU 11 CO -0.06 -0.17 0.24 -0.69 -0.29 0.00 0.00 176.35 175.38 1p45 s VAL 12 N -1.63 -0.30 1.28 1.68 1.01 -0.74 -1.76 120.40 119.95 1p45 s VAL 12 Ca 0.52 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.86 1p45 s VAL 12 Cb -0.19 -0.92 0.33 0.00 0.00 0.00 0.00 36.38 35.59 1p45 s VAL 12 CO 0.25 -0.48 0.95 -1.20 0.00 0.00 0.00 175.10 174.62 1p45 n SER 13 N 5.30 -2.58 0.00 3.32 7.64 -0.45 -1.87 113.62 124.97 1p45 n SER 13 Ca -0.04 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.44 1p45 n SER 13 Cb 0.46 -1.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1p45 n SER 13 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p45 n GLY 14 N 1.33 1.59 3.67 0.23 0.00 -1.22 -4.30 105.19 106.49 1p45 n GLY 14 Ca 0.05 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 0.21 0.00 -0.61 5.41 -1.25 -4.73 119.36 116.39 1p45 n ILE 15 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.71 1p45 n ILE 15 Cb 0.00 -1.55 0.00 0.00 -0.71 0.00 0.00 39.64 37.38 1p45 n ILE 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1p45 n ILE 16 N 3.97 0.00 -4.15 1.39 0.13 -1.26 -4.60 119.36 114.84 1p45 n ILE 16 Ca 0.20 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.73 1p45 n ILE 16 Cb 0.27 -0.02 -0.08 0.00 -0.84 0.00 0.00 39.64 38.96 1p45 n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 1p45 s THR 17 N -1.13 0.00 -1.77 9.51 -4.23 -1.26 -4.86 115.64 111.89 1p45 s THR 17 Ca 0.00 -1.83 0.19 0.00 -1.18 0.00 0.00 61.69 58.87 1p45 s THR 17 Cb 0.00 -2.43 0.45 0.00 1.34 0.00 0.00 72.50 71.87 1p45 s THR 17 CO 0.00 0.00 1.54 -0.90 -0.54 0.00 0.00 174.62 174.72 1p45 n ASP 18 N -0.42 0.00 0.00 3.99 5.68 -1.26 -2.77 116.55 121.77 1p45 n ASP 18 Ca 0.01 -0.35 0.00 0.00 -0.50 0.00 0.00 54.79 53.95 1p45 n ASP 18 Cb 0.65 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1p45 n ASP 18 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1p45 n SER 19 N -1.11 2.55 -4.34 -1.12 3.41 -1.26 -4.82 113.62 106.94 1p45 n SER 19 Ca 0.12 -0.10 -0.43 0.00 -0.26 0.00 0.00 58.87 58.19 1p45 n SER 19 Cb 0.10 0.72 -0.01 0.00 -0.26 0.00 0.00 64.21 64.76 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 -0.97 -2.32 -0.05 4.04 7.64 -1.11 -4.64 113.62 116.19 1p45 n SER 20 Ca 0.00 0.90 -0.14 0.00 1.01 0.00 0.00 58.87 60.63 1p45 n SER 20 Cb 0.00 -0.92 -0.07 0.00 -1.01 0.00 0.00 64.21 62.21 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 0.53 1.35 -0.97 0.44 2.04 -1.90 -2.62 117.51 116.37 1p45 h ILE 21 Ca -0.35 -1.60 0.25 0.00 1.00 0.00 0.00 64.86 64.16 1p45 h ILE 21 Cb 1.44 1.95 -0.13 0.00 -0.74 0.00 0.00 36.82 39.35 1p45 h ILE 21 CO 0.50 0.48 0.53 0.00 0.00 0.00 0.00 178.15 179.66 1p45 h ALA 22 N 0.57 1.70 0.13 1.87 0.00 -1.85 -1.26 119.26 120.42 1p45 h ALA 22 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1p45 h ALA 22 Cb 0.94 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1p45 h ALA 22 CO 0.08 -0.33 -0.06 0.35 0.00 0.00 0.00 179.25 179.29 1p45 h PHE 23 N 0.49 -0.16 0.00 0.00 3.04 -1.75 0.31 116.94 118.87 1p45 h PHE 23 Ca 0.63 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.57 1p45 h PHE 23 Cb 1.23 0.05 -0.00 0.00 2.56 0.00 0.00 35.95 39.79 1p45 h PHE 23 CO -0.05 -0.06 -0.03 0.45 -2.02 0.00 0.00 178.31 176.60 1p45 h HIS 24 N -0.22 0.00 -0.01 0.41 3.86 -1.30 0.12 115.15 118.00 1p45 h HIS 24 Ca -0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1p45 h HIS 24 Cb 0.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.65 1p45 h HIS 24 CO -0.05 0.03 -0.00 0.82 0.86 0.00 0.00 177.93 179.59 1p45 h ILE 25 N 0.00 1.32 -0.52 2.45 2.04 0.21 -2.95 117.51 120.05 1p45 h ILE 25 Ca -0.00 -0.94 0.04 0.00 1.00 0.00 0.00 64.86 64.96 1p45 h ILE 25 Cb 0.13 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 1p45 h ILE 25 CO 0.00 0.25 0.29 0.00 0.00 0.00 0.00 178.15 178.69 1p45 h ALA 26 N 0.61 0.67 -0.66 1.87 0.00 0.11 -0.51 119.26 121.34 1p45 h ALA 26 Ca 0.00 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1p45 h ALA 26 Cb 0.40 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 1p45 h ALA 26 CO 0.00 -0.03 0.22 -0.09 0.00 0.00 0.00 179.25 179.35 1p45 h ARG 27 N 0.57 0.37 0.25 0.00 2.43 -0.86 -0.67 114.38 116.46 1p45 h ARG 27 Ca 0.22 -0.02 -0.33 0.00 -0.81 0.00 0.00 59.98 59.04 1p45 h ARG 27 Cb 0.08 -0.08 0.04 0.00 -0.42 0.00 0.00 29.97 29.59 1p45 h ARG 27 CO -0.13 0.24 -1.47 0.28 -1.51 0.00 0.00 179.97 177.39 1p45 h VAL 28 N 0.38 1.27 -0.60 0.20 2.07 -1.26 -0.71 116.25 117.61 1p45 h VAL 28 Ca 0.35 -2.68 0.12 0.00 0.82 0.00 0.00 66.70 65.30 1p45 h VAL 28 Cb 0.49 3.04 -0.12 0.00 -1.52 0.00 0.00 31.29 33.19 1p45 h VAL 28 CO -0.37 0.81 -0.23 0.00 0.02 0.00 0.00 177.57 177.80 1p45 h ALA 29 N 0.14 0.22 -0.43 1.67 0.00 -0.89 -2.32 119.26 117.66 1p45 h ALA 29 Ca -0.26 0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1p45 h ALA 29 Cb 2.15 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 20.53 1p45 h ALA 29 CO 0.27 -0.53 -0.17 1.96 0.00 0.00 0.00 179.25 180.78 1p45 h GLN 30 N -0.08 0.87 0.00 0.00 4.20 -0.67 -2.17 115.11 117.26 1p45 h GLN 30 Ca 0.27 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1p45 h GLN 30 Cb 0.50 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1p45 h GLN 30 CO -0.65 1.01 0.00 0.39 -0.67 0.00 0.00 178.83 178.90 1p45 n GLU 31 N -4.23 0.36 -0.04 1.46 1.02 -0.31 -1.43 120.64 117.47 1p45 n GLU 31 Ca -0.01 0.08 0.03 0.00 -0.02 0.00 0.00 57.16 57.24 1p45 n GLU 31 Cb 0.42 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.39 1p45 n GLU 31 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1p45 n GLN 32 N -1.18 1.13 -0.10 3.49 1.13 -0.85 -4.99 117.38 116.02 1p45 n GLN 32 Ca 0.10 -1.26 0.00 0.00 -1.94 0.00 0.00 57.00 53.90 1p45 n GLN 32 Cb 0.11 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.33 1p45 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p45 n GLY 33 N 0.23 0.88 2.94 1.08 0.00 -0.52 -0.38 105.19 109.43 1p45 n GLY 33 Ca 0.05 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.99 0.33 -0.11 4.61 0.00 -1.16 -2.29 121.76 121.15 1p45 s ALA 34 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 51.96 51.72 1p45 s ALA 34 Cb 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1p45 s ALA 34 CO 0.00 0.07 0.04 -1.14 0.00 0.00 0.00 175.76 174.73 1p45 s GLN 35 N -0.19 3.27 0.16 0.00 0.74 -0.43 -4.41 119.66 118.80 1p45 s GLN 35 Ca 0.01 -0.35 0.08 0.00 0.05 0.00 0.00 55.36 55.15 1p45 s GLN 35 Cb -0.02 -2.94 -0.04 0.00 1.10 0.00 0.00 33.01 31.10 1p45 s GLN 35 CO -0.00 0.62 -0.17 -0.51 -0.55 0.00 0.00 175.29 174.68 1p45 s LEU 36 N -0.63 2.44 0.04 3.68 1.43 -1.26 -1.51 118.68 122.87 1p45 s LEU 36 Ca 0.11 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.40 1p45 s LEU 36 Cb -0.12 -0.76 -0.03 0.00 0.03 0.00 0.00 46.19 45.31 1p45 s LEU 36 CO 0.02 -0.07 -0.13 -0.69 0.23 0.00 0.00 176.35 175.71 1p45 s VAL 37 N -2.15 3.14 0.04 -1.59 1.01 -0.90 -4.01 120.40 115.94 1p45 s VAL 37 Ca 0.15 -1.08 0.07 0.00 0.00 0.00 0.00 61.98 61.12 1p45 s VAL 37 Cb -0.05 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 1p45 s VAL 37 CO 0.06 0.32 -0.20 -0.76 0.00 0.00 0.00 175.10 174.52 1p45 s LEU 38 N -1.55 2.17 0.33 3.92 1.43 -1.02 -1.79 118.68 122.17 1p45 s LEU 38 Ca 0.16 -0.52 0.08 0.00 -1.03 0.00 0.00 54.13 52.82 1p45 s LEU 38 Cb -0.11 -0.92 -0.06 0.00 0.03 0.00 0.00 46.19 45.12 1p45 s LEU 38 CO 0.07 0.14 -0.05 0.42 0.23 0.00 0.00 176.35 177.16 1p45 s THR 39 N -0.82 1.90 0.26 5.49 -4.23 -0.78 -2.04 115.64 115.41 1p45 s THR 39 Ca 0.07 -2.12 -0.19 0.00 -1.18 0.00 0.00 61.69 58.26 1p45 s THR 39 Cb -0.09 -2.65 0.02 0.00 1.34 0.00 0.00 72.50 71.12 1p45 s THR 39 CO 0.02 -0.18 0.63 -0.83 -0.54 0.00 0.00 174.62 173.72 1p45 s GLY 40 N -3.56 0.03 0.25 3.99 0.00 -1.10 -3.38 107.32 103.55 1p45 s GLY 40 Ca 0.32 -0.39 0.02 0.00 0.00 0.00 0.00 44.72 44.68 1p45 s GLY 40 CO 0.15 -0.22 0.05 -0.12 0.00 0.00 0.00 173.10 172.96 1p45 s PHE 41 N -3.93 1.58 0.03 1.90 5.36 -1.26 -1.61 117.98 120.06 1p45 s PHE 41 Ca 0.13 -1.05 0.00 0.00 -0.96 0.00 0.00 56.93 55.04 1p45 s PHE 41 Cb -0.04 -0.95 0.00 0.00 -0.34 0.00 0.00 43.02 41.70 1p45 s PHE 41 CO 0.05 -0.18 0.51 -0.40 -1.46 0.00 0.00 175.22 173.74 1p45 n ASP 42 N -0.47 0.00 -4.13 6.13 5.75 -1.26 -4.40 116.55 118.17 1p45 n ASP 42 Ca -0.02 0.03 -0.44 0.00 -0.01 0.00 0.00 54.79 54.35 1p45 n ASP 42 Cb 0.65 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.75 1p45 n ASP 42 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1p45 n ARG 43 N -1.05 3.99 -0.01 0.11 1.74 -1.26 -4.87 116.66 115.32 1p45 n ARG 43 Ca 0.00 -4.34 -0.17 0.00 -0.77 0.00 0.00 57.85 52.57 1p45 n ARG 43 Cb 0.51 -2.62 -0.11 0.00 -1.02 0.00 0.00 32.46 29.22 1p45 n ARG 43 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1p45 h LEU 44 N 6.48 0.44 -0.59 0.55 7.12 -1.97 -1.12 115.31 126.22 1p45 h LEU 44 Ca 0.23 -0.75 -0.11 0.00 0.13 0.00 0.00 57.88 57.38 1p45 h LEU 44 Cb 0.72 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.70 1p45 h LEU 44 CO 1.27 1.13 -0.52 0.03 -0.13 0.00 0.00 178.44 180.21 1p45 h ARG 45 N -0.21 0.00 -0.59 1.25 -0.00 -1.98 -2.28 114.38 110.58 1p45 h ARG 45 Ca -0.06 0.00 0.07 0.00 -0.50 0.00 0.00 59.98 59.49 1p45 h ARG 45 Cb 1.20 0.00 -0.10 0.00 0.00 0.00 0.00 29.97 31.07 1p45 h ARG 45 CO 0.09 0.52 -0.55 1.25 0.00 0.00 0.00 179.97 181.29 1p45 h LEU 46 N 0.00 -1.90 -0.71 3.04 6.46 -1.96 -1.78 115.31 118.46 1p45 h LEU 46 Ca -0.01 0.27 0.13 0.00 -0.12 0.00 0.00 57.88 58.15 1p45 h LEU 46 Cb 1.15 0.81 -0.09 0.00 -0.73 0.00 0.00 40.66 41.79 1p45 h LEU 46 CO 0.07 -0.35 0.27 0.40 -0.62 0.00 0.00 178.44 178.21 1p45 h ILE 47 N -0.27 0.68 -0.77 4.05 1.08 -0.66 -2.29 117.51 119.34 1p45 h ILE 47 Ca 0.11 -0.14 -0.04 0.00 -0.39 0.00 0.00 64.86 64.40 1p45 h ILE 47 Cb 0.54 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.48 1p45 h ILE 47 CO -0.70 0.08 0.34 1.56 -0.69 0.00 0.00 178.15 178.73 1p45 h GLN 48 N 0.42 1.12 -0.41 2.37 1.08 -0.81 -0.46 115.11 118.42 1p45 h GLN 48 Ca 0.38 -0.18 0.03 0.00 -1.45 0.00 0.00 58.65 57.43 1p45 h GLN 48 Cb 0.56 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.76 1p45 h GLN 48 CO -0.38 0.89 0.19 0.00 -0.95 0.00 0.00 178.83 178.58 1p45 h ARG 49 N 1.09 0.38 -0.56 1.46 3.08 -1.18 -1.54 114.38 117.12 1p45 h ARG 49 Ca 0.26 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 1p45 h ARG 49 Cb 0.16 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1p45 h ARG 49 CO -0.03 0.25 0.29 0.82 -1.07 0.00 0.00 179.97 180.24 1p45 h ILE 50 N 0.39 1.19 0.00 2.04 1.08 -0.64 -2.79 117.51 118.79 1p45 h ILE 50 Ca 0.18 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1p45 h ILE 50 Cb 0.10 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 34.35 1p45 h ILE 50 CO -0.13 0.21 -0.28 1.07 -0.69 0.00 0.00 178.15 178.33 1p45 n THR 51 N -4.59 0.35 0.23 -0.27 5.66 -0.31 -2.52 114.28 112.84 1p45 n THR 51 Ca 0.03 -0.21 0.09 0.00 -3.05 0.00 0.00 64.05 60.91 1p45 n THR 51 Cb 0.10 -0.32 0.64 0.00 -1.55 0.00 0.00 70.33 69.20 1p45 n THR 51 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 1p45 h ASP 52 N 0.00 0.01 -0.06 1.09 3.45 -0.98 -2.54 116.42 117.40 1p45 h ASP 52 Ca 0.00 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1p45 h ASP 52 Cb 0.68 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.44 1p45 h ASP 52 CO 0.00 0.01 0.00 -2.11 -1.57 0.00 0.00 179.24 175.57 1p45 n ARG 53 N -4.53 1.15 -2.74 3.56 1.85 -1.05 -4.77 116.66 110.13 1p45 n ARG 53 Ca -0.02 -0.23 -0.37 0.00 -1.00 0.00 0.00 57.85 56.24 1p45 n ARG 53 Cb 0.13 -1.10 -0.06 0.00 -1.05 0.00 0.00 32.46 30.38 1p45 n ARG 53 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1p45 s LEU 54 N -1.10 4.31 0.00 2.89 1.43 -0.96 -5.02 118.68 120.23 1p45 s LEU 54 Ca 0.09 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 1p45 s LEU 54 Cb 0.04 -4.04 0.00 0.00 0.03 0.00 0.00 46.19 42.22 1p45 s LEU 54 CO 0.06 -0.14 0.45 -2.65 0.23 0.00 0.00 176.35 174.31 1p45 n PRO 55 N 0.46 0.00 -2.48 1.29 -0.02 -1.26 -4.47 135.00 128.52 1p45 n PRO 55 Ca 0.02 0.45 -0.38 0.00 -2.02 0.00 0.00 63.50 61.58 1p45 n PRO 55 Cb 0.50 -0.92 -0.04 0.00 -0.02 0.00 0.00 33.50 33.02 1p45 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p45 s ALA 56 N -2.80 3.16 1.04 3.55 0.00 -1.26 -5.07 121.76 120.38 1p45 s ALA 56 Ca 0.00 0.79 -0.14 0.00 0.00 0.00 0.00 51.96 52.61 1p45 s ALA 56 Cb 0.00 -3.31 0.11 0.00 0.00 0.00 0.00 23.12 19.93 1p45 s ALA 56 CO 0.00 -0.27 0.45 1.63 0.00 0.00 0.00 175.76 177.57 1p45 n LYS 57 N 0.21 -1.09 -3.52 0.00 5.02 -1.26 -5.02 118.16 112.50 1p45 n LYS 57 Ca 0.04 -0.28 -0.15 0.00 -2.02 0.00 0.00 58.31 55.89 1p45 n LYS 57 Cb 0.48 -1.91 -0.05 0.00 -0.02 0.00 0.00 35.03 33.52 1p45 n LYS 57 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p45 s ALA 58 N -2.37 -1.79 0.83 7.82 0.00 -1.26 -4.85 121.76 120.14 1p45 s ALA 58 Ca 0.60 1.28 -0.11 0.00 0.00 0.00 0.00 51.96 53.73 1p45 s ALA 58 Cb -0.19 -0.05 0.09 0.00 0.00 0.00 0.00 23.12 22.97 1p45 s ALA 58 CO 0.66 -0.41 1.10 -2.14 0.00 0.00 0.00 175.76 174.96 1p45 s PRO 59 N -1.54 1.78 -0.02 0.00 0.02 -1.26 -4.93 135.00 129.06 1p45 s PRO 59 Ca -0.07 1.16 -0.00 0.00 0.02 0.00 0.00 61.00 62.11 1p45 s PRO 59 Cb -0.00 -1.84 0.03 0.00 0.02 0.00 0.00 34.50 32.70 1p45 s PRO 59 CO 0.05 -1.97 0.04 -1.17 -0.33 0.00 0.00 177.00 173.61 1p45 s LEU 60 N -6.12 1.18 -0.01 -5.54 0.20 -1.26 -2.43 118.68 104.70 1p45 s LEU 60 Ca 0.63 0.06 0.06 0.00 0.69 0.00 0.00 54.13 55.57 1p45 s LEU 60 Cb -0.18 -0.01 -0.02 0.00 -0.43 0.00 0.00 46.19 45.55 1p45 s LEU 60 CO 0.57 -0.11 -0.20 -0.76 -0.29 0.00 0.00 176.35 175.55 1p45 s LEU 61 N 0.91 2.05 0.57 -0.68 1.43 -0.87 -5.01 118.68 117.08 1p45 s LEU 61 Ca -0.07 -0.37 -0.21 0.00 -1.03 0.00 0.00 54.13 52.44 1p45 s LEU 61 Cb -0.11 -1.04 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 1p45 s LEU 61 CO -0.03 0.24 1.25 1.21 0.23 0.00 0.00 176.35 179.25 1p45 n GLU 62 N 2.54 1.41 -2.93 1.70 2.13 -1.26 -2.70 120.64 121.52 1p45 n GLU 62 Ca -0.15 0.53 0.03 0.00 0.66 0.00 0.00 57.16 58.22 1p45 n GLU 62 Cb 0.53 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.79 1p45 n GLU 62 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1p45 s LEU 63 N -3.12 -0.42 -0.25 4.31 2.96 -0.63 -4.83 118.68 116.70 1p45 s LEU 63 Ca 0.74 -0.11 -0.11 0.00 -0.22 0.00 0.00 54.13 54.43 1p45 s LEU 63 Cb -0.42 0.81 -0.05 0.00 0.50 0.00 0.00 46.19 47.03 1p45 s LEU 63 CO 0.48 -0.06 0.20 -0.62 -1.32 0.00 0.00 176.35 175.03 1p45 s ASP 64 N 2.34 6.11 0.00 3.68 -1.08 -1.26 -4.43 116.67 122.03 1p45 s ASP 64 Ca 0.20 0.11 0.30 0.00 -0.52 0.00 0.00 52.55 52.63 1p45 s ASP 64 Cb 0.01 -2.12 1.44 0.00 -1.46 0.00 0.00 42.92 40.79 1p45 s ASP 64 CO -0.18 0.00 1.97 1.33 0.52 0.00 0.00 175.17 178.82 1p45 n VAL 65 N 4.59 0.00 0.52 1.11 0.24 -1.26 -3.10 118.33 120.43 1p45 n VAL 65 Ca -0.14 -0.08 0.12 0.00 -2.04 0.00 0.00 64.34 62.21 1p45 n VAL 65 Cb 0.52 -0.13 0.23 0.00 -1.47 0.00 0.00 33.84 32.99 1p45 n VAL 65 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1p45 h GLN 66 N 0.73 0.00 -4.92 7.34 4.20 -1.95 -3.46 115.11 117.05 1p45 h GLN 66 Ca 0.00 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 58.07 1p45 h GLN 66 Cb 0.26 0.00 -0.17 0.00 0.30 0.00 0.00 27.48 27.87 1p45 h GLN 66 CO 0.00 0.00 -0.52 1.21 -0.67 0.00 0.00 178.83 178.85 1p45 s ASN 67 N -4.60 6.03 0.28 1.46 3.04 -1.18 -5.03 114.94 114.94 1p45 s ASN 67 Ca 0.07 0.00 0.09 0.00 0.04 0.00 0.00 52.86 53.06 1p45 s ASN 67 Cb 0.12 -2.12 0.39 0.00 -1.54 0.00 0.00 41.25 38.11 1p45 s ASN 67 CO 0.68 -0.04 1.64 -0.33 -3.04 0.00 0.00 177.10 176.02 1p45 h GLU 68 N 8.28 0.08 0.00 0.43 3.07 -1.88 -3.21 114.58 121.34 1p45 h GLU 68 Ca -0.35 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 1p45 h GLU 68 Cb 1.19 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1p45 h GLU 68 CO 0.56 0.62 0.00 0.93 -1.40 0.00 0.00 179.01 179.72 1p45 h GLU 69 N 0.06 0.00 0.11 2.33 5.08 -1.96 0.98 114.58 121.18 1p45 h GLU 69 Ca -0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1p45 h GLU 69 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1p45 h GLU 69 CO 0.08 0.00 -1.16 0.45 -1.00 0.00 0.00 179.01 177.37 1p45 h HIS 70 N 0.00 0.42 0.64 4.33 3.86 -1.89 -3.15 115.15 119.35 1p45 h HIS 70 Ca 0.00 -0.30 -0.03 0.00 -1.16 0.00 0.00 60.37 58.88 1p45 h HIS 70 Cb 0.22 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1p45 h HIS 70 CO 0.00 1.45 -0.35 -0.07 0.86 0.00 0.00 177.93 179.83 1p45 h LEU 71 N -0.41 -0.85 -1.00 2.43 -0.00 -1.44 -2.14 115.31 111.91 1p45 h LEU 71 Ca -0.25 0.04 0.28 0.00 -0.00 0.00 0.00 57.88 57.95 1p45 h LEU 71 Cb 1.66 0.24 -0.19 0.00 -0.00 0.00 0.00 40.66 42.37 1p45 h LEU 71 CO 0.06 -0.56 0.03 0.00 -0.00 0.00 0.00 178.44 177.97 1p45 n ALA 72 N -2.54 0.52 1.10 1.53 0.00 0.29 -2.69 120.51 118.73 1p45 n ALA 72 Ca -0.13 1.07 0.13 0.00 0.00 0.00 0.00 53.44 54.50 1p45 n ALA 72 Cb 0.38 -0.79 0.38 0.00 0.00 0.00 0.00 19.45 19.43 1p45 n ALA 72 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p45 n SER 73 N -5.49 0.51 0.03 0.00 3.41 -1.06 -4.41 113.62 106.61 1p45 n SER 73 Ca 0.24 -0.28 -0.20 0.00 -0.26 0.00 0.00 58.87 58.36 1p45 n SER 73 Cb 0.78 0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 64.65 1p45 n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1p45 h LEU 74 N 0.29 0.43 -0.81 1.04 6.46 -1.17 -1.92 115.31 119.63 1p45 h LEU 74 Ca 0.00 -0.92 -0.07 0.00 -0.12 0.00 0.00 57.88 56.77 1p45 h LEU 74 Cb 0.48 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1p45 h LEU 74 CO 0.00 1.44 0.11 0.00 -0.62 0.00 0.00 178.44 179.37 1p45 h ALA 75 N 0.04 1.02 -0.97 1.25 0.00 -1.77 0.26 119.26 119.08 1p45 h ALA 75 Ca -0.18 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 54.59 1p45 h ALA 75 Cb 1.65 -0.24 -0.13 0.00 0.00 0.00 0.00 17.79 19.07 1p45 h ALA 75 CO 0.12 0.63 -0.52 0.78 0.00 0.00 0.00 179.25 180.26 1p45 h GLY 76 N 1.04 -0.53 2.00 0.00 0.00 -1.78 -0.67 103.07 103.12 1p45 h GLY 76 Ca 0.19 0.70 -0.07 0.00 0.00 0.00 0.00 47.33 48.15 1p45 h GLY 76 CO 0.01 -0.05 -0.34 3.21 0.00 0.00 0.00 176.54 179.38 1p45 h ARG 77 N -0.02 0.00 0.00 4.80 3.08 -0.49 -1.44 114.38 120.32 1p45 h ARG 77 Ca 0.22 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.24 1p45 h ARG 77 Cb 0.48 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1p45 h ARG 77 CO -0.94 0.34 -0.21 0.28 -1.07 0.00 0.00 179.97 178.37 1p45 h VAL 78 N 0.00 1.00 -0.90 2.04 2.07 0.03 -2.39 116.25 118.10 1p45 h VAL 78 Ca -0.00 -1.82 0.15 0.00 0.82 0.00 0.00 66.70 65.85 1p45 h VAL 78 Cb 0.94 1.95 -0.15 0.00 -1.52 0.00 0.00 31.29 32.51 1p45 h VAL 78 CO 0.04 0.34 -0.32 0.41 0.02 0.00 0.00 177.57 178.06 1p45 n THR 79 N -4.64 -0.45 -0.29 2.57 -1.04 -0.31 -1.33 114.28 108.79 1p45 n THR 79 Ca -0.10 2.10 0.03 0.00 -2.04 0.00 0.00 64.05 64.04 1p45 n THR 79 Cb 0.35 -2.80 0.16 0.00 -1.82 0.00 0.00 70.33 66.22 1p45 n THR 79 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1p45 h GLU 80 N 0.00 0.76 -0.00 -2.82 4.81 -1.21 0.18 114.58 116.31 1p45 h GLU 80 Ca 0.34 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1p45 h GLU 80 Cb 0.57 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1p45 h GLU 80 CO -0.90 0.51 -0.19 0.00 -0.73 0.00 0.00 179.01 177.70 1p45 n ALA 81 N -2.38 2.80 0.01 2.92 0.00 -0.44 -3.71 120.51 119.72 1p45 n ALA 81 Ca 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 53.44 53.38 1p45 n ALA 81 Cb 0.27 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.43 0.62 -0.37 0.00 -6.64 -0.70 -4.97 119.36 105.87 1p45 n ILE 82 Ca 0.07 -0.81 0.00 0.00 -1.77 0.00 0.00 62.75 60.24 1p45 n ILE 82 Cb 0.33 0.70 0.00 0.00 -1.44 0.00 0.00 39.64 39.23 1p45 n ILE 82 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1p45 n GLY 83 N -0.15 -1.58 0.70 3.28 0.00 0.60 -4.79 105.19 103.25 1p45 n GLY 83 Ca 0.02 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 1p45 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p45 n ALA 84 N 1.21 -1.47 -3.56 4.61 0.00 -1.23 -2.08 120.51 118.00 1p45 n ALA 84 Ca 0.00 0.07 -0.26 0.00 0.00 0.00 0.00 53.44 53.25 1p45 n ALA 84 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 1p45 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p45 n GLY 85 N 0.43 -0.47 2.82 0.00 0.00 -1.26 -4.95 105.19 101.76 1p45 n GLY 85 Ca 0.03 0.10 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.83 0.02 0.43 1.61 -0.87 -0.88 -5.18 114.94 107.24 1p45 s ASN 86 Ca 0.48 0.06 0.03 0.00 -1.57 0.00 0.00 52.86 51.86 1p45 s ASN 86 Cb -0.26 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.25 40.94 1p45 s ASN 86 CO 0.59 -0.09 0.08 -0.54 -2.57 0.00 0.00 177.10 174.57 1p45 s LYS 87 N 0.74 1.99 -0.22 -0.60 1.02 -1.26 -4.78 119.74 116.63 1p45 s LYS 87 Ca -0.06 -2.22 -0.10 0.00 0.02 0.00 0.00 55.97 53.61 1p45 s LYS 87 Cb -0.09 -0.94 -0.05 0.00 -0.52 0.00 0.00 37.83 36.23 1p45 s LYS 87 CO -0.02 -0.41 0.15 -0.51 -0.92 0.00 0.00 175.35 173.64 1p45 s LEU 88 N -3.68 4.17 0.21 3.17 1.43 0.77 -4.75 118.68 119.99 1p45 s LEU 88 Ca 0.20 0.18 0.23 0.00 -1.03 0.00 0.00 54.13 53.70 1p45 s LEU 88 Cb 0.03 -2.10 0.04 0.00 0.03 0.00 0.00 46.19 44.19 1p45 s LEU 88 CO 0.11 0.12 1.10 0.44 0.23 0.00 0.00 176.35 178.35 1p45 h ASP 89 N 7.07 0.00 -5.02 2.29 3.32 -1.26 -3.10 116.42 119.73 1p45 h ASP 89 Ca -0.40 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.47 1p45 h ASP 89 Cb 1.16 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.51 1p45 h ASP 89 CO 0.71 0.01 -0.68 -0.83 -1.72 0.00 0.00 179.24 176.73 1p45 s GLY 90 N -4.29 0.25 -0.05 2.75 0.00 -0.61 -1.41 107.32 103.96 1p45 s GLY 90 Ca 0.00 -0.64 -0.03 0.00 0.00 0.00 0.00 44.72 44.06 1p45 s GLY 90 CO 0.78 -0.72 0.11 0.14 0.00 0.00 0.00 173.10 173.41 1p45 s VAL 91 N -1.82 -0.03 -0.18 1.40 1.01 -0.81 -1.40 120.40 118.57 1p45 s VAL 91 Ca -0.13 0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1p45 s VAL 91 Cb -0.07 -0.18 0.04 0.00 0.00 0.00 0.00 36.38 36.17 1p45 s VAL 91 CO -0.02 0.05 -0.10 -0.69 0.00 0.00 0.00 175.10 174.33 1p45 s VAL 92 N 0.72 1.52 -0.37 2.92 1.01 -0.72 -0.52 120.40 124.96 1p45 s VAL 92 Ca -0.06 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 60.95 1p45 s VAL 92 Cb -0.07 -1.57 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 1p45 s VAL 92 CO -0.03 0.24 0.29 -2.28 0.00 0.00 0.00 175.10 173.31 1p45 s HIS 93 N 1.46 3.23 -0.59 5.22 5.04 -0.83 -1.35 115.29 127.48 1p45 s HIS 93 Ca 0.01 -0.34 0.06 0.00 -1.54 0.00 0.00 55.06 53.24 1p45 s HIS 93 Cb -0.15 -2.56 0.31 0.00 0.04 0.00 0.00 32.58 30.22 1p45 s HIS 93 CO -0.09 -0.47 0.87 0.45 -2.34 0.00 0.00 174.74 173.16 1p45 n SER 94 N 5.18 4.06 -4.25 9.88 2.88 -1.26 -2.37 113.62 127.74 1p45 n SER 94 Ca -0.11 -3.57 -0.25 0.00 -1.33 0.00 0.00 58.87 53.61 1p45 n SER 94 Cb 0.49 -0.60 -0.14 0.00 -0.75 0.00 0.00 64.21 63.21 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 -3.70 1.64 0.00 2.46 1.01 -1.26 -4.11 121.20 117.24 1p45 s ILE 95 Ca 0.45 -1.23 0.00 0.00 0.00 0.00 0.00 60.65 59.87 1p45 s ILE 95 Cb 0.24 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1p45 s ILE 95 CO -0.09 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.62 1p45 n GLY 96 N 1.76 1.40 3.60 6.18 0.00 -1.26 -4.65 105.19 112.22 1p45 n GLY 96 Ca -0.18 0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 1p45 n GLY 96 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p45 s PHE 97 N -0.72 -0.74 -0.16 1.61 5.36 -1.26 -4.95 117.98 117.13 1p45 s PHE 97 Ca 0.00 1.68 -0.05 0.00 -0.96 0.00 0.00 56.93 57.60 1p45 s PHE 97 Cb 0.00 0.31 0.08 0.00 -0.34 0.00 0.00 43.02 43.07 1p45 s PHE 97 CO 0.00 -0.44 0.29 1.41 -1.46 0.00 0.00 175.22 175.02 1p45 s MET 98 N -0.07 0.19 0.89 10.12 -2.45 -1.26 -4.07 119.30 122.64 1p45 s MET 98 Ca -0.03 0.71 -0.15 0.00 -1.25 0.00 0.00 55.69 54.97 1p45 s MET 98 Cb -0.04 -0.15 -0.04 0.00 1.25 0.00 0.00 34.83 35.86 1p45 s MET 98 CO 0.03 -0.35 0.11 -2.30 1.05 0.00 0.00 175.02 173.56 1p45 n PRO 99 N 5.35 -0.06 0.23 4.11 -0.02 -1.26 -4.69 135.00 138.66 1p45 n PRO 99 Ca -0.06 0.01 0.15 0.00 -2.02 0.00 0.00 63.50 61.58 1p45 n PRO 99 Cb 0.50 -1.59 0.46 0.00 -0.02 0.00 0.00 33.50 32.84 1p45 n PRO 99 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1p45 h GLN 100 N -1.06 0.00 -0.47 -0.52 1.08 -1.99 0.11 115.11 112.25 1p45 h GLN 100 Ca -0.44 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 56.90 1p45 h GLN 100 Cb 1.31 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.72 1p45 h GLN 100 CO 0.34 0.00 0.37 1.15 -0.95 0.00 0.00 178.83 179.74 1p45 h THR 101 N 0.00 0.66 -0.00 -0.54 2.02 -1.98 -2.45 112.91 110.61 1p45 h THR 101 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1p45 h THR 101 Cb 0.69 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1p45 h THR 101 CO 0.00 0.00 -0.06 0.61 0.37 0.00 0.00 175.52 176.44 1p45 n GLY 102 N -1.60 -1.11 3.43 2.16 0.00 0.37 -4.33 105.19 104.11 1p45 n GLY 102 Ca 0.08 -0.21 -0.17 0.00 0.00 0.00 0.00 46.02 45.73 1p45 n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1p45 s MET 103 N -2.50 1.91 3.55 1.61 1.00 -0.92 -2.40 119.30 121.53 1p45 s MET 103 Ca 0.29 -1.88 0.00 0.00 0.00 0.00 0.00 55.69 54.10 1p45 s MET 103 Cb 0.20 0.41 0.00 0.00 0.00 0.00 0.00 34.83 35.44 1p45 s MET 103 CO 0.47 -0.77 0.00 0.41 0.00 0.00 0.00 175.02 175.13 1p45 n GLY 104 N -0.61 3.05 0.14 -0.03 0.00 -0.82 -3.13 105.19 103.79 1p45 n GLY 104 Ca 0.03 0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1p45 n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1p45 h ILE 105 N 0.00 0.06 -1.62 -0.61 2.04 -1.91 -3.37 117.51 112.11 1p45 h ILE 105 Ca 0.00 -1.11 -0.71 0.00 1.00 0.00 0.00 64.86 64.04 1p45 h ILE 105 Cb 0.00 1.67 0.04 0.00 -0.74 0.00 0.00 36.82 37.78 1p45 h ILE 105 CO 0.00 0.03 0.67 0.59 0.00 0.00 0.00 178.15 179.44 1p45 n ASN 106 N -2.80 2.00 -4.65 1.72 4.13 -1.18 -4.83 115.26 109.65 1p45 n ASN 106 Ca 0.00 1.10 -0.47 0.00 1.68 0.00 0.00 54.58 56.89 1p45 n ASN 106 Cb 0.57 -1.17 -0.04 0.00 -1.54 0.00 0.00 39.78 37.60 1p45 n ASN 106 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1p45 n PRO 107 N 3.89 1.87 -0.16 3.52 -0.02 -1.26 -4.76 135.00 138.09 1p45 n PRO 107 Ca 0.22 0.67 -0.03 0.00 -2.02 0.00 0.00 63.50 62.34 1p45 n PRO 107 Cb 0.16 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.30 1p45 n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p45 h PHE 108 N 5.13 -0.33 0.00 6.00 3.57 -1.90 -2.39 116.94 127.02 1p45 h PHE 108 Ca -0.45 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.09 1p45 h PHE 108 Cb 1.28 0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.24 1p45 h PHE 108 CO 0.60 -0.24 0.00 1.19 -2.23 0.00 0.00 178.31 177.63 1p45 n PHE 109 N -5.38 0.00 0.24 0.41 3.72 -1.26 -3.42 117.46 111.77 1p45 n PHE 109 Ca 0.05 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.56 1p45 n PHE 109 Cb 0.28 -0.47 0.25 0.00 -0.94 0.00 0.00 39.48 38.60 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 -1.47 3.45 -4.68 4.37 8.00 -0.90 -4.89 116.55 120.43 1p45 n ASP 110 Ca 0.04 -1.98 -0.42 0.00 0.71 0.00 0.00 54.79 53.13 1p45 n ASP 110 Cb 0.15 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 40.94 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 -1.42 3.51 0.31 2.24 0.00 -1.22 -5.00 121.76 120.18 1p45 s ALA 111 Ca 0.40 0.49 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 1p45 s ALA 111 Cb 0.23 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.74 1p45 s ALA 111 CO 0.32 -0.80 1.25 -2.14 0.00 0.00 0.00 175.76 174.39 1p45 s PRO 112 N 2.41 4.43 0.41 0.00 0.02 -1.26 -4.85 135.00 136.16 1p45 s PRO 112 Ca 0.53 2.10 0.25 0.00 0.02 0.00 0.00 61.00 63.89 1p45 s PRO 112 Cb -0.22 -3.11 1.31 0.00 0.02 0.00 0.00 34.50 32.50 1p45 s PRO 112 CO 0.18 -0.08 1.65 -0.92 -0.33 0.00 0.00 177.00 177.50 1p45 h TYR 113 N 3.56 0.65 0.00 6.54 3.20 -1.98 -0.65 116.97 128.29 1p45 h TYR 113 Ca -0.48 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.41 1p45 h TYR 113 Cb 1.22 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.33 1p45 h TYR 113 CO 0.57 -0.19 -0.03 0.00 -1.64 0.00 0.00 178.16 176.87 1p45 h ALA 114 N 1.69 1.01 0.07 1.82 0.00 -1.99 0.26 119.26 122.11 1p45 h ALA 114 Ca 0.77 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.65 1p45 h ALA 114 Cb 2.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.00 1p45 h ALA 114 CO -0.47 0.04 -0.03 -0.44 0.00 0.00 0.00 179.25 178.35 1p45 h ASP 115 N 0.00 -0.07 -0.57 0.00 5.19 -1.48 -3.13 116.42 116.35 1p45 h ASP 115 Ca -0.00 -0.55 0.11 0.00 -0.62 0.00 0.00 57.03 55.97 1p45 h ASP 115 Cb 0.56 0.02 -0.09 0.00 0.18 0.00 0.00 39.33 40.00 1p45 h ASP 115 CO 0.00 0.60 0.03 0.58 -3.12 0.00 0.00 179.24 177.34 1p45 h VAL 116 N -0.85 0.57 -0.43 -1.35 2.07 -1.33 -1.45 116.25 113.48 1p45 h VAL 116 Ca -0.01 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1p45 h VAL 116 Cb 0.62 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1p45 h VAL 116 CO 0.01 0.03 0.28 -1.28 0.02 0.00 0.00 177.57 176.64 1p45 h SER 117 N 0.15 0.43 -0.21 0.57 0.87 -0.63 -1.39 113.55 113.35 1p45 h SER 117 Ca 0.30 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.78 1p45 h SER 117 Cb 0.46 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1p45 h SER 117 CO -0.46 0.31 -0.14 0.50 -0.53 0.00 0.00 176.83 176.51 1p45 h LYS 118 N 0.51 0.46 -0.04 2.24 3.64 -1.29 -0.82 116.57 121.26 1p45 h LYS 118 Ca 0.17 -0.22 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1p45 h LYS 118 Cb 0.05 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1p45 h LYS 118 CO -0.04 0.77 -0.31 0.78 -2.27 0.00 0.00 179.45 178.38 1p45 h GLY 119 N 0.15 0.09 1.31 5.01 0.00 -0.75 -1.38 103.07 107.48 1p45 h GLY 119 Ca 0.04 -0.07 -0.26 0.00 0.00 0.00 0.00 47.33 47.05 1p45 h GLY 119 CO 0.04 0.06 -1.02 -2.22 0.00 0.00 0.00 176.54 173.40 1p45 h ILE 120 N 0.07 1.31 -0.45 2.60 2.04 -1.26 -0.42 117.51 121.40 1p45 h ILE 120 Ca 0.01 -2.31 0.09 0.00 1.00 0.00 0.00 64.86 63.65 1p45 h ILE 120 Cb 0.58 2.40 -0.09 0.00 -0.74 0.00 0.00 36.82 38.97 1p45 h ILE 120 CO 0.04 0.71 -0.18 -0.74 0.00 0.00 0.00 178.15 177.98 1p45 h HIS 121 N 0.35 -0.43 0.14 1.37 2.76 -0.37 -0.50 115.15 118.47 1p45 h HIS 121 Ca -0.12 0.05 -0.36 0.00 -2.20 0.00 0.00 60.37 57.74 1p45 h HIS 121 Cb 1.67 0.26 -0.01 0.00 1.55 0.00 0.00 27.41 30.88 1p45 h HIS 121 CO 0.09 -0.26 -1.93 0.82 -1.30 0.00 0.00 177.93 175.35 1p45 h ILE 122 N -0.08 0.70 0.08 6.26 2.04 -1.15 -0.71 117.51 124.65 1p45 h ILE 122 Ca 0.22 -2.37 -0.26 0.00 1.00 0.00 0.00 64.86 63.45 1p45 h ILE 122 Cb 0.42 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 1p45 h ILE 122 CO -0.51 0.89 -1.20 0.28 0.00 0.00 0.00 178.15 177.61 1p45 h SER 123 N 0.06 0.27 0.00 1.72 0.02 -1.16 -3.39 113.55 111.08 1p45 h SER 123 Ca -0.41 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.24 1p45 h SER 123 Cb 2.04 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 64.49 1p45 h SER 123 CO 0.10 1.24 -0.47 0.00 -1.14 0.00 0.00 176.83 176.57 1p45 n ALA 124 N -2.49 2.97 -0.33 3.77 0.00 -0.39 -4.72 120.51 119.33 1p45 n ALA 124 Ca -0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.34 1p45 n ALA 124 Cb 1.00 0.36 0.13 0.00 0.00 0.00 0.00 19.45 20.94 1p45 n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1p45 h TYR 125 N -0.02 1.19 -1.18 0.00 5.03 -1.08 -2.82 116.97 118.09 1p45 h TYR 125 Ca -0.00 0.00 0.34 0.00 2.58 0.00 0.00 58.73 61.65 1p45 h TYR 125 Cb 0.46 -0.39 -0.05 0.00 1.55 0.00 0.00 36.73 38.29 1p45 h TYR 125 CO -0.00 0.78 0.84 0.66 -1.32 0.00 0.00 178.16 179.12 1p45 h SER 126 N 1.25 0.04 -0.40 -2.11 4.64 -1.31 -0.14 113.55 115.52 1p45 h SER 126 Ca 0.33 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.59 1p45 h SER 126 Cb -0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1p45 h SER 126 CO -0.06 0.01 0.01 0.22 -0.87 0.00 0.00 176.83 176.13 1p45 h TYR 127 N 0.04 0.83 0.35 4.77 3.20 -1.78 -0.40 116.97 123.97 1p45 h TYR 127 Ca 0.57 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 62.31 1p45 h TYR 127 Cb 2.21 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 40.26 1p45 h TYR 127 CO -0.00 0.77 -0.17 0.00 -1.64 0.00 0.00 178.16 177.12 1p45 h ALA 128 N 1.27 -0.46 -0.71 1.82 0.00 -1.19 -2.38 119.26 117.61 1p45 h ALA 128 Ca 0.14 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.08 1p45 h ALA 128 Cb 0.44 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.30 1p45 h ALA 128 CO 0.02 -0.44 0.18 0.66 0.00 0.00 0.00 179.25 179.66 1p45 h SER 129 N -1.10 0.03 -0.70 0.00 4.64 -1.52 0.89 113.55 115.80 1p45 h SER 129 Ca -0.05 0.14 0.05 0.00 -0.47 0.00 0.00 61.79 61.46 1p45 h SER 129 Cb 0.40 0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 1p45 h SER 129 CO 0.08 -0.01 0.46 -0.03 -0.87 0.00 0.00 176.83 176.46 1p45 h MET 130 N 0.28 0.74 -0.42 4.77 -1.53 -1.19 -2.72 114.93 114.86 1p45 h MET 130 Ca 0.39 -0.04 -0.14 0.00 -3.44 0.00 0.00 59.70 56.47 1p45 h MET 130 Cb 0.65 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 31.52 1p45 h MET 130 CO -0.48 0.49 -0.29 0.00 0.14 0.00 0.00 176.91 176.78 1p45 h ALA 131 N 1.61 0.60 -0.55 0.39 0.00 0.11 -2.33 119.26 119.09 1p45 h ALA 131 Ca 0.30 -0.42 0.11 0.00 0.00 0.00 0.00 54.91 54.90 1p45 h ALA 131 Cb 0.20 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 1p45 h ALA 131 CO -0.09 0.63 0.03 -0.22 0.00 0.00 0.00 179.25 179.60 1p45 h LYS 132 N 0.76 0.15 -0.00 0.00 3.64 -0.05 -0.90 116.57 120.17 1p45 h LYS 132 Ca 0.08 -0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 59.24 1p45 h LYS 132 Cb 0.87 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1p45 h LYS 132 CO 0.08 0.10 -0.92 0.00 -2.27 0.00 0.00 179.45 176.44 1p45 h ALA 133 N 1.48 0.41 -0.01 5.00 0.00 -1.56 -3.34 119.26 121.24 1p45 h ALA 133 Ca 0.28 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1p45 h ALA 133 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1p45 h ALA 133 CO -0.44 0.84 -0.52 1.28 0.00 0.00 0.00 179.25 180.41 1p45 n LEU 134 N -3.73 1.70 0.02 0.00 4.77 -0.88 -4.38 117.00 114.51 1p45 n LEU 134 Ca -0.06 -0.63 -0.19 0.00 -0.03 0.00 0.00 56.01 55.11 1p45 n LEU 134 Cb 0.82 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.78 1p45 n LEU 134 CO 0.50 0.33 0.17 -0.07 -1.33 0.00 0.00 177.39 176.99 1p45 h LEU 135 N 1.85 0.70 -1.74 2.23 -0.00 -1.29 -2.98 115.31 114.09 1p45 h LEU 135 Ca 0.00 -0.75 0.36 0.00 -0.00 0.00 0.00 57.88 57.48 1p45 h LEU 135 Cb 0.68 -0.22 -0.08 0.00 -0.00 0.00 0.00 40.66 41.05 1p45 h LEU 135 CO 0.00 1.37 0.86 -0.65 -0.00 0.00 0.00 178.44 180.01 1p45 h PRO 136 N 0.12 0.12 -0.52 1.13 0.11 -1.76 -1.25 132.00 129.94 1p45 h PRO 136 Ca -0.10 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.96 1p45 h PRO 136 Cb 1.49 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.55 1p45 h PRO 136 CO 0.16 0.08 0.05 0.44 -0.21 0.00 0.00 178.00 178.51 1p45 n ILE 137 N -4.35 2.68 -3.40 4.15 -5.35 -1.14 -4.96 119.36 106.99 1p45 n ILE 137 Ca 0.29 -1.61 -0.19 0.00 -0.27 0.00 0.00 62.75 60.97 1p45 n ILE 137 Cb 1.24 -0.29 -0.01 0.00 -1.74 0.00 0.00 39.64 38.84 1p45 n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 1p45 s MET 138 N -2.85 2.85 0.03 6.28 -1.94 -0.47 -0.16 119.30 123.03 1p45 s MET 138 Ca 0.51 -1.23 0.06 0.00 -1.71 0.00 0.00 55.69 53.32 1p45 s MET 138 Cb 0.40 -2.66 -0.02 0.00 2.01 0.00 0.00 34.83 34.56 1p45 s MET 138 CO 0.13 -0.09 -0.16 1.21 -0.01 0.00 0.00 175.02 176.10 1p45 s ASN 139 N -4.19 1.92 0.59 3.03 3.04 -1.17 -4.89 114.94 113.28 1p45 s ASN 139 Ca 0.48 -0.44 -0.19 0.00 0.04 0.00 0.00 52.86 52.75 1p45 s ASN 139 Cb -0.08 -0.15 -0.03 0.00 -1.54 0.00 0.00 41.25 39.45 1p45 s ASN 139 CO 0.30 0.10 1.25 -2.84 -3.04 0.00 0.00 177.10 172.87 1p45 s PRO 140 N -1.00 2.92 -0.35 0.43 0.02 -1.25 -2.25 135.00 133.52 1p45 s PRO 140 Ca 0.04 1.94 0.00 0.00 0.02 0.00 0.00 61.00 63.00 1p45 s PRO 140 Cb -0.08 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.47 1p45 s PRO 140 CO 0.01 -1.28 0.00 0.41 -0.33 0.00 0.00 177.00 175.81 1p45 n GLY 141 N 0.64 0.59 3.94 0.52 0.00 0.26 -5.00 105.19 106.15 1p45 n GLY 141 Ca 0.14 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1p45 n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p45 s GLY 142 N -2.37 1.73 -0.07 -0.02 0.00 -0.95 -4.88 107.32 100.76 1p45 s GLY 142 Ca 0.00 -1.17 -0.03 0.00 0.00 0.00 0.00 44.72 43.53 1p45 s GLY 142 CO 0.00 -0.59 0.12 -0.45 0.00 0.00 0.00 173.10 172.19 1p45 s SER 143 N -4.70 0.89 -0.16 1.64 0.15 -0.50 -2.61 113.70 108.41 1p45 s SER 143 Ca 0.67 0.24 -0.08 0.00 0.70 0.00 0.00 55.95 57.48 1p45 s SER 143 Cb -0.07 0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 64.31 1p45 s SER 143 CO 0.48 -0.25 0.11 -0.63 1.20 0.00 0.00 173.24 174.16 1p45 s ILE 144 N 2.24 5.28 -0.02 6.45 1.01 -0.06 -1.92 121.20 134.18 1p45 s ILE 144 Ca 0.04 0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.83 1p45 s ILE 144 Cb -0.12 -3.35 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1p45 s ILE 144 CO -0.05 0.52 -0.02 0.54 0.00 0.00 0.00 174.94 175.94 1p45 s VAL 145 N -0.25 0.22 0.40 2.92 0.11 0.33 -1.72 120.40 122.41 1p45 s VAL 145 Ca 0.10 -0.02 0.08 0.00 -2.93 0.00 0.00 61.98 59.21 1p45 s VAL 145 Cb -0.12 -0.26 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 1p45 s VAL 145 CO 0.01 0.12 0.16 -0.83 -3.33 0.00 0.00 175.10 171.23 1p45 s GLY 146 N 0.55 2.28 -0.16 6.54 0.00 -0.60 -1.96 107.32 113.96 1p45 s GLY 146 Ca -0.05 -2.08 -0.10 0.00 0.00 0.00 0.00 44.72 42.48 1p45 s GLY 146 CO -0.01 -1.90 0.18 1.06 0.00 0.00 0.00 173.10 172.43 1p45 s MET 147 N -3.88 4.01 0.19 2.90 -1.94 -1.00 -1.81 119.30 117.77 1p45 s MET 147 Ca 0.40 -0.10 0.07 0.00 -1.71 0.00 0.00 55.69 54.36 1p45 s MET 147 Cb 0.03 -3.36 -0.05 0.00 2.01 0.00 0.00 34.83 33.47 1p45 s MET 147 CO 0.22 0.42 -0.14 0.34 -0.01 0.00 0.00 175.02 175.85 1p45 s ASP 148 N -0.01 2.42 -0.06 3.03 2.15 0.11 -4.87 116.67 119.43 1p45 s ASP 148 Ca 0.12 -0.99 0.03 0.00 0.43 0.00 0.00 52.55 52.14 1p45 s ASP 148 Cb -0.12 -0.11 0.01 0.00 -0.30 0.00 0.00 42.92 42.40 1p45 s ASP 148 CO 0.01 -0.18 -0.13 0.12 -0.17 0.00 0.00 175.17 174.83 1p45 s PHE 149 N -2.86 1.51 -0.43 -5.34 5.99 -1.26 -1.58 117.98 114.01 1p45 s PHE 149 Ca 0.20 -0.55 -0.27 0.00 0.00 0.00 0.00 56.93 56.31 1p45 s PHE 149 Cb -0.01 -1.09 -0.07 0.00 0.00 0.00 0.00 43.02 41.84 1p45 s PHE 149 CO 0.06 -0.27 2.37 -3.47 -0.00 0.00 0.00 175.22 173.90 1p45 n ASP 150 N 3.72 2.49 -0.64 6.13 2.03 -1.26 -4.76 116.55 124.26 1p45 n ASP 150 Ca -0.22 -0.24 0.10 0.00 0.52 0.00 0.00 54.79 54.96 1p45 n ASP 150 Cb 0.52 -1.53 0.34 0.00 -0.72 0.00 0.00 41.12 39.72 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 8.88 1.83 -0.04 -0.67 -0.04 -1.26 -4.26 135.00 139.45 1p45 n PRO 151 Ca 0.37 -1.26 0.08 0.00 -0.04 0.00 0.00 63.50 62.64 1p45 n PRO 151 Cb 0.48 -1.40 0.37 0.00 -0.04 0.00 0.00 33.50 32.91 1p45 n PRO 151 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1p45 n SER 152 N 0.49 0.59 -3.55 3.54 3.41 -1.26 -4.74 113.62 112.10 1p45 n SER 152 Ca 0.16 -1.65 -0.11 0.00 -0.26 0.00 0.00 58.87 57.01 1p45 n SER 152 Cb 0.36 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 1p45 n SER 152 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p45 s ARG 153 N -1.90 1.35 0.80 4.33 1.70 -1.26 -5.15 118.95 118.81 1p45 s ARG 153 Ca 0.24 -0.62 -0.11 0.00 -0.47 0.00 0.00 55.73 54.77 1p45 s ARG 153 Cb 0.12 0.57 0.07 0.00 -0.57 0.00 0.00 34.95 35.14 1p45 s ARG 153 CO 0.18 -0.59 1.09 0.00 -1.08 0.00 0.00 175.30 174.90 1p45 s ALA 154 N -3.80 2.13 0.04 7.88 0.00 -1.26 -5.02 121.76 121.73 1p45 s ALA 154 Ca 0.04 0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 1p45 s ALA 154 Cb -0.01 -3.23 0.09 0.00 0.00 0.00 0.00 23.12 19.96 1p45 s ALA 154 CO -0.09 -1.85 0.76 0.00 0.00 0.00 0.00 175.76 174.59 1p45 s MET 155 N -4.94 1.00 0.66 0.00 0.23 -1.26 -5.15 119.30 109.84 1p45 s MET 155 Ca 0.61 -0.28 -0.18 0.00 -1.03 0.00 0.00 55.69 54.82 1p45 s MET 155 Cb -0.17 0.46 -0.01 0.00 -1.53 0.00 0.00 34.83 33.59 1p45 s MET 155 CO 0.56 -0.42 1.21 -2.30 -2.03 0.00 0.00 175.02 172.04 1p45 n PRO 156 N -0.11 0.97 0.00 3.16 -0.02 -1.26 -4.27 135.00 133.48 1p45 n PRO 156 Ca -0.13 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1p45 n PRO 156 Cb 0.62 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1p45 n PRO 156 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p45 n ALA 157 N -2.02 0.00 -0.26 3.55 0.00 -1.26 -4.58 120.51 115.95 1p45 n ALA 157 Ca 0.15 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.74 1p45 n ALA 157 Cb 0.48 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.36 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 0.72 0.00 0.00 3.20 -1.88 -2.19 116.97 116.82 1p45 h TYR 158 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1p45 h TYR 158 Cb 0.00 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1p45 h TYR 158 CO 0.00 0.23 0.00 0.09 -1.64 0.00 0.00 178.16 176.84 1p45 n ASN 159 N -4.56 0.00 -0.67 -2.11 4.13 -1.26 -0.51 115.26 110.29 1p45 n ASN 159 Ca 0.18 0.00 0.13 0.00 1.68 0.00 0.00 54.58 56.57 1p45 n ASN 159 Cb 0.56 0.00 0.27 0.00 -1.54 0.00 0.00 39.78 39.07 1p45 n ASN 159 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1p45 n TRP 160 N 0.00 0.00 0.15 3.10 7.02 -1.01 -3.05 117.44 123.65 1p45 n TRP 160 Ca 0.00 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.51 1p45 n TRP 160 Cb 0.00 -0.01 0.12 0.00 -2.42 0.00 0.00 31.31 29.00 1p45 n TRP 160 CO 0.00 0.00 0.00 1.98 -2.02 0.00 0.00 177.69 177.65 1p45 h MET 161 N 3.26 0.00 -0.41 -0.99 4.05 -1.00 -2.97 114.93 116.88 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 0.74 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.52 1p45 h MET 161 CO 0.00 0.50 0.18 1.15 0.23 0.00 0.00 176.91 178.97 1p45 h THR 162 N 0.00 1.18 -0.12 -0.77 2.02 -1.59 0.29 112.91 113.93 1p45 h THR 162 Ca -0.01 -0.54 -0.12 0.00 0.77 0.00 0.00 66.41 66.52 1p45 h THR 162 Cb 1.25 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1p45 h THR 162 CO 0.07 0.20 -0.46 0.58 0.37 0.00 0.00 175.52 176.28 1p45 h VAL 163 N 0.52 1.33 0.19 3.16 2.07 -1.66 0.20 116.25 122.05 1p45 h VAL 163 Ca 0.14 -1.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 1p45 h VAL 163 Cb 0.14 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1p45 h VAL 163 CO -0.02 0.49 -0.09 0.00 0.02 0.00 0.00 177.57 177.98 1p45 h ALA 164 N 1.29 -0.25 -0.95 1.67 0.00 -1.26 -1.56 119.26 118.21 1p45 h ALA 164 Ca 0.02 -0.21 0.19 0.00 0.00 0.00 0.00 54.91 54.91 1p45 h ALA 164 Cb 0.90 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.68 1p45 h ALA 164 CO 0.07 -0.40 0.53 0.87 0.00 0.00 0.00 179.25 180.32 1p45 h LYS 165 N -0.73 0.62 -0.98 0.00 1.79 0.31 0.75 116.57 118.34 1p45 h LYS 165 Ca -0.03 -0.04 0.12 0.00 -2.18 0.00 0.00 60.65 58.52 1p45 h LYS 165 Cb 0.50 -0.14 -0.08 0.00 -1.58 0.00 0.00 32.23 30.93 1p45 h LYS 165 CO 0.04 0.41 0.62 0.77 -1.08 0.00 0.00 179.45 180.21 1p45 h SER 166 N 0.64 0.88 0.04 0.86 0.02 -0.52 0.64 113.55 116.12 1p45 h SER 166 Ca 0.56 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 61.42 1p45 h SER 166 Cb 0.91 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 1p45 h SER 166 CO -0.41 0.48 -0.40 0.00 -1.14 0.00 0.00 176.83 175.36 1p45 h ALA 167 N 1.54 0.94 -0.16 3.77 0.00 0.14 -2.94 119.26 122.56 1p45 h ALA 167 Ca 0.48 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1p45 h ALA 167 Cb 0.49 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1p45 h ALA 167 CO -0.24 0.62 -0.10 1.25 0.00 0.00 0.00 179.25 180.78 1p45 h LEU 168 N 0.38 0.36 -1.29 0.00 6.46 0.16 -0.15 115.31 121.24 1p45 h LEU 168 Ca 0.04 -0.44 0.21 0.00 -0.12 0.00 0.00 57.88 57.57 1p45 h LEU 168 Cb 0.86 -0.10 -0.09 0.00 -0.73 0.00 0.00 40.66 40.61 1p45 h LEU 168 CO 0.07 0.72 0.62 -0.33 -0.62 0.00 0.00 178.44 178.90 1p45 h GLU 169 N 0.00 0.53 0.12 1.25 5.08 -1.03 0.36 114.58 120.88 1p45 h GLU 169 Ca 0.03 -0.03 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 1p45 h GLU 169 Cb 0.59 -0.12 0.03 0.00 0.50 0.00 0.00 28.75 29.76 1p45 h GLU 169 CO 0.03 0.35 -1.22 1.03 -1.00 0.00 0.00 179.01 178.19 1p45 h SER 170 N 0.54 0.87 -0.79 1.42 0.87 -1.27 -2.69 113.55 112.50 1p45 h SER 170 Ca 0.53 -0.82 0.04 0.00 -1.23 0.00 0.00 61.79 60.32 1p45 h SER 170 Cb 1.13 -0.27 -0.05 0.00 -0.44 0.00 0.00 62.40 62.76 1p45 h SER 170 CO -0.27 1.61 0.49 0.58 -0.53 0.00 0.00 176.83 178.71 1p45 h VAL 171 N 0.26 1.07 0.00 2.23 2.07 0.87 -2.52 116.25 120.22 1p45 h VAL 171 Ca -0.19 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1p45 h VAL 171 Cb 1.90 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1p45 h VAL 171 CO 0.24 0.17 -0.09 -1.13 0.02 0.00 0.00 177.57 176.78 1p45 h ASN 172 N 0.93 0.00 0.04 0.57 -1.24 -0.04 -1.87 115.58 113.99 1p45 h ASN 172 Ca 0.33 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.34 1p45 h ASN 172 Cb 0.09 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.14 1p45 h ASN 172 CO -0.14 0.09 -0.02 0.03 -1.29 0.00 0.00 177.43 176.09 1p45 h ARG 173 N 0.00 -0.06 -0.93 6.67 3.08 -1.42 -2.17 114.38 119.55 1p45 h ARG 173 Ca -0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 1p45 h ARG 173 Cb 0.21 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.20 1p45 h ARG 173 CO 0.01 0.44 0.57 0.74 -1.07 0.00 0.00 179.97 180.66 1p45 h PHE 174 N -0.58 1.04 -0.77 3.04 -1.00 -1.36 -0.65 116.94 116.66 1p45 h PHE 174 Ca -0.01 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 1p45 h PHE 174 Cb 0.52 -0.33 -0.04 0.00 3.61 0.00 0.00 35.95 39.71 1p45 h PHE 174 CO 0.10 0.45 0.38 0.28 -1.61 0.00 0.00 178.31 177.91 1p45 h VAL 175 N 0.96 1.24 0.05 -0.55 2.07 -1.30 0.27 116.25 118.97 1p45 h VAL 175 Ca 0.44 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1p45 h VAL 175 Cb 0.36 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1p45 h VAL 175 CO -0.23 0.28 -0.02 0.00 0.02 0.00 0.00 177.57 177.61 1p45 h ALA 176 N 1.33 -0.06 -0.77 1.67 0.00 -0.66 0.25 119.26 121.01 1p45 h ALA 176 Ca 0.27 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.34 1p45 h ALA 176 Cb 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1p45 h ALA 176 CO -0.04 -0.53 0.52 -0.09 0.00 0.00 0.00 179.25 179.12 1p45 h ARG 177 N -0.06 0.30 0.02 0.00 2.43 -0.21 -0.82 114.38 116.03 1p45 h ARG 177 Ca -0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1p45 h ARG 177 Cb 0.05 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1p45 h ARG 177 CO 0.01 0.20 -0.01 0.93 -1.51 0.00 0.00 179.97 179.59 1p45 h GLU 178 N 0.31 -0.02 -0.08 0.20 4.39 0.67 -3.34 114.58 116.71 1p45 h GLU 178 Ca 0.38 0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.11 1p45 h GLU 178 Cb 1.04 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1p45 h GLU 178 CO -0.11 0.45 0.37 0.00 -1.16 0.00 0.00 179.01 178.56 1p45 h ALA 179 N -0.51 1.50 0.00 3.43 0.00 -0.32 -2.29 119.26 121.07 1p45 h ALA 179 Ca -0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1p45 h ALA 179 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1p45 h ALA 179 CO 0.00 -0.41 -0.24 0.78 0.00 0.00 0.00 179.25 179.38 1p45 h GLY 180 N 0.00 0.00 0.27 0.00 0.00 -1.05 -0.84 103.07 101.45 1p45 h GLY 180 Ca 0.04 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.57 1p45 h GLY 180 CO -0.00 0.00 0.60 0.50 0.00 0.00 0.00 176.54 177.64 1p45 h LYS 181 N 0.00 0.47 -0.64 4.80 1.57 -1.60 -2.54 116.57 118.63 1p45 h LYS 181 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1p45 h LYS 181 Cb 0.90 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1p45 h LYS 181 CO 0.03 0.31 0.00 0.66 -0.57 0.00 0.00 179.45 179.88 1p45 n TYR 182 N -4.55 1.11 -2.41 -1.35 4.02 -1.00 -4.92 117.16 108.05 1p45 n TYR 182 Ca 0.20 -0.56 -0.11 0.00 -0.01 0.00 0.00 57.90 57.42 1p45 n TYR 182 Cb 0.67 -0.11 0.01 0.00 -0.02 0.00 0.00 39.34 39.89 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 1.24 -0.03 3.19 2.72 0.00 -0.96 -3.80 105.19 107.55 1p45 n GLY 183 Ca 0.23 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.70 2.57 0.16 1.61 1.01 -0.35 0.93 120.40 123.62 1p45 s VAL 184 Ca 0.07 -0.80 -0.32 0.00 0.00 0.00 0.00 61.98 60.94 1p45 s VAL 184 Cb -0.03 -2.14 -0.10 0.00 0.00 0.00 0.00 36.38 34.11 1p45 s VAL 184 CO 0.09 0.47 1.61 -0.13 0.00 0.00 0.00 175.10 177.14 1p45 s ARG 185 N 1.35 4.20 -0.14 2.72 0.52 -1.07 -3.00 118.95 123.53 1p45 s ARG 185 Ca 0.05 2.40 -0.04 0.00 -0.52 0.00 0.00 55.73 57.62 1p45 s ARG 185 Cb -0.14 -3.21 -0.03 0.00 0.52 0.00 0.00 34.95 32.09 1p45 s ARG 185 CO -0.09 -0.65 0.00 0.45 0.02 0.00 0.00 175.30 175.03 1p45 s SER 186 N 1.35 5.18 -0.07 0.23 0.15 -1.26 -0.88 113.70 118.39 1p45 s SER 186 Ca 0.72 0.03 -0.20 0.00 0.70 0.00 0.00 55.95 57.19 1p45 s SER 186 Cb -0.44 -1.72 0.04 0.00 -1.71 0.00 0.00 66.02 62.19 1p45 s SER 186 CO 0.32 0.25 0.47 0.20 1.20 0.00 0.00 173.24 175.68 1p45 s ASN 187 N -0.10 -0.42 0.20 5.45 0.01 -0.70 0.10 114.94 119.48 1p45 s ASN 187 Ca 0.04 0.54 0.05 0.00 -0.71 0.00 0.00 52.86 52.77 1p45 s ASN 187 Cb -0.13 0.58 -0.03 0.00 0.41 0.00 0.00 41.25 42.08 1p45 s ASN 187 CO 0.02 -0.42 0.26 -0.76 -1.51 0.00 0.00 177.10 174.69 1p45 s LEU 188 N -0.83 4.12 -0.21 0.60 1.02 -0.27 -1.56 118.68 121.54 1p45 s LEU 188 Ca -0.09 -0.00 0.01 0.00 0.02 0.00 0.00 54.13 54.07 1p45 s LEU 188 Cb -0.03 -2.68 0.03 0.00 0.02 0.00 0.00 46.19 43.53 1p45 s LEU 188 CO 0.05 0.00 -0.15 -0.69 0.02 0.00 0.00 176.35 175.58 1p45 s VAL 189 N -1.89 2.21 -0.83 -1.59 1.01 -0.75 -2.42 120.40 116.14 1p45 s VAL 189 Ca 0.33 -1.16 -0.22 0.00 0.00 0.00 0.00 61.98 60.94 1p45 s VAL 189 Cb -0.10 -2.07 0.09 0.00 0.00 0.00 0.00 36.38 34.30 1p45 s VAL 189 CO 0.27 0.32 1.13 0.00 0.00 0.00 0.00 175.10 176.82 1p45 s ALA 190 N 1.24 3.11 0.64 5.51 0.00 0.42 -0.72 121.76 131.96 1p45 s ALA 190 Ca 0.00 -2.22 -0.13 0.00 0.00 0.00 0.00 51.96 49.61 1p45 s ALA 190 Cb -0.16 -4.07 -0.02 0.00 0.00 0.00 0.00 23.12 18.87 1p45 s ALA 190 CO -0.09 -3.03 1.05 0.00 0.00 0.00 0.00 175.76 173.68 1p45 s ALA 191 N 3.83 2.77 0.92 0.00 0.00 -0.61 -1.36 121.76 127.31 1p45 s ALA 191 Ca 0.31 0.19 -0.15 0.00 0.00 0.00 0.00 51.96 52.31 1p45 s ALA 191 Cb -0.09 -3.18 0.16 0.00 0.00 0.00 0.00 23.12 20.01 1p45 s ALA 191 CO -0.00 -0.94 1.26 0.20 0.00 0.00 0.00 175.76 176.28 1p45 s GLY 192 N -3.40 1.70 0.43 0.00 0.00 -0.76 -4.67 107.32 100.63 1p45 s GLY 192 Ca 0.60 -0.99 -0.24 0.00 0.00 0.00 0.00 44.72 44.09 1p45 s GLY 192 CO 0.46 -0.31 1.20 -4.14 0.00 0.00 0.00 173.10 170.31 1p45 s PRO 193 N -5.75 3.86 -0.03 2.90 0.02 -1.26 -5.01 135.00 129.74 1p45 s PRO 193 Ca 0.70 1.88 0.02 0.00 0.02 0.00 0.00 61.00 63.61 1p45 s PRO 193 Cb -0.07 -2.55 0.01 0.00 0.02 0.00 0.00 34.50 31.91 1p45 s PRO 193 CO 0.52 -0.49 -0.06 0.42 -0.33 0.00 0.00 177.00 177.06 1p45 s ILE 194 N -1.44 0.55 -1.31 2.83 -1.09 -1.26 -4.19 121.20 115.29 1p45 s ILE 194 Ca 0.61 -0.20 -0.17 0.00 -2.23 0.00 0.00 60.65 58.65 1p45 s ILE 194 Cb -0.31 -0.53 0.07 0.00 -1.58 0.00 0.00 42.46 40.11 1p45 s ILE 194 CO 0.39 0.20 1.78 -1.14 -1.23 0.00 0.00 174.94 174.93 1p45 n ARG 195 N 3.55 3.17 -1.55 2.79 3.00 0.26 -4.85 116.66 123.04 1p45 n ARG 195 Ca -0.20 -3.24 -0.30 0.00 -0.00 0.00 0.00 57.85 54.11 1p45 n ARG 195 Cb 0.54 -3.46 0.21 0.00 0.00 0.00 0.00 32.46 29.74 1p45 n ARG 195 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1p45 s THR 196 N 4.03 1.82 0.11 5.15 -4.23 -1.26 -4.77 115.64 116.49 1p45 s THR 196 Ca 0.53 0.00 -0.25 0.00 -1.18 0.00 0.00 61.69 60.79 1p45 s THR 196 Cb 0.05 -2.77 -0.09 0.00 1.34 0.00 0.00 72.50 71.02 1p45 s THR 196 CO 0.06 0.00 1.67 0.25 -0.54 0.00 0.00 174.62 176.06 1p45 h LEU 197 N -2.06 -0.47 -1.79 4.79 6.46 -1.92 0.70 115.31 121.02 1p45 h LEU 197 Ca -0.45 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.41 1p45 h LEU 197 Cb 1.26 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 41.35 1p45 h LEU 197 CO 0.36 -0.24 0.22 0.00 -0.62 0.00 0.00 178.44 178.16 1p45 h ALA 198 N 0.53 1.97 0.13 1.25 0.00 -1.96 -1.07 119.26 120.11 1p45 h ALA 198 Ca 0.03 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.65 1p45 h ALA 198 Cb 0.35 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.08 1p45 h ALA 198 CO -0.10 -0.03 -1.24 0.52 0.00 0.00 0.00 179.25 178.41 1p45 h MET 199 N 0.26 0.28 -0.36 0.00 2.86 -1.84 -1.97 114.93 114.16 1p45 h MET 199 Ca 0.14 -0.48 0.09 0.00 -2.06 0.00 0.00 59.70 57.39 1p45 h MET 199 Cb 0.22 0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1p45 h MET 199 CO -0.03 1.22 0.26 0.77 1.06 0.00 0.00 176.91 180.19 1p45 h SER 200 N 0.08 0.07 0.51 1.22 0.02 0.42 -2.57 113.55 113.30 1p45 h SER 200 Ca -0.14 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.61 1p45 h SER 200 Cb 1.96 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 64.48 1p45 h SER 200 CO 0.20 0.04 -0.90 0.00 -1.14 0.00 0.00 176.83 175.04 1p45 h ALA 201 N 1.82 0.47 0.20 3.77 0.00 -1.08 -2.10 119.26 122.33 1p45 h ALA 201 Ca 0.17 -0.72 -0.30 0.00 0.00 0.00 0.00 54.91 54.06 1p45 h ALA 201 Cb 0.58 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.33 1p45 h ALA 201 CO -0.01 0.88 -1.38 0.97 0.00 0.00 0.00 179.25 179.71 1p45 h ILE 202 N 0.15 1.23 -1.08 0.00 -0.00 -1.06 -1.69 117.51 115.05 1p45 h ILE 202 Ca -0.05 -2.59 0.29 0.00 -0.00 0.00 0.00 64.86 62.51 1p45 h ILE 202 Cb 1.53 2.98 -0.09 0.00 -0.00 0.00 0.00 36.82 41.24 1p45 h ILE 202 CO 0.14 0.79 0.71 0.58 -0.00 0.00 0.00 178.15 180.37 1p45 h VAL 203 N -0.04 0.47 -0.01 2.19 2.07 -1.57 -1.12 116.25 118.25 1p45 h VAL 203 Ca -0.26 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1p45 h VAL 203 Cb 1.99 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1p45 h VAL 203 CO 0.20 0.06 -0.02 0.61 0.02 0.00 0.00 177.57 178.44 1p45 n GLY 204 N -1.51 -0.55 0.00 2.17 0.00 -0.79 -4.96 105.19 99.55 1p45 n GLY 204 Ca 0.27 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1p45 n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p45 n GLY 205 N 1.13 1.01 0.20 -0.02 0.00 -0.42 -4.99 105.19 102.09 1p45 n GLY 205 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 1p45 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p45 h ALA 206 N 0.00 1.01 -0.05 4.61 0.00 -1.63 0.20 119.26 123.40 1p45 h ALA 206 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1p45 h ALA 206 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1p45 h ALA 206 CO 0.00 -0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1p45 n LEU 207 N -2.40 2.67 0.00 0.00 7.99 -1.26 -5.05 117.00 118.94 1p45 n LEU 207 Ca -0.02 -1.05 0.00 0.00 -0.01 0.00 0.00 56.01 54.94 1p45 n LEU 207 Cb 0.06 -0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 1p45 n LEU 207 CO 0.11 0.47 0.00 0.61 -1.51 0.00 0.00 177.39 177.08 1p45 n GLY 208 N 1.10 3.14 0.03 -0.72 0.00 0.70 -4.50 105.19 104.94 1p45 n GLY 208 Ca 0.12 -1.99 0.08 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.88 1.03 0.00 1.61 2.13 -1.26 -1.08 120.64 122.19 1p45 n GLU 209 Ca 0.00 -0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.77 1p45 n GLU 209 Cb 0.00 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 30.44 1p45 n GLU 209 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1p45 n GLU 210 N -0.71 0.00 -0.33 5.31 4.07 -1.26 -4.62 120.64 123.10 1p45 n GLU 210 Ca 0.13 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.18 1p45 n GLU 210 Cb 0.07 -0.47 -0.00 0.00 -0.06 0.00 0.00 31.44 30.97 1p45 n GLU 210 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1p45 h ALA 211 N 0.00 -0.09 -0.21 4.31 0.00 -1.77 -1.55 119.26 119.96 1p45 h ALA 211 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1p45 h ALA 211 Cb 0.27 1.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1p45 h ALA 211 CO 0.00 -0.73 0.39 0.78 0.00 0.00 0.00 179.25 179.69 1p45 h GLY 212 N -0.07 0.00 0.00 0.00 0.00 -1.32 -2.78 103.07 98.90 1p45 h GLY 212 Ca 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 1p45 h GLY 212 CO -0.89 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 175.64 1p45 h ALA 213 N 1.40 0.00 -0.83 3.60 0.00 -1.56 -2.68 119.26 119.20 1p45 h ALA 213 Ca 0.10 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1p45 h ALA 213 Cb 0.89 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 1p45 h ALA 213 CO -0.00 0.01 -0.49 1.04 0.00 0.00 0.00 179.25 179.81 1p45 n GLN 214 N -4.69 -0.37 0.22 0.00 1.13 -0.93 0.19 117.38 112.93 1p45 n GLN 214 Ca -0.06 1.33 0.16 0.00 -1.94 0.00 0.00 57.00 56.49 1p45 n GLN 214 Cb 0.26 -1.95 0.83 0.00 0.11 0.00 0.00 30.24 29.48 1p45 n GLN 214 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1p45 h ILE 215 N 0.00 0.53 0.12 5.09 5.03 -1.62 -2.51 117.51 124.15 1p45 h ILE 215 Ca 0.13 0.00 -0.17 0.00 -0.12 0.00 0.00 64.86 64.71 1p45 h ILE 215 Cb 0.34 0.87 0.02 0.00 -3.03 0.00 0.00 36.82 35.02 1p45 h ILE 215 CO -0.78 0.00 -0.76 -0.61 -0.68 0.00 0.00 178.15 175.32 1p45 h GLN 216 N 0.00 0.25 -0.49 2.37 5.75 0.11 -1.99 115.11 121.10 1p45 h GLN 216 Ca 0.07 -0.42 -0.02 0.00 -0.15 0.00 0.00 58.65 58.13 1p45 h GLN 216 Cb 0.40 0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 1p45 h GLN 216 CO -0.00 1.20 0.21 -0.07 -2.65 0.00 0.00 178.83 177.52 1p45 h LEU 217 N -0.47 0.62 0.40 -2.39 3.38 -1.05 0.72 115.31 116.52 1p45 h LEU 217 Ca -0.14 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1p45 h LEU 217 Cb 1.56 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1p45 h LEU 217 CO 0.11 0.55 -0.19 0.25 0.09 0.00 0.00 178.44 179.25 1p45 h LEU 218 N 0.69 -0.46 -1.22 1.67 5.85 -1.53 -3.05 115.31 117.25 1p45 h LEU 218 Ca 0.17 -0.12 0.16 0.00 0.84 0.00 0.00 57.88 58.92 1p45 h LEU 218 Cb 0.11 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 1p45 h LEU 218 CO -0.02 -0.07 0.60 -0.08 -0.34 0.00 0.00 178.44 178.52 1p45 h GLU 219 N -0.90 0.70 0.00 1.25 4.81 -1.32 -3.11 114.58 116.01 1p45 h GLU 219 Ca -0.05 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1p45 h GLU 219 Cb 0.55 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1p45 h GLU 219 CO 0.09 0.46 -0.33 -1.91 -0.73 0.00 0.00 179.01 176.59 1p45 n GLU 220 N -4.60 0.21 0.00 1.92 2.13 0.24 -3.57 120.64 116.97 1p45 n GLU 220 Ca 0.19 0.11 0.10 0.00 0.66 0.00 0.00 57.16 58.22 1p45 n GLU 220 Cb 0.50 -1.68 0.08 0.00 0.27 0.00 0.00 31.44 30.62 1p45 n GLU 220 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1p45 n GLY 221 N 1.37 0.63 0.14 8.31 0.00 -1.17 -3.61 105.19 110.85 1p45 n GLY 221 Ca 0.05 -0.60 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 1p45 n GLY 221 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1p45 h TRP 222 N 3.96 0.33 -0.20 1.61 6.55 -1.69 -2.04 115.95 124.47 1p45 h TRP 222 Ca 0.00 0.01 -0.20 0.00 0.95 0.00 0.00 58.89 59.65 1p45 h TRP 222 Cb 0.86 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.05 1p45 h TRP 222 CO 0.00 0.20 -0.68 0.22 -1.05 0.00 0.00 178.44 177.13 1p45 h ASP 223 N 0.36 0.91 -0.85 -3.49 3.58 -1.81 -0.19 116.42 114.93 1p45 h ASP 223 Ca 0.11 -0.55 -0.02 0.00 0.42 0.00 0.00 57.03 57.00 1p45 h ASP 223 Cb -0.01 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 40.74 1p45 h ASP 223 CO -0.05 1.34 0.47 1.56 -2.88 0.00 0.00 179.24 179.68 1p45 h GLN 224 N 0.57 1.18 0.00 0.28 4.20 -1.66 -2.69 115.11 116.99 1p45 h GLN 224 Ca -0.02 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.50 1p45 h GLN 224 Cb 1.29 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 1p45 h GLN 224 CO 0.14 0.86 -0.27 0.00 -0.67 0.00 0.00 178.83 178.89 1p45 h ARG 225 N 1.18 0.00 -6.51 1.46 3.08 -0.90 -3.45 114.38 109.24 1p45 h ARG 225 Ca 0.30 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.78 1p45 h ARG 225 Cb 0.02 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.00 1p45 h ARG 225 CO -0.05 0.27 0.88 0.00 -1.07 0.00 0.00 179.97 180.00 1p45 s ALA 226 N -3.25 3.32 0.60 0.04 0.00 -0.12 -4.55 121.76 117.79 1p45 s ALA 226 Ca 0.04 -0.29 0.30 0.00 0.00 0.00 0.00 51.96 52.00 1p45 s ALA 226 Cb 0.08 -3.79 1.64 0.00 0.00 0.00 0.00 23.12 21.05 1p45 s ALA 226 CO 0.69 -1.89 2.03 -1.35 0.00 0.00 0.00 175.76 175.23 1p45 h PRO 227 N 8.69 0.00 0.00 0.00 0.11 -1.85 -1.66 132.00 137.30 1p45 h PRO 227 Ca -0.22 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 1p45 h PRO 227 Cb 1.06 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1p45 h PRO 227 CO 1.08 0.00 -0.32 0.44 -0.21 0.00 0.00 178.00 178.99 1p45 n ILE 228 N -3.62 1.67 -0.95 4.15 -5.35 -1.25 -5.10 119.36 108.90 1p45 n ILE 228 Ca 0.03 -2.31 0.12 0.00 -0.27 0.00 0.00 62.75 60.31 1p45 n ILE 228 Cb 0.42 -0.06 -0.06 0.00 -1.74 0.00 0.00 39.64 38.20 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 -1.02 -2.83 2.70 3.28 0.00 -0.63 -4.97 105.19 101.73 1p45 n GLY 229 Ca 0.15 -1.20 -0.19 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.42 0.01 -0.32 1.61 -0.11 -1.26 -4.58 118.94 110.87 1p45 s TRP 230 Ca 0.00 0.33 -0.01 0.00 1.22 0.00 0.00 56.10 57.63 1p45 s TRP 230 Cb 0.00 -0.44 0.06 0.00 -1.50 0.00 0.00 33.47 31.60 1p45 s TRP 230 CO 0.00 -0.20 0.04 1.21 -4.62 0.00 0.00 176.95 173.37 1p45 s ASN 231 N 2.18 4.93 0.00 5.86 2.47 -1.26 -4.61 114.94 124.51 1p45 s ASN 231 Ca 0.04 -1.47 0.07 0.00 0.42 0.00 0.00 52.86 51.92 1p45 s ASN 231 Cb -0.12 -1.72 0.31 0.00 -1.45 0.00 0.00 41.25 38.27 1p45 s ASN 231 CO -0.04 -0.32 1.18 1.15 -3.72 0.00 0.00 177.10 175.36 1p45 n MET 232 N 4.58 0.03 -1.26 0.43 -0.00 -1.26 -2.56 117.12 117.08 1p45 n MET 232 Ca -0.10 0.34 -0.26 0.00 -0.00 0.00 0.00 57.70 57.68 1p45 n MET 232 Cb 0.43 -1.50 0.14 0.00 -0.00 0.00 0.00 33.22 32.29 1p45 n MET 232 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1p45 n LYS 233 N -1.44 2.43 -3.36 3.17 2.85 -1.26 0.92 118.16 121.46 1p45 n LYS 233 Ca 0.02 -3.20 -0.14 0.00 -1.05 0.00 0.00 58.31 53.94 1p45 n LYS 233 Cb 0.07 -2.18 -0.08 0.00 -0.65 0.00 0.00 35.03 32.19 1p45 n LYS 233 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1p45 s ASP 234 N -1.77 1.20 0.00 -5.58 2.15 -1.06 -5.01 116.67 106.60 1p45 s ASP 234 Ca 0.58 -0.69 0.12 0.00 0.43 0.00 0.00 52.55 52.99 1p45 s ASP 234 Cb 0.48 0.72 0.40 0.00 -0.30 0.00 0.00 42.92 44.21 1p45 s ASP 234 CO 0.05 -0.37 1.31 0.00 -0.17 0.00 0.00 175.17 175.99 1p45 n ALA 235 N 5.25 2.47 -0.05 3.66 0.00 -1.26 -4.48 120.51 126.10 1p45 n ALA 235 Ca -0.00 -0.50 -0.15 0.00 0.00 0.00 0.00 53.44 52.79 1p45 n ALA 235 Cb 0.47 -1.01 -0.07 0.00 0.00 0.00 0.00 19.45 18.84 1p45 n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1p45 h THR 236 N 1.75 1.35 -1.00 0.00 2.02 -1.95 -1.18 112.91 113.90 1p45 h THR 236 Ca 0.00 -1.65 0.12 0.00 0.77 0.00 0.00 66.41 65.65 1p45 h THR 236 Cb 0.40 1.99 -0.09 0.00 -1.74 0.00 0.00 68.15 68.71 1p45 h THR 236 CO 0.00 0.50 0.63 -0.65 0.37 0.00 0.00 175.52 176.37 1p45 h PRO 237 N 0.18 0.95 -0.24 6.66 0.11 -1.98 0.65 132.00 138.33 1p45 h PRO 237 Ca -0.00 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.92 1p45 h PRO 237 Cb 1.00 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 1p45 h PRO 237 CO 0.08 0.63 -0.41 0.28 -0.21 0.00 0.00 178.00 178.37 1p45 h VAL 238 N 0.98 1.30 -0.03 3.15 2.07 -1.75 -1.83 116.25 120.13 1p45 h VAL 238 Ca 0.50 -1.58 -0.19 0.00 0.82 0.00 0.00 66.70 66.25 1p45 h VAL 238 Cb 0.52 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1p45 h VAL 238 CO -0.27 0.50 -0.74 0.00 0.02 0.00 0.00 177.57 177.08 1p45 h ALA 239 N 1.09 0.13 -0.98 1.67 0.00 0.05 -0.33 119.26 120.89 1p45 h ALA 239 Ca 0.04 -0.60 0.28 0.00 0.00 0.00 0.00 54.91 54.63 1p45 h ALA 239 Cb 0.91 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1p45 h ALA 239 CO 0.08 0.49 0.73 0.87 0.00 0.00 0.00 179.25 181.42 1p45 h LYS 240 N 0.14 0.00 0.04 0.00 1.57 0.21 -2.18 116.57 116.36 1p45 h LYS 240 Ca -0.08 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 1p45 h LYS 240 Cb 1.42 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.73 1p45 h LYS 240 CO 0.15 0.00 -0.46 1.15 -0.57 0.00 0.00 179.45 179.72 1p45 h THR 241 N 0.00 1.56 -0.92 -0.16 2.02 -0.19 -2.63 112.91 112.59 1p45 h THR 241 Ca 0.47 -2.37 0.27 0.00 0.77 0.00 0.00 66.41 65.54 1p45 h THR 241 Cb 1.92 3.14 -0.15 0.00 -1.74 0.00 0.00 68.15 71.32 1p45 h THR 241 CO -0.00 0.60 0.29 0.58 0.37 0.00 0.00 175.52 177.35 1p45 h VAL 242 N -0.81 0.26 -0.55 3.16 2.07 -1.05 -0.68 116.25 118.65 1p45 h VAL 242 Ca -0.10 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1p45 h VAL 242 Cb 1.24 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1p45 h VAL 242 CO 0.01 0.03 0.09 0.00 0.02 0.00 0.00 177.57 177.72 1p45 h ALA 244 N 0.99 0.01 -0.99 0.00 0.00 -0.75 0.18 119.26 118.71 1p45 h ALA 244 Ca 0.17 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.30 1p45 h ALA 244 Cb 0.41 0.69 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1p45 h ALA 244 CO 0.01 -0.64 0.64 -0.07 0.00 0.00 0.00 179.25 179.20 1p45 h LEU 245 N -0.16 1.03 -1.07 0.00 -0.00 -1.14 -2.74 115.31 111.24 1p45 h LEU 245 Ca 0.23 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 58.07 1p45 h LEU 245 Cb 0.53 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.96 1p45 h LEU 245 CO -0.63 0.67 -0.21 -0.07 -0.00 0.00 0.00 178.44 178.21 1p45 h LEU 246 N 1.18 0.00-10.48 1.67 3.38 0.66 -3.45 115.31 108.27 1p45 h LEU 246 Ca 0.42 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.91 1p45 h LEU 246 Cb 0.13 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.00 1p45 h LEU 246 CO -0.16 0.21 0.34 -0.94 0.09 0.00 0.00 178.44 177.98 1p45 s SER 247 N -6.15 4.13 0.11 -0.43 1.04 0.22 -4.68 113.70 107.93 1p45 s SER 247 Ca 0.01 1.07 0.18 0.00 0.48 0.00 0.00 55.95 57.69 1p45 s SER 247 Cb 0.10 -1.70 0.76 0.00 0.10 0.00 0.00 66.02 65.27 1p45 s SER 247 CO 0.63 -2.17 1.56 0.47 0.98 0.00 0.00 173.24 174.71 1p45 n ASP 248 N -3.53 0.27 -0.00 7.02 8.00 -1.26 -3.91 116.55 123.14 1p45 n ASP 248 Ca 0.07 0.57 0.15 0.00 0.71 0.00 0.00 54.79 56.29 1p45 n ASP 248 Cb 0.58 -0.63 0.83 0.00 -0.02 0.00 0.00 41.12 41.89 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 -1.80 0.00 -3.73 1.24 7.02 -1.26 -3.25 117.44 115.65 1p45 n TRP 249 Ca 0.03 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.23 1p45 n TRP 249 Cb 0.19 -0.17 -0.11 0.00 -2.42 0.00 0.00 31.31 28.79 1p45 n TRP 249 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1p45 s LEU 250 N -2.34 3.61 0.00 -0.99 1.43 -1.25 -4.96 118.68 114.17 1p45 s LEU 250 Ca 0.36 -3.53 0.26 0.00 -1.03 0.00 0.00 54.13 50.19 1p45 s LEU 250 Cb 0.21 -1.22 0.64 0.00 0.03 0.00 0.00 46.19 45.85 1p45 s LEU 250 CO 0.43 -0.12 1.50 -0.81 0.23 0.00 0.00 176.35 177.57 1p45 n PRO 251 N 2.35 0.56 -0.57 1.29 -0.04 -1.20 -4.19 135.00 133.18 1p45 n PRO 251 Ca 0.22 -0.33 0.08 0.00 -0.04 0.00 0.00 63.50 63.43 1p45 n PRO 251 Cb 0.39 -1.49 0.30 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.93 3.24 -3.87 0.55 0.00 -1.26 -4.91 120.51 113.33 1p45 n ALA 252 Ca 0.10 -2.18 -0.29 0.00 0.00 0.00 0.00 53.44 51.07 1p45 n ALA 252 Cb 0.35 -0.83 -0.17 0.00 0.00 0.00 0.00 19.45 18.80 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 -2.77 1.49 0.01 0.00 -1.32 -1.26 -5.10 115.64 106.69 1p45 s THR 253 Ca 0.46 -0.60 -0.16 0.00 -1.21 0.00 0.00 61.69 60.18 1p45 s THR 253 Cb 0.36 -1.39 0.03 0.00 -1.51 0.00 0.00 72.50 69.99 1p45 s THR 253 CO 0.11 0.44 0.34 0.28 -2.21 0.00 0.00 174.62 173.58 1p45 s THR 254 N 1.32 0.06 0.00 5.08 -1.32 -1.26 -4.75 115.64 114.77 1p45 s THR 254 Ca 0.01 -0.53 0.00 0.00 -1.21 0.00 0.00 61.69 59.95 1p45 s THR 254 Cb -0.14 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 1p45 s THR 254 CO -0.07 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.66 1p45 n GLY 255 N 0.88 2.69 4.02 6.08 0.00 0.29 -4.92 105.19 114.23 1p45 n GLY 255 Ca -0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.70 5.47 -0.04 1.61 -1.08 -1.25 -4.39 116.67 115.29 1p45 s ASP 256 Ca 0.00 -0.57 0.06 0.00 -0.52 0.00 0.00 52.55 51.52 1p45 s ASP 256 Cb 0.00 -0.33 -0.01 0.00 -1.46 0.00 0.00 42.92 41.12 1p45 s ASP 256 CO 0.00 -0.96 -0.21 -0.63 0.52 0.00 0.00 175.17 173.89 1p45 s ILE 257 N -2.46 1.67 -0.11 4.11 1.01 -1.26 -1.12 121.20 123.04 1p45 s ILE 257 Ca 0.57 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 60.37 1p45 s ILE 257 Cb -0.09 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 1p45 s ILE 257 CO 0.35 0.47 -0.19 -0.63 0.00 0.00 0.00 174.94 174.95 1p45 s ILE 258 N -0.22 2.56 -0.48 2.92 -1.09 -1.02 -4.96 121.20 118.91 1p45 s ILE 258 Ca 0.01 -0.84 -0.17 0.00 -2.23 0.00 0.00 60.65 57.42 1p45 s ILE 258 Cb -0.11 -2.03 0.06 0.00 -1.58 0.00 0.00 42.46 38.80 1p45 s ILE 258 CO 0.01 0.54 0.50 -0.31 -1.23 0.00 0.00 174.94 174.46 1p45 s TYR 259 N 0.31 3.15 -1.03 3.97 1.51 -1.26 -0.44 117.35 123.56 1p45 s TYR 259 Ca -0.14 -0.66 -0.03 0.00 -1.01 0.00 0.00 57.07 55.23 1p45 s TYR 259 Cb -0.17 -3.28 0.30 0.00 -0.11 0.00 0.00 41.96 38.71 1p45 s TYR 259 CO 0.07 -0.88 1.40 0.00 -1.11 0.00 0.00 175.55 175.03 1p45 n ALA 260 N 5.69 5.07 -2.39 3.71 0.00 -0.47 -4.72 120.51 127.40 1p45 n ALA 260 Ca -0.09 -4.81 0.02 0.00 0.00 0.00 0.00 53.44 48.57 1p45 n ALA 260 Cb 0.45 -2.18 0.01 0.00 0.00 0.00 0.00 19.45 17.73 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 1.24 0.66 -2.58 0.00 5.75 -1.26 -1.83 116.55 118.54 1p45 n ASP 261 Ca 0.27 -1.99 -0.02 0.00 -0.01 0.00 0.00 54.79 53.04 1p45 n ASP 261 Cb 0.34 -0.21 -0.00 0.00 -1.03 0.00 0.00 41.12 40.21 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 0.39 -0.50 0.98 6.12 0.00 -1.26 -2.42 105.19 108.50 1p45 n GLY 262 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.52 0.97 0.28 -0.02 0.00 -1.26 -3.61 105.19 101.03 1p45 n GLY 263 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 1.07 0.00 4.61 0.00 -1.72 -0.92 119.26 122.30 1p45 h ALA 264 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1p45 h ALA 264 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1p45 h ALA 264 CO 0.00 0.07 0.00 -2.39 0.00 0.00 0.00 179.25 176.93 1p45 n HIS 265 N -3.26 0.00 0.71 0.00 1.44 -1.26 -3.03 115.22 109.82 1p45 n HIS 265 Ca -0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 1p45 n HIS 265 Cb 0.25 -0.38 0.13 0.00 0.12 0.00 0.00 29.99 30.12 1p45 n HIS 265 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1p45 n THR 266 N -1.38 0.18 -4.19 0.61 -2.24 -0.35 -4.94 114.28 101.97 1p45 n THR 266 Ca 0.10 -0.59 -0.18 0.00 -2.27 0.00 0.00 64.05 61.11 1p45 n THR 266 Cb 0.25 1.30 -0.12 0.00 -2.10 0.00 0.00 70.33 69.67 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 -1.74 0.87 -0.24 -0.78 -1.52 -1.17 -5.04 119.66 110.04 1p45 s GLN 267 Ca 0.30 -1.05 -0.17 0.00 -1.95 0.00 0.00 55.36 52.49 1p45 s GLN 267 Cb 0.20 -0.79 -0.14 0.00 -0.22 0.00 0.00 33.01 32.06 1p45 s GLN 267 CO 0.29 0.16 -0.11 -0.11 -0.25 0.00 0.00 175.29 175.27 1p45 n LEU 268 N 0.99 1.91 0.00 2.90 7.94 -1.26 -4.95 117.00 124.52 1p45 n LEU 268 Ca -0.19 0.39 0.00 0.00 -1.11 0.00 0.00 56.01 55.10 1p45 n LEU 268 Cb 0.55 -0.88 0.00 0.00 0.53 0.00 0.00 43.42 43.62 1p45 n LEU 268 CO 0.24 0.35 0.00 -0.11 -1.11 0.00 0.00 177.39 176.76