#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x12 s LYS 2 N 0.00 1.60 -0.08 2.12 1.02 -1.26 -1.23 119.74 121.91 1x12 s LYS 2 Ca 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 55.97 55.35 1x12 s LYS 2 Cb 0.00 -1.51 0.01 0.00 -0.52 0.00 0.00 37.83 35.80 1x12 s LYS 2 CO 0.00 0.38 -0.19 0.08 -0.92 0.00 0.00 175.35 174.71 1x12 s VAL 3 N -0.37 1.64 -0.18 3.17 1.01 0.56 -0.64 120.40 125.59 1x12 s VAL 3 Ca 0.05 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1x12 s VAL 3 Cb -0.08 -1.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1x12 s VAL 3 CO -0.00 0.47 -0.03 -0.22 0.00 0.00 0.00 175.10 175.32 1x12 s LEU 4 N 0.45 3.20 -0.09 3.92 2.96 0.04 0.19 118.68 129.34 1x12 s LEU 4 Ca -0.16 -0.19 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 1x12 s LEU 4 Cb -0.17 -1.79 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 1x12 s LEU 4 CO 0.06 0.11 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.28 1x12 s VAL 5 N 0.70 2.03 0.20 1.68 1.01 0.55 -0.70 120.40 125.87 1x12 s VAL 5 Ca -0.02 -1.02 0.11 0.00 0.00 0.00 0.00 61.98 61.05 1x12 s VAL 5 Cb -0.14 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1x12 s VAL 5 CO 0.02 0.56 -0.22 0.42 0.00 0.00 0.00 175.10 175.88 1x12 s THR 6 N 0.19 2.21 0.32 3.92 -4.23 -0.90 -1.16 115.64 116.00 1x12 s THR 6 Ca -0.14 -2.06 0.04 0.00 -1.18 0.00 0.00 61.69 58.35 1x12 s THR 6 Cb -0.17 -2.07 -0.04 0.00 1.34 0.00 0.00 72.50 71.57 1x12 s THR 6 CO 0.07 -0.22 0.16 -0.83 -0.54 0.00 0.00 174.62 173.27 1x12 s GLY 7 N -2.80 2.15 0.20 3.99 0.00 -0.54 -0.70 107.32 109.62 1x12 s GLY 7 Ca 0.21 -1.73 0.11 0.00 0.00 0.00 0.00 44.72 43.31 1x12 s GLY 7 CO 0.10 -1.61 -0.21 -1.36 0.00 0.00 0.00 173.10 170.02 1x12 s PHE 8 N -3.54 2.36 0.90 1.90 0.40 -1.26 -0.06 117.98 118.69 1x12 s PHE 8 Ca 0.35 -0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 56.22 1x12 s PHE 8 Cb 0.04 -1.16 0.13 0.00 0.51 0.00 0.00 43.02 42.55 1x12 s PHE 8 CO 0.18 0.52 1.17 -1.83 0.70 0.00 0.00 175.22 175.96 1x12 s GLU 9 N -2.77 1.26 0.68 0.44 -1.05 -0.85 -3.26 118.70 113.14 1x12 s GLU 9 Ca 0.22 0.14 -0.16 0.00 -0.15 0.00 0.00 54.97 55.02 1x12 s GLU 9 Cb -0.08 -1.87 0.01 0.00 -0.44 0.00 0.00 34.13 31.76 1x12 s GLU 9 CO 0.11 -2.09 1.23 -2.14 0.95 0.00 0.00 175.26 173.32 1x12 s PRO 10 N -5.45 2.41 0.26 -4.83 0.02 -1.26 -4.76 135.00 121.39 1x12 s PRO 10 Ca 0.65 1.84 -0.20 0.00 0.02 0.00 0.00 61.00 63.30 1x12 s PRO 10 Cb -0.12 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.57 1x12 s PRO 10 CO 0.52 -1.65 0.67 -0.59 -0.33 0.00 0.00 177.00 175.62 1x12 s PHE 11 N -1.78 -0.17 -1.73 6.54 -0.12 -1.26 -4.84 117.98 114.61 1x12 s PHE 11 Ca 0.77 -0.24 0.00 0.00 -0.05 0.00 0.00 56.93 57.41 1x12 s PHE 11 Cb -0.31 0.62 0.00 0.00 -0.63 0.00 0.00 43.02 42.69 1x12 s PHE 11 CO 0.41 -1.14 0.00 0.41 -0.05 0.00 0.00 175.22 174.85 1x12 n GLY 12 N -0.43 1.02 1.35 1.99 0.00 -1.26 -2.23 105.19 105.63 1x12 n GLY 12 Ca -0.06 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1x12 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x12 n GLY 13 N -0.89 2.08 3.77 -0.02 0.00 -1.26 -5.04 105.19 103.83 1x12 n GLY 13 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1x12 n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x12 s GLU 14 N -0.61 4.00 0.22 1.61 0.41 -0.94 -4.93 118.70 118.45 1x12 s GLU 14 Ca 0.00 2.04 0.09 0.00 -0.41 0.00 0.00 54.97 56.70 1x12 s GLU 14 Cb 0.00 -2.73 0.14 0.00 -1.78 0.00 0.00 34.13 29.76 1x12 s GLU 14 CO 0.00 -0.43 1.48 0.87 -0.49 0.00 0.00 175.26 176.69 1x12 h LYS 15 N 2.67 0.00 -4.66 1.61 6.56 -1.96 -3.37 116.57 117.42 1x12 h LYS 15 Ca -0.49 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 58.85 1x12 h LYS 15 Cb 1.24 0.00 -0.15 0.00 -0.57 0.00 0.00 32.23 32.75 1x12 h LYS 15 CO 0.63 0.76 -0.66 0.96 -2.06 0.00 0.00 179.45 179.07 1x12 s ILE 16 N -3.25 0.48 -0.17 1.86 -4.36 -1.26 -4.82 121.20 109.68 1x12 s ILE 16 Ca -0.00 -1.95 -0.03 0.00 -0.26 0.00 0.00 60.65 58.41 1x12 s ILE 16 Cb 0.12 -2.08 0.05 0.00 1.25 0.00 0.00 42.46 41.80 1x12 s ILE 16 CO 0.78 -0.49 0.03 0.21 0.24 0.00 0.00 174.94 175.71 1x12 s ASN 17 N -3.13 2.64 0.57 4.36 3.84 -1.26 -4.74 114.94 117.23 1x12 s ASN 17 Ca 0.23 -0.68 0.27 0.00 0.21 0.00 0.00 52.86 52.90 1x12 s ASN 17 Cb 0.07 -0.56 1.54 0.00 -0.55 0.00 0.00 41.25 41.74 1x12 s ASN 17 CO 0.03 -0.28 2.04 1.55 -2.79 0.00 0.00 177.10 177.65 1x12 h PRO 18 N 8.26 0.00 0.00 0.43 0.13 -1.94 -1.44 132.00 137.45 1x12 h PRO 18 Ca -0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.95 1x12 h PRO 18 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1x12 h PRO 18 CO 0.32 0.00 -0.06 1.79 -0.23 0.00 0.00 178.00 179.82 1x12 h THR 19 N 0.00 0.16 -0.33 1.56 1.35 -1.92 -2.22 112.91 111.51 1x12 h THR 19 Ca 0.14 -0.67 -0.06 0.00 -0.55 0.00 0.00 66.41 65.28 1x12 h THR 19 Cb 0.70 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 1x12 h THR 19 CO -0.00 0.06 -0.02 -0.08 -0.25 0.00 0.00 175.52 175.22 1x12 h GLU 20 N 0.00 0.59 -0.32 4.72 4.81 -1.23 -1.91 114.58 121.23 1x12 h GLU 20 Ca -0.00 -0.20 -0.11 0.00 -0.13 0.00 0.00 59.36 58.92 1x12 h GLU 20 Cb 0.57 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1x12 h GLU 20 CO 0.01 0.74 -0.25 -0.09 -0.73 0.00 0.00 179.01 178.69 1x12 h ARG 21 N 0.39 0.65 -0.30 1.92 2.43 -1.58 -2.38 114.38 115.50 1x12 h ARG 21 Ca 0.09 -0.26 0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1x12 h ARG 21 Cb 0.49 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1x12 h ARG 21 CO 0.02 0.84 0.15 0.82 -1.51 0.00 0.00 179.97 180.29 1x12 h ILE 22 N 0.56 0.99 -0.19 1.20 2.04 -1.21 0.20 117.51 121.11 1x12 h ILE 22 Ca 0.08 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1x12 h ILE 22 Cb 0.73 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1x12 h ILE 22 CO 0.06 0.06 0.12 0.00 0.00 0.00 0.00 178.15 178.38 1x12 h ALA 23 N 1.15 0.24 -0.58 1.87 0.00 -1.19 -1.15 119.26 119.61 1x12 h ALA 23 Ca 0.12 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1x12 h ALA 23 Cb 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1x12 h ALA 23 CO -0.08 -0.29 0.07 0.87 0.00 0.00 0.00 179.25 179.81 1x12 h LYS 24 N 0.24 0.95 -0.17 0.00 1.57 -1.11 -1.41 116.57 116.64 1x12 h LYS 24 Ca 0.07 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 1x12 h LYS 24 Cb -0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1x12 h LYS 24 CO -0.03 0.90 -0.33 -0.44 -0.57 0.00 0.00 179.45 178.98 1x12 h ASP 25 N 0.89 0.34 0.79 0.86 3.45 -0.34 -3.11 116.42 119.30 1x12 h ASP 25 Ca 0.18 -0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1x12 h ASP 25 Cb 0.43 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 1x12 h ASP 25 CO 0.01 0.65 -0.64 0.18 -1.57 0.00 0.00 179.24 177.87 1x12 n LEU 26 N -4.08 0.66 -4.71 1.55 4.77 -0.46 -4.82 117.00 109.91 1x12 n LEU 26 Ca -0.01 0.18 -0.42 0.00 -0.03 0.00 0.00 56.01 55.73 1x12 n LEU 26 Cb 0.43 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1x12 n LEU 26 CO 0.42 -0.03 1.29 -0.62 -1.33 0.00 0.00 177.39 177.12 1x12 s ASP 27 N -4.06 6.53 0.00 -1.43 3.68 -0.55 -2.45 116.67 118.39 1x12 s ASP 27 Ca 0.07 2.67 0.00 0.00 2.13 0.00 0.00 52.55 57.41 1x12 s ASP 27 Cb 0.14 -2.59 0.00 0.00 -1.45 0.00 0.00 42.92 39.02 1x12 s ASP 27 CO 0.72 -0.88 0.00 0.61 0.13 0.00 0.00 175.17 175.75 1x12 n GLY 28 N 3.88 2.12 3.85 2.66 0.00 -0.03 -4.85 105.19 112.81 1x12 n GLY 28 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1x12 n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1x12 s ILE 29 N -2.49 2.52 -0.01 -0.61 -4.36 -1.03 -4.79 121.20 110.44 1x12 s ILE 29 Ca 0.00 0.17 0.03 0.00 -0.26 0.00 0.00 60.65 60.59 1x12 s ILE 29 Cb 0.00 -3.05 -0.01 0.00 1.25 0.00 0.00 42.46 40.65 1x12 s ILE 29 CO 0.00 -0.22 -0.09 -0.54 0.24 0.00 0.00 174.94 174.32 1x12 s LYS 30 N -5.37 0.78 -0.34 0.37 1.02 -1.26 -1.46 119.74 113.48 1x12 s LYS 30 Ca 0.61 -0.33 0.03 0.00 0.02 0.00 0.00 55.97 56.30 1x12 s LYS 30 Cb -0.13 -0.75 0.10 0.00 -0.52 0.00 0.00 37.83 36.53 1x12 s LYS 30 CO 0.52 0.19 0.05 0.42 -0.92 0.00 0.00 175.35 175.61 1x12 s ILE 31 N -0.18 2.42 0.00 2.17 1.01 -0.90 -4.96 121.20 120.76 1x12 s ILE 31 Ca 0.03 -2.20 0.00 0.00 0.00 0.00 0.00 60.65 58.48 1x12 s ILE 31 Cb -0.04 -2.72 0.00 0.00 0.01 0.00 0.00 42.46 39.71 1x12 s ILE 31 CO -0.00 -0.53 0.00 0.61 0.00 0.00 0.00 174.94 175.02 1x12 n GLY 32 N 4.33 1.05 1.41 6.18 0.00 -1.26 -2.15 105.19 114.74 1x12 n GLY 32 Ca 0.01 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.49 1x12 n GLY 32 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x12 n ASP 33 N 5.34 4.19 -4.73 1.61 8.00 -1.26 -4.93 116.55 124.76 1x12 n ASP 33 Ca 0.00 -2.14 -0.40 0.00 0.71 0.00 0.00 54.79 52.96 1x12 n ASP 33 Cb 0.00 -0.51 -0.05 0.00 -0.02 0.00 0.00 41.12 40.54 1x12 n ASP 33 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x12 s ALA 34 N -1.26 3.36 -0.14 2.24 0.00 -0.92 -4.58 121.76 120.46 1x12 s ALA 34 Ca 0.49 0.20 -0.17 0.00 0.00 0.00 0.00 51.96 52.49 1x12 s ALA 34 Cb 0.28 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.39 1x12 s ALA 34 CO 0.30 -0.01 0.43 -1.14 0.00 0.00 0.00 175.76 175.34 1x12 s GLN 35 N 0.35 4.30 -0.14 0.00 2.00 -0.36 -2.11 119.66 123.70 1x12 s GLN 35 Ca 0.38 0.34 -0.05 0.00 -2.00 0.00 0.00 55.36 54.03 1x12 s GLN 35 Cb -0.19 -3.45 -0.04 0.00 0.80 0.00 0.00 33.01 30.13 1x12 s GLN 35 CO 0.20 0.14 0.03 0.08 -0.50 0.00 0.00 175.29 175.25 1x12 s VAL 36 N 0.70 4.51 -0.08 1.34 1.01 -0.53 -0.32 120.40 127.02 1x12 s VAL 36 Ca 0.23 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1x12 s VAL 36 Cb -0.15 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1x12 s VAL 36 CO 0.08 0.53 -0.21 -0.36 0.00 0.00 0.00 175.10 175.15 1x12 s PHE 37 N -0.18 2.58 -0.13 5.22 0.40 0.13 -0.85 117.98 125.15 1x12 s PHE 37 Ca 0.06 -0.73 0.02 0.00 -0.60 0.00 0.00 56.93 55.68 1x12 s PHE 37 Cb -0.12 -1.69 0.00 0.00 0.51 0.00 0.00 43.02 41.72 1x12 s PHE 37 CO 0.02 -0.22 -0.20 0.20 0.70 0.00 0.00 175.22 175.72 1x12 s GLY 38 N 0.02 1.41 0.01 4.36 0.00 -1.26 -0.33 107.32 111.53 1x12 s GLY 38 Ca -0.08 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.65 1x12 s GLY 38 CO 0.05 -0.13 -0.07 0.50 0.00 0.00 0.00 173.10 173.45 1x12 s ARG 39 N 0.60 0.53 -0.17 2.90 1.81 -0.31 -4.75 118.95 119.55 1x12 s ARG 39 Ca -0.11 -0.43 -0.09 0.00 -1.72 0.00 0.00 55.73 53.38 1x12 s ARG 39 Cb -0.16 -0.44 -0.05 0.00 -0.45 0.00 0.00 34.95 33.85 1x12 s ARG 39 CO 0.03 0.11 0.13 0.08 -0.68 0.00 0.00 175.30 174.97 1x12 s VAL 40 N -0.61 5.42 0.07 3.52 1.01 -1.26 -1.46 120.40 127.08 1x12 s VAL 40 Ca -0.02 0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.18 1x12 s VAL 40 Cb -0.05 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1x12 s VAL 40 CO 0.00 0.50 0.04 -0.76 0.00 0.00 0.00 175.10 174.89 1x12 s LEU 41 N -0.13 3.66 0.48 3.92 1.43 0.91 -4.92 118.68 124.03 1x12 s LEU 41 Ca 0.10 -0.05 -0.19 0.00 -1.03 0.00 0.00 54.13 52.96 1x12 s LEU 41 Cb -0.11 -2.31 -0.09 0.00 0.03 0.00 0.00 46.19 43.70 1x12 s LEU 41 CO 0.00 0.19 0.98 -2.16 0.23 0.00 0.00 176.35 175.60 1x12 s PRO 42 N -2.21 4.00 -1.18 1.29 0.04 -1.26 -2.01 135.00 133.66 1x12 s PRO 42 Ca 0.26 1.11 -0.06 0.00 0.04 0.00 0.00 61.00 62.35 1x12 s PRO 42 Cb -0.12 -2.14 0.23 0.00 0.04 0.00 0.00 34.50 32.51 1x12 s PRO 42 CO 0.19 -0.23 1.80 0.28 0.04 0.00 0.00 177.00 179.07 1x12 n VAL 43 N -1.12 5.03 -3.70 -0.36 0.31 -1.26 -4.55 118.33 112.68 1x12 n VAL 43 Ca 0.07 -5.14 -0.15 0.00 -0.01 0.00 0.00 64.34 59.12 1x12 n VAL 43 Cb 0.54 -2.13 -0.14 0.00 -0.91 0.00 0.00 33.84 31.20 1x12 n VAL 43 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1x12 s VAL 44 N -1.52 -0.17 0.48 2.52 1.01 -1.26 -0.28 120.40 121.17 1x12 s VAL 44 Ca 0.38 0.25 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 1x12 s VAL 44 Cb 0.10 -0.31 -0.07 0.00 0.00 0.00 0.00 36.38 36.10 1x12 s VAL 44 CO 0.02 0.11 1.29 -0.36 0.00 0.00 0.00 175.10 176.15 1x12 s PHE 45 N 1.76 2.62 0.00 5.22 0.40 -1.26 -0.98 117.98 125.74 1x12 s PHE 45 Ca -0.03 1.43 0.00 0.00 -0.60 0.00 0.00 56.93 57.72 1x12 s PHE 45 Cb -0.12 -3.64 0.00 0.00 0.51 0.00 0.00 43.02 39.77 1x12 s PHE 45 CO -0.07 -2.25 0.00 0.41 0.70 0.00 0.00 175.22 174.01 1x12 n GLY 46 N 0.61 2.08 0.32 4.36 0.00 -1.26 -4.51 105.19 106.79 1x12 n GLY 46 Ca 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 46.02 45.83 1x12 n GLY 46 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1x12 h LYS 47 N 0.00 0.96 -0.67 1.61 3.64 -1.97 -0.51 116.57 119.63 1x12 h LYS 47 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1x12 h LYS 47 Cb 0.00 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 1x12 h LYS 47 CO 0.00 0.64 0.42 0.00 -2.27 0.00 0.00 179.45 178.23 1x12 h ALA 48 N 1.40 1.48 -0.38 5.00 0.00 -1.29 -0.91 119.26 124.56 1x12 h ALA 48 Ca 0.37 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1x12 h ALA 48 Cb 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1x12 h ALA 48 CO -0.17 0.46 -0.03 -0.22 0.00 0.00 0.00 179.25 179.29 1x12 h LYS 49 N 0.91 0.70 0.05 0.00 3.64 -1.38 -0.52 116.57 119.96 1x12 h LYS 49 Ca 0.24 -0.24 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1x12 h LYS 49 Cb -0.07 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1x12 h LYS 49 CO -0.05 0.81 -0.07 0.93 -2.27 0.00 0.00 179.45 178.80 1x12 h GLU 50 N 0.51 -0.15 -0.29 1.90 5.08 -0.47 0.24 114.58 121.41 1x12 h GLU 50 Ca 0.10 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1x12 h GLU 50 Cb 0.52 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1x12 h GLU 50 CO 0.03 -0.10 0.17 0.28 -1.00 0.00 0.00 179.01 178.39 1x12 h VAL 51 N -0.15 1.11 0.04 3.13 2.07 -1.14 -1.04 116.25 120.25 1x12 h VAL 51 Ca 0.01 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.29 1x12 h VAL 51 Cb 0.16 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1x12 h VAL 51 CO -0.04 0.10 -0.07 0.25 0.02 0.00 0.00 177.57 177.84 1x12 h LEU 52 N 0.37 -0.19 -0.24 2.57 5.85 -0.90 0.29 115.31 123.06 1x12 h LEU 52 Ca 0.10 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1x12 h LEU 52 Cb 0.02 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 1x12 h LEU 52 CO -0.02 -0.10 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.65 1x12 h GLU 53 N -0.14 0.07 -0.69 1.25 4.39 -0.83 0.30 114.58 118.94 1x12 h GLU 53 Ca 0.02 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1x12 h GLU 53 Cb 0.15 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 1x12 h GLU 53 CO -0.05 0.05 0.40 0.87 -1.16 0.00 0.00 179.01 179.12 1x12 h LYS 54 N 0.07 0.94 -0.34 2.33 1.57 -1.00 -1.15 116.57 118.99 1x12 h LYS 54 Ca 0.11 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1x12 h LYS 54 Cb 0.15 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1x12 h LYS 54 CO -0.19 0.69 0.11 1.15 -0.57 0.00 0.00 179.45 180.64 1x12 h THR 55 N 0.94 1.20 -0.67 -0.16 2.02 -0.51 0.32 112.91 116.05 1x12 h THR 55 Ca 0.24 -0.65 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 1x12 h THR 55 Cb 0.00 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1x12 h THR 55 CO -0.04 0.22 0.35 -0.07 0.37 0.00 0.00 175.52 176.35 1x12 h LEU 56 N 0.40 0.86 -0.61 2.58 3.38 -0.73 -0.47 115.31 120.72 1x12 h LEU 56 Ca 0.11 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1x12 h LEU 56 Cb 0.24 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1x12 h LEU 56 CO -0.00 0.72 -0.40 -0.08 0.09 0.00 0.00 178.44 178.77 1x12 h GLU 57 N 0.93 0.65 0.15 1.13 4.81 -1.07 0.46 114.58 121.64 1x12 h GLU 57 Ca 0.23 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1x12 h GLU 57 Cb 0.07 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1x12 h GLU 57 CO -0.03 0.93 -0.07 1.49 -0.73 0.00 0.00 179.01 180.60 1x12 h GLU 58 N 0.54 -0.19 0.09 1.92 4.81 -0.63 -3.36 114.58 117.76 1x12 h GLU 58 Ca 0.05 0.01 -0.32 0.00 -0.13 0.00 0.00 59.36 58.97 1x12 h GLU 58 Cb 0.92 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.32 1x12 h GLU 58 CO 0.08 0.15 -1.69 0.82 -0.73 0.00 0.00 179.01 177.64 1x12 h ILE 59 N -0.56 0.95 -6.05 2.32 2.04 -1.14 -3.49 117.51 111.58 1x12 h ILE 59 Ca -0.02 -2.66 -0.39 0.00 1.00 0.00 0.00 64.86 62.79 1x12 h ILE 59 Cb 0.43 2.61 0.11 0.00 -0.74 0.00 0.00 36.82 39.22 1x12 h ILE 59 CO 0.03 0.76 -0.91 0.29 0.00 0.00 0.00 178.15 178.32 1x12 n LYS 60 N -3.36 -1.88 -1.79 2.37 5.02 0.16 -4.93 118.16 113.75 1x12 n LYS 60 Ca -0.20 0.56 -0.34 0.00 -2.02 0.00 0.00 58.31 56.31 1x12 n LYS 60 Cb 1.04 -4.62 0.05 0.00 -0.02 0.00 0.00 35.03 31.48 1x12 n LYS 60 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1x12 s PRO 61 N -5.64 2.79 0.04 1.97 0.04 -1.26 -4.90 135.00 128.03 1x12 s PRO 61 Ca 0.41 1.49 0.10 0.00 0.04 0.00 0.00 61.00 63.05 1x12 s PRO 61 Cb -0.12 -1.94 -0.21 0.00 0.04 0.00 0.00 34.50 32.26 1x12 s PRO 61 CO 0.83 -1.28 0.95 -0.44 0.04 0.00 0.00 177.00 177.10 1x12 h ASP 62 N 0.18 0.00 -3.67 6.66 3.32 -1.24 -3.32 116.42 118.35 1x12 h ASP 62 Ca -0.47 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.18 1x12 h ASP 62 Cb 1.26 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.49 1x12 h ASP 62 CO 0.54 0.98 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.64 1x12 s ILE 63 N -2.66 0.60 -0.12 0.35 1.01 -1.09 -0.66 121.20 118.63 1x12 s ILE 63 Ca -0.02 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.41 1x12 s ILE 63 Cb 0.09 -0.57 0.02 0.00 0.01 0.00 0.00 42.46 42.00 1x12 s ILE 63 CO 0.82 0.21 -0.15 0.00 0.00 0.00 0.00 174.94 175.83 1x12 s ALA 64 N 0.45 1.72 -0.26 9.38 0.00 -0.26 -0.78 121.76 132.01 1x12 s ALA 64 Ca -0.06 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.14 1x12 s ALA 64 Cb -0.10 -0.90 0.07 0.00 0.00 0.00 0.00 23.12 22.19 1x12 s ALA 64 CO 0.00 -0.18 -0.03 0.42 0.00 0.00 0.00 175.76 175.98 1x12 s ILE 65 N 1.16 1.63 -0.13 0.00 1.01 0.12 -2.00 121.20 122.99 1x12 s ILE 65 Ca -0.03 -1.45 -0.17 0.00 0.00 0.00 0.00 60.65 59.01 1x12 s ILE 65 Cb -0.14 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1x12 s ILE 65 CO -0.04 -0.23 0.41 -1.00 0.00 0.00 0.00 174.94 174.08 1x12 s HIS 66 N 1.32 3.50 0.04 3.97 3.76 -0.69 -2.11 115.29 125.07 1x12 s HIS 66 Ca -0.02 0.79 0.08 0.00 -0.15 0.00 0.00 55.06 55.75 1x12 s HIS 66 Cb -0.19 -2.47 -0.03 0.00 1.11 0.00 0.00 32.58 31.00 1x12 s HIS 66 CO -0.08 0.20 -0.20 0.08 -0.85 0.00 0.00 174.74 173.89 1x12 s VAL 67 N 0.54 2.65 0.18 -0.90 1.01 0.13 -0.72 120.40 123.29 1x12 s VAL 67 Ca 0.23 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 1x12 s VAL 67 Cb -0.14 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.14 1x12 s VAL 67 CO 0.08 0.34 0.38 -0.83 0.00 0.00 0.00 175.10 175.07 1x12 s GLY 68 N -1.40 0.28 -0.04 4.51 0.00 -0.55 -3.98 107.32 106.14 1x12 s GLY 68 Ca 0.14 -0.65 -0.18 0.00 0.00 0.00 0.00 44.72 44.02 1x12 s GLY 68 CO 0.05 -0.63 0.50 -2.27 0.00 0.00 0.00 173.10 170.75 1x12 s LEU 69 N -2.94 4.39 -0.56 0.66 2.96 -1.26 -0.68 118.68 121.25 1x12 s LEU 69 Ca 0.15 0.99 0.04 0.00 -0.22 0.00 0.00 54.13 55.09 1x12 s LEU 69 Cb 0.02 -2.75 0.15 0.00 0.50 0.00 0.00 46.19 44.10 1x12 s LEU 69 CO -0.01 0.13 0.34 0.00 -1.32 0.00 0.00 176.35 175.50 1x12 s ALA 70 N -0.19 3.18 0.04 5.97 0.00 0.19 -4.85 121.76 126.11 1x12 s ALA 70 Ca 0.27 -3.30 -0.36 0.00 0.00 0.00 0.00 51.96 48.56 1x12 s ALA 70 Cb -0.17 -2.09 -0.16 0.00 0.00 0.00 0.00 23.12 20.71 1x12 s ALA 70 CO 0.14 -2.05 1.49 -2.30 0.00 0.00 0.00 175.76 173.03 1x12 n PRO 71 N 2.79 1.46 0.00 0.00 -0.02 -1.26 -1.76 135.00 136.21 1x12 n PRO 71 Ca 0.12 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1x12 n PRO 71 Cb 0.34 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1x12 n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x12 n GLY 72 N 3.09 3.17 3.77 -1.23 0.00 -1.26 -5.03 105.19 107.70 1x12 n GLY 72 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1x12 n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x12 s ARG 73 N -0.40 4.02 0.00 1.61 0.52 -0.72 -4.52 118.95 119.46 1x12 s ARG 73 Ca 0.00 1.74 0.23 0.00 -0.52 0.00 0.00 55.73 57.18 1x12 s ARG 73 Cb 0.00 -2.59 0.11 0.00 0.52 0.00 0.00 34.95 32.99 1x12 s ARG 73 CO 0.00 -0.32 1.14 -1.13 0.02 0.00 0.00 175.30 175.01 1x12 n SER 74 N -0.08 1.14 -3.60 0.23 3.41 -1.26 -4.46 113.62 109.01 1x12 n SER 74 Ca 0.05 -0.95 -0.10 0.00 -0.26 0.00 0.00 58.87 57.61 1x12 n SER 74 Cb 0.48 0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 64.99 1x12 n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x12 s ALA 75 N -2.81 -0.12 0.26 7.33 0.00 -1.26 -4.81 121.76 120.35 1x12 s ALA 75 Ca 0.13 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.80 1x12 s ALA 75 Cb 0.17 1.01 -0.11 0.00 0.00 0.00 0.00 23.12 24.20 1x12 s ALA 75 CO 0.72 -0.87 1.52 0.42 0.00 0.00 0.00 175.76 177.55 1x12 s ILE 76 N -3.45 2.39 -0.05 0.00 -1.09 -0.94 -4.48 121.20 113.58 1x12 s ILE 76 Ca 0.23 0.32 0.03 0.00 -2.23 0.00 0.00 60.65 59.00 1x12 s ILE 76 Cb -0.02 -3.21 0.01 0.00 -1.58 0.00 0.00 42.46 37.66 1x12 s ILE 76 CO 0.12 0.05 -0.14 -0.94 -1.23 0.00 0.00 174.94 172.80 1x12 s SER 77 N 0.51 1.92 -0.27 3.58 1.04 -0.73 -1.21 113.70 118.55 1x12 s SER 77 Ca 0.62 -0.32 -0.08 0.00 0.48 0.00 0.00 55.95 56.65 1x12 s SER 77 Cb -0.45 -0.71 -0.02 0.00 0.10 0.00 0.00 66.02 64.94 1x12 s SER 77 CO 0.44 0.09 0.10 -0.63 0.98 0.00 0.00 173.24 174.22 1x12 s ILE 78 N 0.35 4.47 0.02 -1.02 1.01 -0.17 -0.76 121.20 125.10 1x12 s ILE 78 Ca -0.09 -0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.04 1x12 s ILE 78 Cb -0.13 -3.14 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 1x12 s ILE 78 CO 0.03 0.26 1.32 -1.61 0.00 0.00 0.00 174.94 174.94 1x12 s GLU 79 N 1.63 4.33 0.01 2.79 0.41 -0.30 -0.69 118.70 126.88 1x12 s GLU 79 Ca 0.06 1.88 0.05 0.00 -0.41 0.00 0.00 54.97 56.55 1x12 s GLU 79 Cb -0.16 -3.48 -0.24 0.00 -1.78 0.00 0.00 34.13 28.47 1x12 s GLU 79 CO 0.05 -0.47 0.88 -0.09 -0.49 0.00 0.00 175.26 175.15 1x12 h ARG 80 N 7.41 0.10 -3.56 1.61 2.43 -1.27 -3.41 114.38 117.68 1x12 h ARG 80 Ca -0.38 -0.17 -0.19 0.00 -0.81 0.00 0.00 59.98 58.43 1x12 h ARG 80 Cb 1.19 0.06 -0.25 0.00 -0.42 0.00 0.00 29.97 30.55 1x12 h ARG 80 CO 0.87 0.87 -0.59 -1.50 -1.51 0.00 0.00 179.97 178.12 1x12 s ILE 81 N -2.63 0.03 -0.14 1.20 2.07 -1.26 -1.02 121.20 119.45 1x12 s ILE 81 Ca -0.05 -0.26 -0.03 0.00 -1.41 0.00 0.00 60.65 58.89 1x12 s ILE 81 Cb 0.08 -0.22 -0.03 0.00 0.13 0.00 0.00 42.46 42.42 1x12 s ILE 81 CO 0.83 -0.14 -0.02 0.00 -1.91 0.00 0.00 174.94 173.69 1x12 s ALA 82 N -0.44 3.10 -0.09 1.50 0.00 -0.07 -4.32 121.76 121.43 1x12 s ALA 82 Ca -0.05 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 1x12 s ALA 82 Cb -0.03 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.50 1x12 s ALA 82 CO 0.00 0.32 -0.05 0.08 0.00 0.00 0.00 175.76 176.11 1x12 s VAL 83 N 0.02 3.86 -1.39 0.00 1.01 -1.26 -1.47 120.40 121.16 1x12 s VAL 83 Ca 0.01 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 1x12 s VAL 83 Cb -0.13 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 1x12 s VAL 83 CO 0.02 0.58 2.39 -3.20 0.00 0.00 0.00 175.10 174.89 1x12 n ASN 84 N 2.48 5.13 -3.52 3.32 5.15 0.25 -4.82 115.26 123.25 1x12 n ASN 84 Ca -0.18 -2.72 -0.17 0.00 -0.60 0.00 0.00 54.58 50.92 1x12 n ASN 84 Cb 0.53 -1.53 -0.06 0.00 -0.53 0.00 0.00 39.78 38.19 1x12 n ASN 84 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1x12 s ALA 85 N 3.14 -1.78 -0.10 5.20 0.00 -1.26 -3.95 121.76 123.01 1x12 s ALA 85 Ca 0.54 1.30 0.01 0.00 0.00 0.00 0.00 51.96 53.82 1x12 s ALA 85 Cb 0.15 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.25 1x12 s ALA 85 CO -0.05 -0.39 -0.13 0.42 0.00 0.00 0.00 175.76 175.61 1x12 s ILE 86 N -1.34 1.31 -0.49 0.00 1.01 0.12 -4.77 121.20 117.05 1x12 s ILE 86 Ca -0.09 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.09 1x12 s ILE 86 Cb -0.00 -1.22 0.18 0.00 0.01 0.00 0.00 42.46 41.43 1x12 s ILE 86 CO 0.08 0.41 0.62 -0.62 0.00 0.00 0.00 174.94 175.42 1x12 s ASP 87 N 1.07 -0.64 0.10 3.58 3.68 -0.79 -1.12 116.67 122.56 1x12 s ASP 87 Ca -0.06 -2.09 -0.31 0.00 2.13 0.00 0.00 52.55 52.22 1x12 s ASP 87 Cb -0.15 1.24 -0.07 0.00 -1.45 0.00 0.00 42.92 42.50 1x12 s ASP 87 CO -0.02 -0.09 1.31 0.00 0.13 0.00 0.00 175.17 176.50 1x12 s ALA 88 N 0.67 3.51 0.14 3.66 0.00 -0.05 -4.66 121.76 125.02 1x12 s ALA 88 Ca 0.30 1.01 0.09 0.00 0.00 0.00 0.00 51.96 53.37 1x12 s ALA 88 Cb 0.01 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1x12 s ALA 88 CO -0.09 -0.54 1.40 -0.09 0.00 0.00 0.00 175.76 176.45 1x12 h ARG 89 N 6.70 0.00 -5.00 0.00 2.43 -1.90 -3.45 114.38 113.16 1x12 h ARG 89 Ca -0.42 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.44 1x12 h ARG 89 Cb 1.21 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.61 1x12 h ARG 89 CO 0.84 0.83 -0.71 0.96 -1.51 0.00 0.00 179.97 180.38 1x12 s ILE 90 N -3.01 1.09 0.73 1.20 -4.36 -1.26 -5.15 121.20 110.43 1x12 s ILE 90 Ca 0.01 -2.03 -0.11 0.00 -0.26 0.00 0.00 60.65 58.25 1x12 s ILE 90 Cb 0.11 -1.81 0.03 0.00 1.25 0.00 0.00 42.46 42.03 1x12 s ILE 90 CO 0.79 -0.76 1.07 -2.16 0.24 0.00 0.00 174.94 174.12 1x12 s PRO 91 N -3.74 2.67 0.59 0.37 0.04 -1.26 -4.77 135.00 128.90 1x12 s PRO 91 Ca 0.16 0.77 -0.10 0.00 0.04 0.00 0.00 61.00 61.87 1x12 s PRO 91 Cb 0.03 -1.97 0.14 0.00 0.04 0.00 0.00 34.50 32.73 1x12 s PRO 91 CO -0.00 -1.24 0.76 -0.40 0.04 0.00 0.00 177.00 176.16 1x12 n ASP 92 N -3.20 -0.14 0.00 6.66 3.85 0.19 -4.83 116.55 119.08 1x12 n ASP 92 Ca 0.07 -1.24 0.03 0.00 -0.71 0.00 0.00 54.79 52.94 1x12 n ASP 92 Cb 0.55 -0.59 0.14 0.00 -1.35 0.00 0.00 41.12 39.86 1x12 n ASP 92 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1x12 n ASN 93 N -3.57 0.00 -0.66 -1.12 5.03 0.62 -1.33 115.26 114.24 1x12 n ASN 93 Ca 0.10 0.30 0.08 0.00 0.87 0.00 0.00 54.58 55.93 1x12 n ASN 93 Cb 0.34 -0.36 0.21 0.00 -1.02 0.00 0.00 39.78 38.95 1x12 n ASN 93 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1x12 n GLU 94 N -1.36 2.63 -1.00 3.52 1.02 -1.26 -4.97 120.64 119.22 1x12 n GLU 94 Ca 0.02 -2.59 0.00 0.00 -0.02 0.00 0.00 57.16 54.57 1x12 n GLU 94 Cb 0.05 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 1x12 n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x12 n GLY 95 N -0.51 0.50 3.63 0.62 0.00 -0.44 -5.02 105.19 103.99 1x12 n GLY 95 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1x12 n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x12 s LYS 96 N -0.14 4.12 -0.64 1.61 1.02 -1.26 -4.73 119.74 119.72 1x12 s LYS 96 Ca 0.00 0.41 0.01 0.00 0.02 0.00 0.00 55.97 56.41 1x12 s LYS 96 Cb 0.00 -3.62 0.16 0.00 -0.52 0.00 0.00 37.83 33.85 1x12 s LYS 96 CO 0.00 -0.30 0.43 0.21 -0.92 0.00 0.00 175.35 174.77 1x12 s LYS 97 N 2.14 2.44 0.08 1.68 2.20 -1.26 -0.64 119.74 126.39 1x12 s LYS 97 Ca 0.23 -2.81 -0.30 0.00 -0.36 0.00 0.00 55.97 52.73 1x12 s LYS 97 Cb -0.16 -3.57 -0.05 0.00 -1.51 0.00 0.00 37.83 32.54 1x12 s LYS 97 CO 0.09 -1.18 1.07 0.42 -0.36 0.00 0.00 175.35 175.38 1x12 s ILE 98 N -0.57 4.33 -0.03 5.43 1.01 -1.26 -4.88 121.20 125.22 1x12 s ILE 98 Ca 0.20 1.79 0.05 0.00 0.00 0.00 0.00 60.65 62.69 1x12 s ILE 98 Cb -0.18 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.14 1x12 s ILE 98 CO -0.06 0.21 -0.19 -1.61 0.00 0.00 0.00 174.94 173.30 1x12 s GLU 99 N 0.49 1.74 -0.69 2.79 2.02 -1.26 -0.87 118.70 122.91 1x12 s GLU 99 Ca 0.52 -0.66 -0.11 0.00 0.02 0.00 0.00 54.97 54.74 1x12 s GLU 99 Cb -0.26 -1.57 0.02 0.00 0.10 0.00 0.00 34.13 32.42 1x12 s GLU 99 CO 0.30 0.32 0.59 -0.25 0.02 0.00 0.00 175.26 176.25 1x12 n ASP 100 N 2.90 -4.74 -3.79 -0.19 8.00 -0.27 -4.92 116.55 113.55 1x12 n ASP 100 Ca -0.17 -0.72 -0.13 0.00 0.71 0.00 0.00 54.79 54.49 1x12 n ASP 100 Cb 0.53 -1.51 -0.12 0.00 -0.02 0.00 0.00 41.12 39.99 1x12 n ASP 100 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1x12 s GLU 101 N -4.13 0.22 0.68 -1.24 2.12 -0.98 -4.98 118.70 110.40 1x12 s GLU 101 Ca 0.11 0.32 -0.12 0.00 0.36 0.00 0.00 54.97 55.63 1x12 s GLU 101 Cb -0.01 0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.45 1x12 s GLU 101 CO 0.85 -0.05 1.07 -1.25 -0.54 0.00 0.00 175.26 175.33 1x12 s PRO 102 N 0.32 2.91 -0.09 4.30 0.04 -1.26 0.12 135.00 141.35 1x12 s PRO 102 Ca -0.02 1.07 -0.22 0.00 0.04 0.00 0.00 61.00 61.87 1x12 s PRO 102 Cb -0.03 -1.98 -0.28 0.00 0.04 0.00 0.00 34.50 32.24 1x12 s PRO 102 CO -0.01 -1.12 0.75 0.82 0.04 0.00 0.00 177.00 177.47 1x12 h ILE 103 N -0.46 1.43 -3.23 0.56 2.04 -1.86 -3.44 117.51 112.55 1x12 h ILE 103 Ca -0.45 -2.44 -0.57 0.00 1.00 0.00 0.00 64.86 62.40 1x12 h ILE 103 Cb 1.22 3.07 -0.40 0.00 -0.74 0.00 0.00 36.82 39.97 1x12 h ILE 103 CO 0.56 0.66 -0.76 -0.69 0.00 0.00 0.00 178.15 177.92 1x12 s VAL 104 N -2.39 0.89 0.20 1.67 1.01 -1.26 -5.07 120.40 115.45 1x12 s VAL 104 Ca -0.17 -1.25 -0.32 0.00 0.00 0.00 0.00 61.98 60.24 1x12 s VAL 104 Cb 0.01 -1.58 -0.14 0.00 0.00 0.00 0.00 36.38 34.67 1x12 s VAL 104 CO 0.77 -0.54 1.40 -2.65 0.00 0.00 0.00 175.10 174.08 1x12 n PRO 105 N 4.86 1.87 0.00 2.72 -0.02 -1.26 -1.62 135.00 141.54 1x12 n PRO 105 Ca -0.04 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1x12 n PRO 105 Cb 0.43 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1x12 n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x12 n GLY 106 N 2.43 2.74 3.88 -1.23 0.00 -1.26 -5.02 105.19 106.73 1x12 n GLY 106 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1x12 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x12 s ALA 107 N -2.17 2.70 0.45 4.61 0.00 -0.64 -4.99 121.76 121.72 1x12 s ALA 107 Ca 0.00 -0.45 -0.23 0.00 0.00 0.00 0.00 51.96 51.27 1x12 s ALA 107 Cb 0.00 -3.01 -0.10 0.00 0.00 0.00 0.00 23.12 20.02 1x12 s ALA 107 CO 0.00 -1.44 1.01 -2.30 0.00 0.00 0.00 175.76 173.03 1x12 n PRO 108 N -3.19 1.31 0.18 0.00 -0.02 -1.26 -4.86 135.00 127.15 1x12 n PRO 108 Ca 0.07 0.47 0.13 0.00 -2.02 0.00 0.00 63.50 62.16 1x12 n PRO 108 Cb 0.59 -2.08 0.70 0.00 -0.02 0.00 0.00 33.50 32.69 1x12 n PRO 108 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1x12 h THR 109 N 1.39 0.82 -2.71 3.45 2.02 -1.94 -3.40 112.91 112.54 1x12 h THR 109 Ca -0.45 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.78 1x12 h THR 109 Cb 1.34 0.90 -0.11 0.00 -1.74 0.00 0.00 68.15 68.54 1x12 h THR 109 CO 0.56 0.00 0.33 0.00 0.37 0.00 0.00 175.52 176.78 1x12 s ALA 110 N -4.96 -1.61 -0.01 6.16 0.00 -1.26 -0.58 121.76 119.49 1x12 s ALA 110 Ca -0.05 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.40 1x12 s ALA 110 Cb 0.17 0.71 0.00 0.00 0.00 0.00 0.00 23.12 24.01 1x12 s ALA 110 CO 0.66 -0.82 -0.06 0.71 0.00 0.00 0.00 175.76 176.25 1x12 s TYR 111 N -3.54 0.64 0.24 0.00 1.51 -0.54 -4.99 117.35 110.67 1x12 s TYR 111 Ca 0.05 -0.13 -0.22 0.00 -1.01 0.00 0.00 57.07 55.76 1x12 s TYR 111 Cb -0.02 -0.46 -0.09 0.00 -0.11 0.00 0.00 41.96 41.29 1x12 s TYR 111 CO -0.07 -0.06 0.78 -0.06 -1.11 0.00 0.00 175.55 175.04 1x12 s PHE 112 N 0.12 3.68 0.50 2.71 2.99 -1.26 -0.90 117.98 125.82 1x12 s PHE 112 Ca -0.01 1.51 -0.24 0.00 0.00 0.00 0.00 56.93 58.19 1x12 s PHE 112 Cb -0.06 -2.71 -0.07 0.00 0.00 0.00 0.00 43.02 40.19 1x12 s PHE 112 CO -0.00 0.32 1.38 0.45 -0.00 0.00 0.00 175.22 177.37 1x12 s SER 113 N -1.60 5.60 0.00 1.36 0.15 -0.19 -4.90 113.70 114.12 1x12 s SER 113 Ca 0.44 2.82 0.19 0.00 0.70 0.00 0.00 55.95 60.10 1x12 s SER 113 Cb -0.18 -2.64 0.53 0.00 -1.71 0.00 0.00 66.02 62.03 1x12 s SER 113 CO 0.22 -1.35 1.45 0.35 1.20 0.00 0.00 173.24 175.11 1x12 n THR 114 N -0.59 0.97 -2.43 6.45 -2.24 -0.36 -4.94 114.28 111.14 1x12 n THR 114 Ca 0.08 -0.98 -0.32 0.00 -2.27 0.00 0.00 64.05 60.55 1x12 n THR 114 Cb 0.44 0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 69.16 1x12 n THR 114 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1x12 s LEU 115 N -1.02 3.64 -1.41 3.22 1.43 -1.22 -4.52 118.68 118.80 1x12 s LEU 115 Ca 0.41 1.56 -0.15 0.00 -1.03 0.00 0.00 54.13 54.92 1x12 s LEU 115 Cb 0.21 -4.49 0.05 0.00 0.03 0.00 0.00 46.19 42.00 1x12 s LEU 115 CO 0.28 -0.57 2.10 -0.81 0.23 0.00 0.00 176.35 177.58 1x12 n PRO 116 N -1.54 2.97 -0.30 1.29 -0.04 -1.26 -4.79 135.00 131.33 1x12 n PRO 116 Ca 0.06 -2.80 0.06 0.00 -0.04 0.00 0.00 63.50 60.77 1x12 n PRO 116 Cb 0.54 -3.31 0.20 0.00 -0.04 0.00 0.00 33.50 30.89 1x12 n PRO 116 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 1x12 h ILE 117 N 4.32 0.80 -0.51 0.52 3.07 -1.92 -0.88 117.51 122.91 1x12 h ILE 117 Ca 0.53 -0.24 -0.10 0.00 1.55 0.00 0.00 64.86 66.60 1x12 h ILE 117 Cb 0.69 0.04 -0.02 0.00 -0.27 0.00 0.00 36.82 37.27 1x12 h ILE 117 CO 1.78 0.13 -0.09 0.11 -1.05 0.00 0.00 178.15 179.03 1x12 h LYS 118 N 0.70 0.96 -0.52 0.16 1.79 -2.00 -0.93 116.57 116.74 1x12 h LYS 118 Ca 0.44 -0.35 -0.10 0.00 -2.18 0.00 0.00 60.65 58.46 1x12 h LYS 118 Cb 0.54 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 1x12 h LYS 118 CO -0.31 1.02 -0.07 0.87 -1.08 0.00 0.00 179.45 179.88 1x12 h LYS 119 N 0.83 0.94 -0.25 3.15 1.57 -1.84 -1.07 116.57 119.89 1x12 h LYS 119 Ca 0.13 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1x12 h LYS 119 Cb 0.64 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1x12 h LYS 119 CO 0.04 0.97 0.13 0.82 -0.57 0.00 0.00 179.45 180.84 1x12 h ILE 120 N 0.85 1.14 -0.68 1.86 2.04 -1.01 -0.84 117.51 120.86 1x12 h ILE 120 Ca 0.14 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1x12 h ILE 120 Cb 0.59 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 1x12 h ILE 120 CO 0.04 0.14 0.43 -0.03 0.00 0.00 0.00 178.15 178.73 1x12 h MET 121 N 0.28 0.84 -0.43 2.37 4.05 -0.95 -0.79 114.93 120.31 1x12 h MET 121 Ca 0.09 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 1x12 h MET 121 Cb 0.10 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1x12 h MET 121 CO -0.01 0.55 0.22 -0.22 0.23 0.00 0.00 176.91 177.69 1x12 h LYS 122 N 0.86 0.61 -0.65 0.39 3.11 -0.91 -1.46 116.57 118.53 1x12 h LYS 122 Ca 0.27 -0.08 -0.07 0.00 -2.81 0.00 0.00 60.65 57.96 1x12 h LYS 122 Cb -0.02 -0.12 -0.03 0.00 -1.00 0.00 0.00 32.23 31.07 1x12 h LYS 122 CO -0.09 0.50 0.12 -0.22 -2.81 0.00 0.00 179.45 176.96 1x12 h LYS 123 N 0.56 1.06 -0.51 1.90 1.63 -0.82 -1.78 116.57 118.60 1x12 h LYS 123 Ca 0.15 -0.27 0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1x12 h LYS 123 Cb 0.08 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.55 1x12 h LYS 123 CO -0.02 0.97 0.33 -0.07 -3.45 0.00 0.00 179.45 177.20 1x12 h LEU 124 N 0.98 0.55 -0.96 5.20 3.38 -0.92 -1.93 115.31 121.61 1x12 h LEU 124 Ca 0.20 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.18 1x12 h LEU 124 Cb 0.41 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1x12 h LEU 124 CO 0.01 0.40 0.63 0.45 0.09 0.00 0.00 178.44 180.02 1x12 h HIS 125 N 0.66 1.20 0.00 1.13 3.86 -0.95 0.30 115.15 121.36 1x12 h HIS 125 Ca 0.20 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.42 1x12 h HIS 125 Cb -0.04 -0.40 -0.00 0.00 1.06 0.00 0.00 27.41 28.02 1x12 h HIS 125 CO -0.05 0.74 -0.09 0.93 0.86 0.00 0.00 177.93 180.32 1x12 h GLU 126 N 1.28 0.00 -0.19 2.45 5.08 -0.68 -0.41 114.58 122.10 1x12 h GLU 126 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1x12 h GLU 126 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1x12 h GLU 126 CO -0.09 0.09 0.00 0.54 -1.00 0.00 0.00 179.01 178.55 1x12 n ARG 127 N -3.56 1.90 -1.45 2.33 5.12 -0.24 -4.91 116.66 115.85 1x12 n ARG 127 Ca -0.02 -1.35 -0.04 0.00 -1.93 0.00 0.00 57.85 54.51 1x12 n ARG 127 Cb 0.22 -1.43 -0.01 0.00 -1.16 0.00 0.00 32.46 30.08 1x12 n ARG 127 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1x12 n GLY 128 N 1.22 0.51 3.36 -0.13 0.00 -0.16 -5.02 105.19 104.97 1x12 n GLY 128 Ca 0.17 -0.84 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 1x12 n GLY 128 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x12 s ILE 129 N -2.16 4.37 0.16 -0.61 1.01 -0.07 -5.00 121.20 118.90 1x12 s ILE 129 Ca 0.00 -0.82 -0.32 0.00 0.00 0.00 0.00 60.65 59.52 1x12 s ILE 129 Cb 0.00 -3.39 -0.10 0.00 0.01 0.00 0.00 42.46 38.98 1x12 s ILE 129 CO 0.00 -0.14 1.59 -2.16 0.00 0.00 0.00 174.94 174.23 1x12 s PRO 130 N 1.53 4.21 -0.03 2.79 0.04 -1.26 -3.53 135.00 138.74 1x12 s PRO 130 Ca 0.02 2.38 -0.24 0.00 0.04 0.00 0.00 61.00 63.20 1x12 s PRO 130 Cb -0.19 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.22 1x12 s PRO 130 CO 0.05 -0.63 0.52 0.00 0.04 0.00 0.00 177.00 176.99 1x12 s ALA 131 N 1.27 -1.35 0.20 8.56 0.00 -1.26 -2.22 121.76 126.97 1x12 s ALA 131 Ca 0.71 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 53.47 1x12 s ALA 131 Cb -0.44 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1x12 s ALA 131 CO 0.31 -0.33 0.33 1.52 0.00 0.00 0.00 175.76 177.59 1x12 s TYR 132 N -1.27 0.55 -0.19 0.00 -0.85 -0.35 -4.96 117.35 110.28 1x12 s TYR 132 Ca -0.12 -0.89 -0.19 0.00 -0.52 0.00 0.00 57.07 55.35 1x12 s TYR 132 Cb -0.02 -0.07 -0.03 0.00 0.38 0.00 0.00 41.96 42.21 1x12 s TYR 132 CO 0.07 -0.81 0.56 0.42 -1.52 0.00 0.00 175.55 174.28 1x12 s ILE 133 N -4.03 5.08 -0.07 -3.49 -1.09 -1.26 -1.00 121.20 115.34 1x12 s ILE 133 Ca 0.24 1.05 -0.11 0.00 -2.23 0.00 0.00 60.65 59.60 1x12 s ILE 133 Cb 0.03 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 36.98 1x12 s ILE 133 CO 0.06 0.16 0.27 -0.55 -1.23 0.00 0.00 174.94 173.66 1x12 s SER 134 N 1.13 6.59 0.00 3.58 0.15 0.14 -4.88 113.70 120.40 1x12 s SER 134 Ca 0.26 0.70 0.21 0.00 0.70 0.00 0.00 55.95 57.83 1x12 s SER 134 Cb -0.16 -2.16 0.47 0.00 -1.71 0.00 0.00 66.02 62.47 1x12 s SER 134 CO 0.10 0.36 1.41 0.59 1.20 0.00 0.00 173.24 176.90 1x12 n ASN 135 N 1.96 3.52 -3.66 5.45 5.03 -1.26 -0.75 115.26 125.55 1x12 n ASN 135 Ca -0.17 -1.97 -0.06 0.00 0.87 0.00 0.00 54.58 53.25 1x12 n ASN 135 Cb 0.54 -0.32 -0.07 0.00 -1.02 0.00 0.00 39.78 38.91 1x12 n ASN 135 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1x12 s SER 136 N -1.26 -0.75 -0.09 6.41 0.15 -1.26 -4.70 113.70 112.20 1x12 s SER 136 Ca 0.39 1.29 0.13 0.00 0.70 0.00 0.00 55.95 58.46 1x12 s SER 136 Cb 0.22 1.65 0.53 0.00 -1.71 0.00 0.00 66.02 66.71 1x12 s SER 136 CO 0.30 -0.22 1.39 0.00 1.20 0.00 0.00 173.24 175.90 1x12 n ALA 137 N 5.09 3.01 0.00 5.45 0.00 -1.26 -5.04 120.51 127.76 1x12 n ALA 137 Ca -0.14 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 52.14 1x12 n ALA 137 Cb 0.52 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1x12 n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x12 n GLY 138 N 0.84 -2.22 1.83 0.00 0.00 -1.26 -3.80 105.19 100.58 1x12 n GLY 138 Ca 0.19 -1.55 -0.04 0.00 0.00 0.00 0.00 46.02 44.61 1x12 n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x12 n LEU 139 N 0.00 2.56 0.00 0.99 4.77 -1.26 -4.52 117.00 119.53 1x12 n LEU 139 Ca 0.00 -3.42 0.00 0.00 -0.03 0.00 0.00 56.01 52.56 1x12 n LEU 139 Cb 0.00 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1x12 n LEU 139 CO 0.00 1.27 0.00 0.00 -1.33 0.00 0.00 177.39 177.33 1x12 n TYR 140 N -0.48 0.00 0.12 -1.77 9.36 -1.26 -1.88 117.16 121.24 1x12 n TYR 140 Ca 0.19 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.38 1x12 n TYR 140 Cb 0.90 0.00 0.17 0.00 -0.63 0.00 0.00 39.34 39.78 1x12 n TYR 140 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1x12 h LEU 141 N 0.00 0.13 0.10 2.98 3.38 -1.96 -2.34 115.31 117.60 1x12 h LEU 141 Ca 0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1x12 h LEU 141 Cb 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1x12 h LEU 141 CO 0.00 0.68 -0.05 0.28 0.09 0.00 0.00 178.44 179.45 1x12 h SER 142 N 0.09 -0.11 -0.65 -0.43 0.02 -1.95 -0.84 113.55 109.67 1x12 h SER 142 Ca -0.00 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 1x12 h SER 142 Cb 1.05 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.59 1x12 h SER 142 CO 0.08 -0.03 0.23 -1.13 -1.14 0.00 0.00 176.83 174.85 1x12 h ASN 143 N -0.18 0.94 0.07 3.07 -1.24 -1.65 -0.77 115.58 115.82 1x12 h ASN 143 Ca -0.01 -0.15 0.02 0.00 0.71 0.00 0.00 56.30 56.87 1x12 h ASN 143 Cb 0.15 -0.25 -0.04 0.00 0.73 0.00 0.00 38.32 38.91 1x12 h ASN 143 CO 0.02 0.87 -0.27 0.22 -1.29 0.00 0.00 177.43 176.98 1x12 h TYR 144 N 0.99 -0.74 -0.40 0.67 3.20 -1.06 0.10 116.97 119.74 1x12 h TYR 144 Ca 0.22 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.98 1x12 h TYR 144 Cb 0.25 0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1x12 h TYR 144 CO 0.02 -0.37 -0.26 -0.39 -1.64 0.00 0.00 178.16 175.51 1x12 h VAL 145 N -0.46 1.27 -0.54 1.81 -1.51 -1.02 -2.01 116.25 113.80 1x12 h VAL 145 Ca 0.04 -1.41 0.01 0.00 -1.23 0.00 0.00 66.70 64.11 1x12 h VAL 145 Cb 0.51 1.25 -0.03 0.00 -2.13 0.00 0.00 31.29 30.89 1x12 h VAL 145 CO -0.19 0.47 0.35 -0.03 -1.23 0.00 0.00 177.57 176.95 1x12 h MET 146 N 0.72 0.70 -0.13 5.19 1.85 -0.79 -0.88 114.93 121.59 1x12 h MET 146 Ca 0.09 -0.04 -0.02 0.00 -0.61 0.00 0.00 59.70 59.12 1x12 h MET 146 Cb 0.81 -0.16 -0.00 0.00 0.43 0.00 0.00 31.60 32.67 1x12 h MET 146 CO 0.07 0.46 -0.00 -0.92 -0.40 0.00 0.00 176.91 176.12 1x12 h TYR 147 N 0.72 0.25 -0.75 1.39 3.20 -0.71 -2.21 116.97 118.86 1x12 h TYR 147 Ca 0.20 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1x12 h TYR 147 Cb -0.08 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 1x12 h TYR 147 CO -0.04 0.47 0.48 -0.07 -1.64 0.00 0.00 178.16 177.36 1x12 h LEU 148 N -0.04 0.87 -0.23 2.82 3.38 -1.24 0.13 115.31 121.00 1x12 h LEU 148 Ca 0.04 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1x12 h LEU 148 Cb 0.37 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1x12 h LEU 148 CO 0.01 0.64 -0.02 -1.28 0.09 0.00 0.00 178.44 177.88 1x12 h SER 149 N 1.02 0.41 -0.02 -0.43 0.87 -1.07 -0.31 113.55 114.02 1x12 h SER 149 Ca 0.27 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.42 1x12 h SER 149 Cb -0.09 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 1x12 h SER 149 CO -0.06 0.64 -0.23 -0.07 -0.53 0.00 0.00 176.83 176.59 1x12 h LEU 150 N 0.17 0.40 -0.66 2.23 3.38 -1.00 -1.68 115.31 118.16 1x12 h LEU 150 Ca 0.06 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 1x12 h LEU 150 Cb 0.44 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1x12 h LEU 150 CO 0.02 0.64 -0.31 -0.74 0.09 0.00 0.00 178.44 178.14 1x12 h HIS 151 N 0.37 0.82 -0.64 1.13 2.76 -0.59 -1.41 115.15 117.60 1x12 h HIS 151 Ca 0.06 -0.21 -0.03 0.00 -2.20 0.00 0.00 60.37 57.99 1x12 h HIS 151 Cb 0.60 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 1x12 h HIS 151 CO 0.02 0.93 0.30 1.25 -1.30 0.00 0.00 177.93 179.12 1x12 h HIS 152 N 0.60 0.94 -0.42 5.26 6.17 -0.56 -0.76 115.15 126.39 1x12 h HIS 152 Ca 0.07 -0.05 -0.01 0.00 0.71 0.00 0.00 60.37 61.08 1x12 h HIS 152 Cb 0.82 -0.29 -0.02 0.00 2.52 0.00 0.00 27.41 30.44 1x12 h HIS 152 CO 0.04 0.71 0.20 1.03 0.71 0.00 0.00 177.93 180.63 1x12 h SER 153 N 0.89 0.54 -0.11 3.26 0.87 -1.01 0.34 113.55 118.32 1x12 h SER 153 Ca 0.22 -0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.57 1x12 h SER 153 Cb 0.14 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1x12 h SER 153 CO -0.03 0.51 -0.18 0.00 -0.53 0.00 0.00 176.83 176.61 1x12 h ALA 154 N 1.05 1.17 0.00 6.23 0.00 -0.90 -0.81 119.26 125.99 1x12 h ALA 154 Ca 0.14 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 1x12 h ALA 154 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1x12 h ALA 154 CO -0.02 0.53 -1.91 0.25 0.00 0.00 0.00 179.25 178.10 1x12 n THR 155 N -4.16 0.87 0.42 0.00 -2.24 -0.32 -4.53 114.28 104.31 1x12 n THR 155 Ca 0.00 -0.68 0.05 0.00 -2.27 0.00 0.00 64.05 61.15 1x12 n THR 155 Cb 0.36 -0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.12 1x12 n THR 155 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1x12 n LYS 156 N -2.64 3.00 -0.43 -0.78 4.76 0.12 -5.01 118.16 117.18 1x12 n LYS 156 Ca -0.15 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1x12 n LYS 156 Cb 0.85 -1.04 0.00 0.00 -1.84 0.00 0.00 35.03 33.00 1x12 n LYS 156 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x12 n GLY 157 N 1.35 1.18 3.32 0.72 0.00 -0.31 -5.00 105.19 106.44 1x12 n GLY 157 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 1x12 n GLY 157 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1x12 s TYR 158 N -3.08 -0.35 0.73 1.61 -0.85 -1.25 -4.38 117.35 109.78 1x12 s TYR 158 Ca 0.00 0.68 -0.13 0.00 -0.52 0.00 0.00 57.07 57.10 1x12 s TYR 158 Cb 0.00 0.17 0.03 0.00 0.38 0.00 0.00 41.96 42.55 1x12 s TYR 158 CO 0.00 -0.39 1.11 -1.25 -1.52 0.00 0.00 175.55 173.50 1x12 s PRO 159 N -0.87 2.43 0.20 -3.49 0.04 -1.25 -3.46 135.00 128.60 1x12 s PRO 159 Ca -0.09 1.31 -0.06 0.00 0.04 0.00 0.00 61.00 62.20 1x12 s PRO 159 Cb -0.04 -1.91 0.14 0.00 0.04 0.00 0.00 34.50 32.74 1x12 s PRO 159 CO 0.04 -1.53 1.64 0.87 0.04 0.00 0.00 177.00 178.06 1x12 h LYS 160 N -0.61 0.91 -5.66 4.56 1.57 -1.09 -3.42 116.57 112.83 1x12 h LYS 160 Ca -0.45 -0.33 -0.56 0.00 -1.87 0.00 0.00 60.65 57.45 1x12 h LYS 160 Cb 1.24 -0.06 -0.30 0.00 0.08 0.00 0.00 32.23 33.20 1x12 h LYS 160 CO 0.52 0.98 -0.84 -1.64 -0.57 0.00 0.00 179.45 177.90 1x12 s MET 161 N -4.79 1.50 -0.08 3.15 -1.94 -0.93 -4.95 119.30 111.26 1x12 s MET 161 Ca -0.10 -0.64 -0.11 0.00 -1.71 0.00 0.00 55.69 53.13 1x12 s MET 161 Cb 0.13 -1.43 0.03 0.00 2.01 0.00 0.00 34.83 35.57 1x12 s MET 161 CO 0.85 0.37 0.29 0.45 -0.01 0.00 0.00 175.02 176.97 1x12 s SER 162 N -0.36 -0.26 0.24 3.03 0.15 -1.26 -1.10 113.70 114.14 1x12 s SER 162 Ca 0.05 0.43 -0.20 0.00 0.70 0.00 0.00 55.95 56.93 1x12 s SER 162 Cb -0.08 0.52 0.07 0.00 -1.71 0.00 0.00 66.02 64.83 1x12 s SER 162 CO -0.00 -0.21 0.98 -0.83 1.20 0.00 0.00 173.24 174.38 1x12 s GLY 163 N -0.30 0.21 -0.00 9.45 0.00 -0.85 -1.22 107.32 114.61 1x12 s GLY 163 Ca -0.04 -0.49 0.02 0.00 0.00 0.00 0.00 44.72 44.21 1x12 s GLY 163 CO 0.01 1.92 -0.06 -0.12 0.00 0.00 0.00 173.10 174.85 1x12 s PHE 164 N -2.10 0.57 -0.08 1.90 2.19 -1.26 -1.70 117.98 117.49 1x12 s PHE 164 Ca 0.21 -0.13 0.02 0.00 0.33 0.00 0.00 56.93 57.36 1x12 s PHE 164 Cb -0.03 -0.36 0.01 0.00 -1.31 0.00 0.00 43.02 41.33 1x12 s PHE 164 CO 0.07 -0.01 -0.13 0.42 1.83 0.00 0.00 175.22 177.40 1x12 s ILE 165 N -0.23 1.24 -0.06 3.12 1.01 0.10 -1.15 121.20 125.23 1x12 s ILE 165 Ca 0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 1x12 s ILE 165 Cb -0.03 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1x12 s ILE 165 CO -0.00 0.39 0.05 -1.00 0.00 0.00 0.00 174.94 174.37 1x12 s HIS 166 N 0.84 3.28 0.16 3.97 3.76 0.07 -1.48 115.29 125.89 1x12 s HIS 166 Ca -0.11 0.26 0.11 0.00 -0.15 0.00 0.00 55.06 55.17 1x12 s HIS 166 Cb -0.15 -1.80 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 1x12 s HIS 166 CO 0.01 0.55 -0.25 0.14 -0.85 0.00 0.00 174.74 174.34 1x12 s VAL 167 N -1.01 2.34 1.07 -0.90 -7.23 0.14 -1.77 120.40 113.04 1x12 s VAL 167 Ca 0.17 -1.89 -0.17 0.00 -1.81 0.00 0.00 61.98 58.28 1x12 s VAL 167 Cb -0.12 -2.08 0.23 0.00 0.56 0.00 0.00 36.38 34.97 1x12 s VAL 167 CO 0.06 -0.02 1.20 -2.84 -0.31 0.00 0.00 175.10 173.20 1x12 s PRO 168 N -2.38 -0.17 0.76 4.82 0.02 -1.26 -0.63 135.00 136.15 1x12 s PRO 168 Ca 0.18 -0.16 -0.14 0.00 0.02 0.00 0.00 61.00 60.90 1x12 s PRO 168 Cb -0.09 -1.73 0.06 0.00 0.02 0.00 0.00 34.50 32.76 1x12 s PRO 168 CO 0.08 -3.00 1.18 0.71 -0.33 0.00 0.00 177.00 175.65 1x12 s TYR 169 N -3.39 2.03 0.23 6.54 2.02 -1.26 -4.69 117.35 118.82 1x12 s TYR 169 Ca 0.71 1.63 -0.02 0.00 -0.37 0.00 0.00 57.07 59.02 1x12 s TYR 169 Cb -0.08 -3.41 -0.05 0.00 -0.40 0.00 0.00 41.96 38.02 1x12 s TYR 169 CO 0.54 -2.55 0.44 0.96 -1.57 0.00 0.00 175.55 173.37 1x12 s ILE 170 N -2.17 5.15 0.30 2.71 -4.36 -1.26 -1.14 121.20 120.43 1x12 s ILE 170 Ca 0.72 -0.23 -0.02 0.00 -0.26 0.00 0.00 60.65 60.86 1x12 s ILE 170 Cb -0.27 -3.73 0.43 0.00 1.25 0.00 0.00 42.46 40.15 1x12 s ILE 170 CO 0.48 -0.21 1.57 -0.65 0.24 0.00 0.00 174.94 176.36 1x12 h PRO 171 N 1.93 0.00 -0.02 0.37 0.11 -1.91 -0.56 132.00 131.93 1x12 h PRO 171 Ca -0.48 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.64 1x12 h PRO 171 Cb 1.19 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1x12 h PRO 171 CO 0.68 0.00 0.03 1.05 -0.21 0.00 0.00 178.00 179.55 1x12 h GLU 172 N 0.00 0.00 0.00 1.05 4.11 -1.96 -0.46 114.58 117.32 1x12 h GLU 172 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.98 1x12 h GLU 172 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1x12 h GLU 172 CO -0.97 0.00 0.00 1.04 0.07 0.00 0.00 179.01 179.15 1x12 n GLN 173 N -3.61 0.19 0.09 1.06 6.02 -0.22 -3.35 117.38 117.56 1x12 n GLN 173 Ca -0.02 0.23 0.02 0.00 -0.01 0.00 0.00 57.00 57.21 1x12 n GLN 173 Cb 0.11 -1.76 -0.02 0.00 1.02 0.00 0.00 30.24 29.59 1x12 n GLN 173 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1x12 h ILE 174 N 0.00 0.64 -0.32 5.09 1.08 -1.17 -3.40 117.51 119.44 1x12 h ILE 174 Ca 0.00 -2.04 0.06 0.00 -0.39 0.00 0.00 64.86 62.49 1x12 h ILE 174 Cb 0.59 2.19 -0.08 0.00 -3.07 0.00 0.00 36.82 36.45 1x12 h ILE 174 CO 0.00 0.37 -0.47 0.40 -0.69 0.00 0.00 178.15 177.76 1x12 h ILE 175 N 0.00 0.08 0.00 -0.67 1.08 -1.62 -0.09 117.51 116.29 1x12 h ILE 175 Ca -0.07 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1x12 h ILE 175 Cb 1.45 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1x12 h ILE 175 CO 0.05 0.00 0.00 0.44 -0.69 0.00 0.00 178.15 177.95 1x12 h ASP 176 N -0.41 0.00 0.62 1.72 3.32 -1.81 -2.27 116.42 117.59 1x12 h ASP 176 Ca 0.10 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 1x12 h ASP 176 Cb 0.61 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1x12 h ASP 176 CO -0.53 0.00 -0.68 0.11 -1.72 0.00 0.00 179.24 176.42 1x12 h LYS 177 N 0.00 0.06 -6.60 3.56 1.79 -1.23 -3.40 116.57 110.75 1x12 h LYS 177 Ca 0.00 -0.05 -0.53 0.00 -2.18 0.00 0.00 60.65 57.90 1x12 h LYS 177 Cb 0.30 0.01 0.04 0.00 -1.58 0.00 0.00 32.23 31.00 1x12 h LYS 177 CO 0.00 0.72 0.80 0.42 -1.08 0.00 0.00 179.45 180.31 1x12 s ILE 178 N -3.49 2.91 0.00 1.86 1.01 -0.86 -1.69 121.20 120.94 1x12 s ILE 178 Ca -0.02 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.30 1x12 s ILE 178 Cb 0.12 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 39.16 1x12 s ILE 178 CO 0.78 0.06 0.00 0.61 0.00 0.00 0.00 174.94 176.39 1x12 n GLY 179 N 3.44 2.96 0.00 6.18 0.00 -1.26 -4.78 105.19 111.73 1x12 n GLY 179 Ca 0.12 -0.49 0.06 0.00 0.00 0.00 0.00 46.02 45.70 1x12 n GLY 179 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x12 n LYS 180 N 0.00 0.34 -0.44 1.61 5.02 -0.68 -4.77 118.16 119.24 1x12 n LYS 180 Ca 0.00 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1x12 n LYS 180 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1x12 n LYS 180 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x12 n GLY 181 N -0.31 1.61 0.00 0.72 0.00 -1.25 -5.09 105.19 100.87 1x12 n GLY 181 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1x12 n GLY 181 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1x12 n GLN 182 N -0.95 0.00 -3.83 1.61 -0.06 -1.25 -5.11 117.38 107.78 1x12 n GLN 182 Ca 0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.70 1x12 n GLN 182 Cb 0.11 0.00 -0.14 0.00 -4.06 0.00 0.00 30.24 26.15 1x12 n GLN 182 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1x12 s VAL 183 N -1.53 2.01 0.72 1.69 1.01 -1.26 -3.87 120.40 119.17 1x12 s VAL 183 Ca 0.00 -2.95 -0.14 0.00 0.00 0.00 0.00 61.98 58.89 1x12 s VAL 183 Cb 0.00 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 34.01 1x12 s VAL 183 CO 0.00 -0.85 1.16 -2.84 0.00 0.00 0.00 175.10 172.57 1x12 s PRO 184 N 0.02 2.33 0.77 2.72 0.02 -1.26 -5.00 135.00 134.59 1x12 s PRO 184 Ca 0.17 1.56 -0.12 0.00 0.02 0.00 0.00 61.00 62.64 1x12 s PRO 184 Cb -0.25 -1.88 0.06 0.00 0.02 0.00 0.00 34.50 32.45 1x12 s PRO 184 CO 0.00 -1.65 1.12 -2.14 -0.33 0.00 0.00 177.00 174.00 1x12 s PRO 185 N -4.09 2.14 0.14 5.54 0.02 -1.26 -4.99 135.00 132.49 1x12 s PRO 185 Ca 0.70 1.34 -0.08 0.00 0.02 0.00 0.00 61.00 62.97 1x12 s PRO 185 Cb -0.24 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.39 1x12 s PRO 185 CO 0.45 -1.76 0.24 -1.54 -0.33 0.00 0.00 177.00 174.07 1x12 s SER 186 N -2.98 0.08 -0.07 2.53 1.04 -1.26 -4.18 113.70 108.87 1x12 s SER 186 Ca 0.64 -0.83 -0.06 0.00 0.48 0.00 0.00 55.95 56.18 1x12 s SER 186 Cb -0.20 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.34 1x12 s SER 186 CO 0.52 -0.84 0.19 -0.32 0.98 0.00 0.00 173.24 173.77 1x12 s MET 187 N -3.94 0.22 0.59 4.02 1.75 -0.29 -4.90 119.30 116.74 1x12 s MET 187 Ca 0.14 0.25 -0.20 0.00 -1.25 0.00 0.00 55.69 54.64 1x12 s MET 187 Cb 0.04 0.11 -0.04 0.00 2.84 0.00 0.00 34.83 37.78 1x12 s MET 187 CO -0.03 -0.03 1.27 -1.13 -0.65 0.00 0.00 175.02 174.46 1x12 n SER 188 N 2.97 2.17 -0.30 1.11 3.41 -1.26 -4.14 113.62 117.58 1x12 n SER 188 Ca -0.13 0.90 -0.04 0.00 -0.26 0.00 0.00 58.87 59.34 1x12 n SER 188 Cb 0.59 -1.54 0.09 0.00 -0.26 0.00 0.00 64.21 63.09 1x12 n SER 188 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1x12 h TYR 189 N 0.99 1.20 -0.81 7.33 3.20 -1.98 -2.33 116.97 124.57 1x12 h TYR 189 Ca -0.50 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.35 1x12 h TYR 189 Cb 1.33 -0.37 -0.05 0.00 1.54 0.00 0.00 36.73 39.17 1x12 h TYR 189 CO 0.43 0.87 0.51 0.93 -1.64 0.00 0.00 178.16 179.26 1x12 h GLU 190 N 1.18 0.95 -0.56 1.82 3.07 -2.00 -0.10 114.58 118.94 1x12 h GLU 190 Ca 0.28 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.36 58.98 1x12 h GLU 190 Cb 0.13 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 1x12 h GLU 190 CO -0.03 0.63 -0.06 1.98 -1.40 0.00 0.00 179.01 180.12 1x12 h MET 191 N 0.98 1.02 -0.09 2.33 4.05 -1.84 -2.08 114.93 119.30 1x12 h MET 191 Ca 0.34 -0.35 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1x12 h MET 191 Cb 0.06 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 30.78 1x12 h MET 191 CO -0.13 1.04 0.05 -0.44 0.23 0.00 0.00 176.91 177.66 1x12 h ASP 192 N 0.92 0.10 -0.43 1.39 3.32 -0.82 -0.22 116.42 120.69 1x12 h ASP 192 Ca 0.15 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.21 1x12 h ASP 192 Cb 0.62 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1x12 h ASP 192 CO 0.04 0.10 0.23 0.25 -1.72 0.00 0.00 179.24 178.13 1x12 h LEU 193 N 0.10 0.34 -0.84 1.55 5.85 -0.95 -1.39 115.31 119.97 1x12 h LEU 193 Ca 0.03 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1x12 h LEU 193 Cb 0.01 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1x12 h LEU 193 CO -0.01 0.24 0.32 -0.08 -0.34 0.00 0.00 178.44 178.58 1x12 h GLU 194 N 0.46 1.17 -0.54 1.25 4.57 -1.18 -1.70 114.58 118.60 1x12 h GLU 194 Ca 0.18 -0.21 0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1x12 h GLU 194 Cb 0.07 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1x12 h GLU 194 CO -0.11 0.94 0.35 0.00 -1.18 0.00 0.00 179.01 179.01 1x12 h ALA 195 N 1.20 0.69 -0.62 2.92 0.00 -0.38 0.70 119.26 123.77 1x12 h ALA 195 Ca 0.26 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 1x12 h ALA 195 Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1x12 h ALA 195 CO -0.02 0.11 0.05 0.28 0.00 0.00 0.00 179.25 179.67 1x12 h VAL 196 N 0.72 1.26 -0.59 0.00 2.07 -0.97 -0.78 116.25 117.97 1x12 h VAL 196 Ca 0.20 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1x12 h VAL 196 Cb -0.07 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1x12 h VAL 196 CO -0.05 0.40 0.31 0.11 0.02 0.00 0.00 177.57 178.36 1x12 h LYS 197 N 0.98 0.84 -0.62 1.57 1.57 -0.79 -1.31 116.57 118.80 1x12 h LYS 197 Ca 0.18 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1x12 h LYS 197 Cb 0.51 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1x12 h LYS 197 CO 0.02 0.65 0.38 0.28 -0.57 0.00 0.00 179.45 180.21 1x12 h VAL 198 N 0.80 1.18 -0.68 0.50 2.07 -0.58 -1.18 116.25 118.36 1x12 h VAL 198 Ca 0.21 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.34 1x12 h VAL 198 Cb 0.07 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1x12 h VAL 198 CO -0.03 0.19 0.44 0.00 0.02 0.00 0.00 177.57 178.19 1x12 h ALA 199 N 1.19 0.87 -0.16 1.67 0.00 -0.68 -0.75 119.26 121.41 1x12 h ALA 199 Ca 0.22 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1x12 h ALA 199 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1x12 h ALA 199 CO -0.04 0.25 0.08 0.82 0.00 0.00 0.00 179.25 180.36 1x12 h ILE 200 N 0.89 1.11 -0.46 0.00 2.04 -0.84 -0.49 117.51 119.75 1x12 h ILE 200 Ca 0.26 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1x12 h ILE 200 Cb -0.06 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1x12 h ILE 200 CO -0.07 0.10 0.28 -0.33 0.00 0.00 0.00 178.15 178.12 1x12 h GLU 201 N 0.14 0.54 -0.63 2.37 5.08 -0.90 0.33 114.58 121.51 1x12 h GLU 201 Ca 0.05 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 1x12 h GLU 201 Cb 0.09 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1x12 h GLU 201 CO -0.01 0.36 0.03 0.28 -1.00 0.00 0.00 179.01 178.67 1x12 h VAL 202 N 0.56 1.27 -0.40 3.13 2.07 -1.02 -0.35 116.25 121.50 1x12 h VAL 202 Ca 0.18 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 1x12 h VAL 202 Cb 0.01 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1x12 h VAL 202 CO -0.08 0.41 0.17 0.00 0.02 0.00 0.00 177.57 178.09 1x12 h ALA 203 N 1.02 0.52 -0.23 1.67 0.00 -0.69 -1.65 119.26 119.91 1x12 h ALA 203 Ca 0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1x12 h ALA 203 Cb 0.53 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1x12 h ALA 203 CO 0.03 0.12 0.14 -0.07 0.00 0.00 0.00 179.25 179.47 1x12 h LEU 204 N 0.51 0.28 -2.16 0.00 3.38 -0.70 -1.78 115.31 114.84 1x12 h LEU 204 Ca 0.14 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1x12 h LEU 204 Cb 0.18 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1x12 h LEU 204 CO -0.01 0.24 -0.00 -0.33 0.09 0.00 0.00 178.44 178.43 1x12 h GLU 205 N 0.29 0.00 -0.15 1.13 5.08 -0.91 -0.20 114.58 119.81 1x12 h GLU 205 Ca 0.08 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.25 1x12 h GLU 205 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1x12 h GLU 205 CO -0.02 0.00 -0.69 1.49 -1.00 0.00 0.00 179.01 178.80 1x12 h GLU 206 N 0.00 0.63 0.00 2.33 4.57 -0.49 -3.05 114.58 118.56 1x12 h GLU 206 Ca -0.00 -0.47 -0.01 0.00 -1.18 0.00 0.00 59.36 57.70 1x12 h GLU 206 Cb 0.00 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.68 1x12 h GLU 206 CO 0.00 1.09 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.81 1x12 h LEU 207 N 0.45 0.00 0.00 1.64 3.38 -0.45 -3.51 115.31 116.81 1x12 h LEU 207 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1x12 h LEU 207 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1x12 h LEU 207 CO 0.13 0.04 0.00 0.18 0.09 0.00 0.00 178.44 178.88