#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tc2 h GLU 6 N 0.00 0.00 -0.01 -0.72 4.39 -2.05 -2.51 114.58 113.68 1tc2 h GLU 6 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1tc2 h GLU 6 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1tc2 h GLU 6 CO 0.00 0.06 -0.01 1.97 -1.16 0.00 0.00 179.01 179.87 1tc2 n PHE 7 N -3.25 0.00 -4.35 4.33 1.16 -1.26 -4.88 117.46 109.22 1tc2 n PHE 7 Ca -0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.26 1tc2 n PHE 7 Cb 0.26 -0.02 -0.10 0.00 -1.61 0.00 0.00 39.48 38.02 1tc2 n PHE 7 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1tc2 s ALA 8 N -2.05 3.08 -0.81 1.98 0.00 -0.95 -0.76 121.76 122.26 1tc2 s ALA 8 Ca 0.42 -1.06 0.17 0.00 0.00 0.00 0.00 51.96 51.49 1tc2 s ALA 8 Cb 0.21 -1.13 -0.19 0.00 0.00 0.00 0.00 23.12 22.02 1tc2 s ALA 8 CO 0.36 0.64 0.73 -0.85 0.00 0.00 0.00 175.76 176.64 1tc2 n GLU 9 N 1.24 1.26 -3.59 0.00 0.28 -0.34 -4.73 120.64 114.76 1tc2 n GLU 9 Ca -0.14 -0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.77 1tc2 n GLU 9 Cb 0.52 -1.32 -0.05 0.00 1.43 0.00 0.00 31.44 32.03 1tc2 n GLU 9 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 1tc2 s LYS 10 N -2.64 0.48 -0.21 3.44 2.20 -1.25 -5.00 119.74 116.75 1tc2 s LYS 10 Ca 0.06 0.08 -0.11 0.00 -0.36 0.00 0.00 55.97 55.64 1tc2 s LYS 10 Cb 0.13 0.23 -0.05 0.00 -1.51 0.00 0.00 37.83 36.63 1tc2 s LYS 10 CO 0.71 -0.16 0.20 0.42 -0.36 0.00 0.00 175.35 176.16 1tc2 s ILE 11 N -1.25 5.35 -0.15 5.43 -1.09 -1.26 -1.19 121.20 127.04 1tc2 s ILE 11 Ca 0.01 0.30 -0.11 0.00 -2.23 0.00 0.00 60.65 58.62 1tc2 s ILE 11 Cb -0.01 -3.53 -0.05 0.00 -1.58 0.00 0.00 42.46 37.29 1tc2 s ILE 11 CO -0.01 0.38 -0.17 0.18 -1.23 0.00 0.00 174.94 174.08 1tc2 n LEU 12 N 3.93 1.83 -3.89 2.97 4.77 -0.07 -4.96 117.00 121.57 1tc2 n LEU 12 Ca -0.14 0.58 -0.14 0.00 -0.03 0.00 0.00 56.01 56.28 1tc2 n LEU 12 Cb 0.52 -0.86 -0.14 0.00 -2.33 0.00 0.00 43.42 40.60 1tc2 n LEU 12 CO 0.37 -0.38 -0.37 -0.36 -1.33 0.00 0.00 177.39 175.32 1tc2 s PHE 13 N -2.33 0.18 0.59 -1.77 0.40 -0.98 -5.02 117.98 109.06 1tc2 s PHE 13 Ca -0.18 -0.02 -0.06 0.00 -0.60 0.00 0.00 56.93 56.07 1tc2 s PHE 13 Cb 0.03 -0.15 0.01 0.00 0.51 0.00 0.00 43.02 43.42 1tc2 s PHE 13 CO 0.28 -0.02 0.90 0.95 0.70 0.00 0.00 175.22 178.03 1tc2 s THR 14 N 0.09 3.55 0.29 0.64 -4.23 -1.26 -0.97 115.64 113.74 1tc2 s THR 14 Ca -0.01 -0.05 0.01 0.00 -1.18 0.00 0.00 61.69 60.46 1tc2 s THR 14 Cb -0.02 -3.41 0.28 0.00 1.34 0.00 0.00 72.50 70.69 1tc2 s THR 14 CO -0.00 -0.42 1.86 -0.08 -0.54 0.00 0.00 174.62 175.44 1tc2 h GLU 15 N -0.18 1.00 -0.37 3.99 4.81 -1.95 -1.63 114.58 120.24 1tc2 h GLU 15 Ca -0.45 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.70 1tc2 h GLU 15 Cb 1.26 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 1tc2 h GLU 15 CO 0.60 0.66 0.15 0.93 -0.73 0.00 0.00 179.01 180.63 1tc2 h GLU 16 N 1.04 0.56 -0.51 1.92 3.07 -1.93 0.18 114.58 118.91 1tc2 h GLU 16 Ca 0.46 -0.10 -0.04 0.00 -0.50 0.00 0.00 59.36 59.19 1tc2 h GLU 16 Cb 0.38 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.18 1tc2 h GLU 16 CO -0.22 0.54 0.17 0.93 -1.40 0.00 0.00 179.01 179.02 1tc2 h GLU 17 N 0.46 0.78 0.03 2.33 5.08 -1.81 -2.27 114.58 119.18 1tc2 h GLU 17 Ca 0.12 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1tc2 h GLU 17 Cb 0.19 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1tc2 h GLU 17 CO -0.01 0.72 -0.03 0.82 -1.00 0.00 0.00 179.01 179.51 1tc2 h ILE 18 N 0.68 0.93 -0.56 3.13 2.04 -1.18 -2.01 117.51 120.54 1tc2 h ILE 18 Ca 0.16 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.14 1tc2 h ILE 18 Cb 0.26 0.93 -0.09 0.00 -0.74 0.00 0.00 36.82 37.17 1tc2 h ILE 18 CO -0.01 0.00 0.03 -0.09 0.00 0.00 0.00 178.15 178.09 1tc2 h ARG 19 N -0.07 0.15 -0.10 2.37 2.43 -0.77 -0.88 114.38 117.50 1tc2 h ARG 19 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1tc2 h ARG 19 Cb 0.07 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1tc2 h ARG 19 CO -0.01 0.10 0.03 1.15 -1.51 0.00 0.00 179.97 179.73 1tc2 h THR 20 N 0.15 1.17 -0.72 0.20 2.02 -1.17 -2.59 112.91 111.98 1tc2 h THR 20 Ca 0.29 -0.50 0.01 0.00 0.77 0.00 0.00 66.41 66.98 1tc2 h THR 20 Cb 0.45 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1tc2 h THR 20 CO -0.45 0.15 0.47 0.03 0.37 0.00 0.00 175.52 176.09 1tc2 h ARG 21 N -0.01 0.94 -0.80 6.66 3.08 -0.96 -1.93 114.38 121.35 1tc2 h ARG 21 Ca 0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1tc2 h ARG 21 Cb 0.20 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1tc2 h ARG 21 CO -0.00 0.62 0.51 0.82 -1.07 0.00 0.00 179.97 180.85 1tc2 h ILE 22 N 0.96 1.21 -0.94 2.04 2.04 -1.12 -1.35 117.51 120.36 1tc2 h ILE 22 Ca 0.27 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.73 1tc2 h ILE 22 Cb -0.10 0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 35.99 1tc2 h ILE 22 CO -0.06 0.21 0.62 0.11 0.00 0.00 0.00 178.15 179.03 1tc2 h LYS 23 N 1.08 1.23 -0.21 2.37 1.79 -0.99 0.70 116.57 122.54 1tc2 h LYS 23 Ca 0.29 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.66 1tc2 h LYS 23 Cb -0.10 -0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 30.26 1tc2 h LYS 23 CO -0.06 0.81 0.04 0.93 -1.08 0.00 0.00 179.45 180.09 1tc2 h GLU 24 N 1.27 0.35 -0.75 3.15 5.08 -0.68 -1.40 114.58 121.60 1tc2 h GLU 24 Ca 0.35 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.56 1tc2 h GLU 24 Cb -0.13 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1tc2 h GLU 24 CO -0.08 0.50 0.26 0.28 -1.00 0.00 0.00 179.01 178.97 1tc2 h VAL 25 N 0.15 1.26 -0.50 3.13 2.07 -0.93 -1.72 116.25 119.72 1tc2 h VAL 25 Ca 0.07 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1tc2 h VAL 25 Cb 0.31 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1tc2 h VAL 25 CO 0.00 0.35 0.14 0.00 0.02 0.00 0.00 177.57 178.08 1tc2 h ALA 26 N 1.17 1.31 -0.39 1.67 0.00 -0.73 0.70 119.26 122.99 1tc2 h ALA 26 Ca 0.25 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1tc2 h ALA 26 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1tc2 h ALA 26 CO -0.01 0.49 -0.29 -0.22 0.00 0.00 0.00 179.25 179.22 1tc2 h LYS 27 N 0.73 0.83 0.08 0.00 3.64 -0.77 -0.51 116.57 120.57 1tc2 h LYS 27 Ca 0.17 -0.38 -0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1tc2 h LYS 27 Cb 0.24 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1tc2 h LYS 27 CO -0.01 1.01 -0.04 -0.09 -2.27 0.00 0.00 179.45 178.06 1tc2 h ARG 28 N 0.71 -0.10 -0.31 1.90 2.43 -0.67 -0.39 114.38 117.94 1tc2 h ARG 28 Ca 0.08 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1tc2 h ARG 28 Cb 0.84 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.36 1tc2 h ARG 28 CO 0.07 0.05 0.01 0.82 -1.51 0.00 0.00 179.97 179.41 1tc2 h ILE 29 N -0.23 0.78 -0.58 1.20 2.04 -0.77 0.12 117.51 120.07 1tc2 h ILE 29 Ca -0.01 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 65.83 1tc2 h ILE 29 Cb 0.20 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1tc2 h ILE 29 CO 0.02 0.02 0.36 0.00 0.00 0.00 0.00 178.15 178.55 1tc2 h ALA 30 N 1.26 0.74 -0.65 1.87 0.00 -0.91 -1.69 119.26 119.89 1tc2 h ALA 30 Ca 0.15 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1tc2 h ALA 30 Cb 0.20 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1tc2 h ALA 30 CO -0.24 0.11 0.10 -0.44 0.00 0.00 0.00 179.25 178.78 1tc2 h ASP 31 N 0.72 1.03 0.38 0.00 3.45 -0.51 -1.63 116.42 119.86 1tc2 h ASP 31 Ca 0.23 -0.25 0.00 0.00 0.43 0.00 0.00 57.03 57.44 1tc2 h ASP 31 Cb -0.02 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 38.48 1tc2 h ASP 31 CO -0.08 1.03 0.00 0.44 -1.57 0.00 0.00 179.24 179.06 1tc2 h ASP 32 N 1.01 0.00 -0.01 6.45 3.32 0.10 -2.23 116.42 125.05 1tc2 h ASP 32 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1tc2 h ASP 32 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1tc2 h ASP 32 CO 0.01 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.31 1tc2 n TYR 33 N -3.08 0.00 0.00 4.55 4.02 -0.80 -4.74 117.16 117.11 1tc2 n TYR 33 Ca -0.02 -0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1tc2 n TYR 33 Cb 0.16 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1tc2 n TYR 33 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1tc2 n LYS 34 N 0.54 0.00 0.00 -0.72 5.02 -0.64 -0.37 118.16 121.98 1tc2 n LYS 34 Ca 0.06 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1tc2 n LYS 34 Cb 0.24 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1tc2 n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tc2 n GLY 35 N -1.06 0.13 0.00 0.72 0.00 -1.26 -4.76 105.19 98.96 1tc2 n GLY 35 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1tc2 n GLY 35 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tc2 n LYS 36 N -0.45 0.66 -3.24 1.61 4.76 0.50 -4.90 118.16 117.09 1tc2 n LYS 36 Ca 0.00 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.23 1tc2 n LYS 36 Cb 0.02 -1.40 0.05 0.00 -1.84 0.00 0.00 35.03 31.86 1tc2 n LYS 36 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tc2 n GLY 37 N 0.28 -0.40 3.72 0.72 0.00 -1.26 -4.95 105.19 103.30 1tc2 n GLY 37 Ca 0.13 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1tc2 n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tc2 s LEU 38 N -6.40 4.37 -0.03 0.99 1.43 -1.26 -4.82 118.68 112.96 1tc2 s LEU 38 Ca 0.41 2.58 -0.09 0.00 -1.03 0.00 0.00 54.13 56.00 1tc2 s LEU 38 Cb -0.18 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.46 1tc2 s LEU 38 CO 0.51 -0.80 0.20 -0.13 0.23 0.00 0.00 176.35 176.37 1tc2 s ARG 39 N 1.09 0.45 0.84 1.70 1.81 -0.02 -4.82 118.95 120.01 1tc2 s ARG 39 Ca 0.69 -0.12 -0.11 0.00 -1.72 0.00 0.00 55.73 54.47 1tc2 s ARG 39 Cb -0.43 0.20 0.10 0.00 -0.45 0.00 0.00 34.95 34.37 1tc2 s ARG 39 CO 0.31 -0.10 1.13 -1.25 -0.68 0.00 0.00 175.30 174.72 1tc2 s PRO 40 N -0.88 1.57 0.00 3.54 0.04 -1.26 -0.19 135.00 137.81 1tc2 s PRO 40 Ca -0.10 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.39 1tc2 s PRO 40 Cb -0.05 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1tc2 s PRO 40 CO 0.02 -2.21 0.00 0.66 0.04 0.00 0.00 177.00 175.51 1tc2 n TYR 41 N -3.81 0.00 -0.01 0.56 4.02 -1.26 -4.05 117.16 112.61 1tc2 n TYR 41 Ca 0.11 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.78 1tc2 n TYR 41 Cb 0.52 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.71 1tc2 n TYR 41 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 176.86 175.46 1tc2 h VAL 42 N 0.00 0.74 -1.74 -0.72 -1.51 -2.01 -3.44 116.25 107.57 1tc2 h VAL 42 Ca 0.00 -2.34 -0.46 0.00 -1.23 0.00 0.00 66.70 62.67 1tc2 h VAL 42 Cb 0.00 2.50 -0.40 0.00 -2.13 0.00 0.00 31.29 31.26 1tc2 h VAL 42 CO 0.00 0.78 -1.12 -3.20 -1.23 0.00 0.00 177.57 172.81 1tc2 n ASN 43 N -3.69 1.57 -4.87 4.19 5.15 0.73 -4.97 115.26 113.36 1tc2 n ASN 43 Ca -0.31 -3.04 -0.31 0.00 -0.60 0.00 0.00 54.58 50.33 1tc2 n ASN 43 Cb 0.98 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 39.65 1tc2 n ASN 43 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1tc2 s PRO 44 N -2.78 3.62 -0.29 1.20 0.04 -0.60 -0.84 135.00 135.36 1tc2 s PRO 44 Ca 0.38 0.70 -0.29 0.00 0.04 0.00 0.00 61.00 61.83 1tc2 s PRO 44 Cb 0.37 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.80 1tc2 s PRO 44 CO -0.06 -0.49 1.05 -1.17 0.04 0.00 0.00 177.00 176.37 1tc2 s LEU 45 N -5.02 4.00 -0.24 -3.56 2.96 -0.34 -4.40 118.68 112.08 1tc2 s LEU 45 Ca 0.54 1.15 -0.23 0.00 -0.22 0.00 0.00 54.13 55.38 1tc2 s LEU 45 Cb -0.11 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 1tc2 s LEU 45 CO 0.51 -0.79 0.74 -0.69 -1.32 0.00 0.00 176.35 174.80 1tc2 s VAL 46 N 3.46 4.90 -0.30 1.68 1.01 -0.13 -0.74 120.40 130.28 1tc2 s VAL 46 Ca 0.44 1.38 -0.11 0.00 0.00 0.00 0.00 61.98 63.69 1tc2 s VAL 46 Cb -0.13 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1tc2 s VAL 46 CO 0.12 -0.02 0.20 -0.76 0.00 0.00 0.00 175.10 174.64 1tc2 s LEU 47 N 2.64 4.16 -0.59 3.92 1.43 0.20 -0.17 118.68 130.27 1tc2 s LEU 47 Ca 0.31 -0.14 -0.13 0.00 -1.03 0.00 0.00 54.13 53.15 1tc2 s LEU 47 Cb -0.15 -2.12 0.15 0.00 0.03 0.00 0.00 46.19 44.09 1tc2 s LEU 47 CO 0.08 -0.10 0.51 -0.63 0.23 0.00 0.00 176.35 176.44 1tc2 s ILE 48 N 1.75 4.92 -0.26 -0.59 1.01 -0.17 -0.52 121.20 127.34 1tc2 s ILE 48 Ca 0.07 -1.88 -0.28 0.00 0.00 0.00 0.00 60.65 58.56 1tc2 s ILE 48 Cb -0.16 -4.15 0.01 0.00 0.01 0.00 0.00 42.46 38.16 1tc2 s ILE 48 CO 0.11 -0.88 0.98 -0.55 0.00 0.00 0.00 174.94 174.60 1tc2 s SER 49 N 2.85 6.97 -0.42 3.58 0.15 -0.30 -0.02 113.70 126.51 1tc2 s SER 49 Ca 0.08 1.17 -0.24 0.00 0.70 0.00 0.00 55.95 57.66 1tc2 s SER 49 Cb -0.24 -2.51 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 1tc2 s SER 49 CO -0.01 -0.68 0.84 -0.69 1.20 0.00 0.00 173.24 173.90 1tc2 s VAL 50 N 3.21 4.62 0.67 4.45 1.01 -0.69 -1.29 120.40 132.39 1tc2 s VAL 50 Ca 0.41 0.76 -0.15 0.00 0.00 0.00 0.00 61.98 63.00 1tc2 s VAL 50 Cb -0.14 -4.32 0.01 0.00 0.00 0.00 0.00 36.38 31.93 1tc2 s VAL 50 CO 0.09 -0.64 1.12 -0.76 0.00 0.00 0.00 175.10 174.91 1tc2 s LEU 51 N 3.38 3.36 -0.17 3.92 1.43 -0.41 -2.98 118.68 127.21 1tc2 s LEU 51 Ca 0.33 2.01 0.07 0.00 -1.03 0.00 0.00 54.13 55.51 1tc2 s LEU 51 Cb -0.12 -4.55 -0.22 0.00 0.03 0.00 0.00 46.19 41.33 1tc2 s LEU 51 CO 0.21 -1.70 0.15 0.29 0.23 0.00 0.00 176.35 175.54 1tc2 n LYS 52 N -2.50 0.68 -0.35 1.70 5.02 -1.26 -4.69 118.16 116.77 1tc2 n LYS 52 Ca 0.10 0.16 0.24 0.00 -2.02 0.00 0.00 58.31 56.79 1tc2 n LYS 52 Cb 0.52 -1.61 0.48 0.00 -0.02 0.00 0.00 35.03 34.40 1tc2 n LYS 52 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1tc2 h GLY 53 N 2.67 1.77 1.31 0.72 0.00 -1.72 -1.30 103.07 106.52 1tc2 h GLY 53 Ca -0.48 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.61 1tc2 h GLY 53 CO 0.01 -0.35 0.00 -1.14 0.00 0.00 0.00 176.54 175.07 1tc2 n SER 54 N -4.88 0.00 -0.35 0.19 3.41 -1.16 -3.97 113.62 106.86 1tc2 n SER 54 Ca 0.30 -0.40 0.09 0.00 -0.26 0.00 0.00 58.87 58.60 1tc2 n SER 54 Cb 0.96 -0.15 0.27 0.00 -0.26 0.00 0.00 64.21 65.03 1tc2 n SER 54 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1tc2 h PHE 55 N 0.00 1.09 -0.01 7.33 -5.15 -1.48 0.20 116.94 118.93 1tc2 h PHE 55 Ca 0.00 0.03 -0.07 0.00 -0.20 0.00 0.00 57.97 57.74 1tc2 h PHE 55 Cb 0.12 -0.34 0.00 0.00 0.22 0.00 0.00 35.95 35.95 1tc2 h PHE 55 CO 0.00 0.40 -0.25 1.98 -2.00 0.00 0.00 178.31 178.44 1tc2 h MET 56 N 0.92 0.18 -0.61 6.09 4.05 -1.83 -2.19 114.93 121.55 1tc2 h MET 56 Ca 0.50 -0.19 0.04 0.00 -0.28 0.00 0.00 59.70 59.78 1tc2 h MET 56 Cb 0.59 0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.39 1tc2 h MET 56 CO -0.28 0.91 0.35 0.35 0.23 0.00 0.00 176.91 178.47 1tc2 h PHE 57 N -0.47 0.65 -0.59 1.39 3.57 -1.72 -2.30 116.94 117.47 1tc2 h PHE 57 Ca -0.03 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1tc2 h PHE 57 Cb 0.99 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 1tc2 h PHE 57 CO 0.17 0.34 0.30 1.15 -2.23 0.00 0.00 178.31 178.04 1tc2 h THR 58 N 0.67 1.20 -0.64 4.41 2.02 -0.61 0.11 112.91 120.07 1tc2 h THR 58 Ca 0.26 -0.55 0.04 0.00 0.77 0.00 0.00 66.41 66.93 1tc2 h THR 58 Cb 0.10 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 1tc2 h THR 58 CO -0.14 0.23 0.38 0.00 0.37 0.00 0.00 175.52 176.35 1tc2 h ALA 59 N 1.13 0.84 -0.02 6.16 0.00 -0.96 -0.82 119.26 125.60 1tc2 h ALA 59 Ca 0.20 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.86 1tc2 h ALA 59 Cb 0.09 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.73 1tc2 h ALA 59 CO -0.03 0.10 -0.99 -0.44 0.00 0.00 0.00 179.25 177.89 1tc2 h ASP 60 N 0.73 0.84 -0.03 0.00 3.32 -1.22 -3.22 116.42 116.84 1tc2 h ASP 60 Ca 0.27 -0.66 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 1tc2 h ASP 60 Cb 0.09 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 1tc2 h ASP 60 CO -0.13 1.46 0.01 0.25 -1.72 0.00 0.00 179.24 179.10 1tc2 h LEU 61 N 0.38 0.04 -1.55 1.55 5.85 -0.56 -2.17 115.31 118.85 1tc2 h LEU 61 Ca -0.11 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.51 1tc2 h LEU 61 Cb 1.63 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.62 1tc2 h LEU 61 CO 0.19 0.19 0.39 0.00 -0.34 0.00 0.00 178.44 178.87 1tc2 h ARG 63 N 0.55 0.30 -0.04 0.00 3.08 -1.51 -0.79 114.38 115.97 1tc2 h ARG 63 Ca 0.25 -0.17 -0.20 0.00 0.07 0.00 0.00 59.98 59.93 1tc2 h ARG 63 Cb 0.29 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 1tc2 h ARG 63 CO -0.07 0.72 -0.83 0.00 -1.07 0.00 0.00 179.97 178.72 1tc2 h ALA 64 N 1.25 0.49 -0.29 0.04 0.00 -0.47 -2.32 119.26 117.96 1tc2 h ALA 64 Ca 0.01 -0.66 -0.11 0.00 0.00 0.00 0.00 54.91 54.15 1tc2 h ALA 64 Cb 0.95 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1tc2 h ALA 64 CO 0.08 0.80 -0.26 -0.07 0.00 0.00 0.00 179.25 179.79 1tc2 h LEU 65 N 0.24 0.59 -1.27 0.00 3.38 -0.67 -2.18 115.31 115.40 1tc2 h LEU 65 Ca -0.05 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 1tc2 h LEU 65 Cb 1.44 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1tc2 h LEU 65 CO 0.14 0.84 0.03 0.00 0.09 0.00 0.00 178.44 179.54 1tc2 h ASP 67 N 0.51 0.14 -0.60 0.00 3.32 -0.83 0.83 116.42 119.79 1tc2 h ASP 67 Ca 0.11 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1tc2 h ASP 67 Cb 0.28 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1tc2 h ASP 67 CO 0.01 0.11 0.00 0.49 -1.72 0.00 0.00 179.24 178.12 1tc2 n PHE 68 N -4.52 1.13 -3.04 4.55 3.01 -0.51 -4.94 117.46 113.15 1tc2 n PHE 68 Ca -0.01 -0.48 -0.23 0.00 1.01 0.00 0.00 57.45 57.74 1tc2 n PHE 68 Cb 0.08 -0.13 0.04 0.00 -0.01 0.00 0.00 39.48 39.46 1tc2 n PHE 68 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1tc2 n ASN 69 N 1.14 -6.11 -4.55 4.37 3.02 0.29 -4.98 115.26 108.44 1tc2 n ASN 69 Ca 0.22 -0.29 -0.42 0.00 -0.03 0.00 0.00 54.58 54.06 1tc2 n ASN 69 Cb 0.69 -4.93 -0.07 0.00 -0.61 0.00 0.00 39.78 34.86 1tc2 n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tc2 s VAL 70 N -3.18 4.88 -0.05 2.41 1.01 -0.59 -5.00 120.40 119.88 1tc2 s VAL 70 Ca 0.31 0.38 -0.30 0.00 0.00 0.00 0.00 61.98 62.38 1tc2 s VAL 70 Cb -0.14 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1tc2 s VAL 70 CO 0.38 -0.40 1.48 -2.16 0.00 0.00 0.00 175.10 174.40 1tc2 s PRO 71 N 2.71 4.23 0.30 2.72 0.04 -1.26 -4.35 135.00 139.38 1tc2 s PRO 71 Ca 0.23 2.00 0.09 0.00 0.04 0.00 0.00 61.00 63.37 1tc2 s PRO 71 Cb -0.14 -3.77 -0.05 0.00 0.04 0.00 0.00 34.50 30.58 1tc2 s PRO 71 CO 0.16 -0.71 0.00 0.14 0.04 0.00 0.00 177.00 176.63 1tc2 s VAL 72 N 3.24 3.07 -0.13 -0.36 -7.23 -1.26 -1.20 120.40 116.54 1tc2 s VAL 72 Ca 0.66 -1.95 -0.01 0.00 -1.81 0.00 0.00 61.98 58.88 1tc2 s VAL 72 Cb -0.30 -2.80 0.03 0.00 0.56 0.00 0.00 36.38 33.87 1tc2 s VAL 72 CO 0.25 -0.30 -0.06 -0.60 -0.31 0.00 0.00 175.10 174.08 1tc2 s ARG 73 N -3.69 1.44 -0.10 4.82 3.52 0.08 -4.80 118.95 120.22 1tc2 s ARG 73 Ca 0.33 -0.32 -0.22 0.00 -0.13 0.00 0.00 55.73 55.40 1tc2 s ARG 73 Cb -0.04 -1.69 -0.04 0.00 -1.56 0.00 0.00 34.95 31.62 1tc2 s ARG 73 CO 0.20 -0.32 0.63 -1.64 -0.81 0.00 0.00 175.30 173.35 1tc2 s MET 74 N 1.70 4.38 0.03 5.12 -1.94 -1.26 -0.63 119.30 126.70 1tc2 s MET 74 Ca 0.04 0.73 0.05 0.00 -1.71 0.00 0.00 55.69 54.79 1tc2 s MET 74 Cb -0.13 -3.46 -0.02 0.00 2.01 0.00 0.00 34.83 33.23 1tc2 s MET 74 CO -0.08 0.05 -0.14 -1.21 -0.01 0.00 0.00 175.02 173.63 1tc2 s GLU 75 N 0.90 0.98 -0.07 2.03 0.41 0.33 -4.95 118.70 118.32 1tc2 s GLU 75 Ca 0.33 -0.71 0.03 0.00 -0.41 0.00 0.00 54.97 54.21 1tc2 s GLU 75 Cb -0.17 -0.98 0.01 0.00 -1.78 0.00 0.00 34.13 31.21 1tc2 s GLU 75 CO 0.15 0.25 -0.14 -0.06 -0.49 0.00 0.00 175.26 174.97 1tc2 s PHE 76 N -0.75 1.59 0.06 1.61 0.40 -1.26 -1.15 117.98 118.47 1tc2 s PHE 76 Ca 0.02 -0.59 0.08 0.00 -0.60 0.00 0.00 56.93 55.85 1tc2 s PHE 76 Cb -0.07 -1.14 -0.03 0.00 0.51 0.00 0.00 43.02 42.29 1tc2 s PHE 76 CO 0.01 -0.28 -0.23 0.96 0.70 0.00 0.00 175.22 176.37 1tc2 s ILE 77 N 0.59 1.89 -0.11 0.64 -4.36 -0.41 -4.54 121.20 114.90 1tc2 s ILE 77 Ca -0.14 -1.37 0.03 0.00 -0.26 0.00 0.00 60.65 58.90 1tc2 s ILE 77 Cb -0.16 -1.64 0.01 0.00 1.25 0.00 0.00 42.46 41.91 1tc2 s ILE 77 CO 0.04 0.21 -0.20 0.00 0.24 0.00 0.00 174.94 175.22 1tc2 s VAL 79 N 0.64 2.44 0.01 0.00 -7.23 -1.26 -0.68 120.40 114.31 1tc2 s VAL 79 Ca -0.13 -2.39 -0.04 0.00 -1.81 0.00 0.00 61.98 57.62 1tc2 s VAL 79 Cb -0.16 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.45 1tc2 s VAL 79 CO 0.03 -0.39 0.06 -0.55 -0.31 0.00 0.00 175.10 173.94 1tc2 s SER 80 N -3.51 0.10 0.34 4.85 0.15 0.12 -4.90 113.70 110.85 1tc2 s SER 80 Ca 0.30 -0.28 -0.26 0.00 0.70 0.00 0.00 55.95 56.42 1tc2 s SER 80 Cb -0.04 0.16 -0.09 0.00 -1.71 0.00 0.00 66.02 64.33 1tc2 s SER 80 CO 0.15 -0.30 1.00 -0.55 1.20 0.00 0.00 173.24 174.74 1tc2 s SER 81 N -1.23 7.12 0.23 5.45 0.15 -1.26 0.36 113.70 124.52 1tc2 s SER 81 Ca -0.13 1.96 0.08 0.00 0.70 0.00 0.00 55.95 58.56 1tc2 s SER 81 Cb -0.08 -2.59 0.21 0.00 -1.71 0.00 0.00 66.02 61.85 1tc2 s SER 81 CO 0.00 -0.23 1.52 1.88 1.20 0.00 0.00 173.24 177.62 1tc2 h TYR 82 N 3.01 0.08 0.00 3.44 -1.99 -1.95 -3.45 116.97 116.12 1tc2 h TYR 82 Ca -0.47 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.22 1tc2 h TYR 82 Cb 1.20 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.92 1tc2 h TYR 82 CO 0.60 0.74 0.00 0.41 -0.00 0.00 0.00 178.16 179.91 1tc2 n GLY 83 N 0.49 -0.60 3.68 3.88 0.00 -1.26 -5.05 105.19 106.34 1tc2 n GLY 83 Ca -0.01 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 1tc2 n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tc2 s GLU 84 N -2.00 4.33 -1.21 1.61 0.41 -1.26 -3.85 118.70 116.72 1tc2 s GLU 84 Ca 0.00 1.05 0.00 0.00 -0.41 0.00 0.00 54.97 55.61 1tc2 s GLU 84 Cb 0.00 -3.56 0.00 0.00 -1.78 0.00 0.00 34.13 28.79 1tc2 s GLU 84 CO 0.00 -0.29 0.00 0.41 -0.49 0.00 0.00 175.26 174.89 1tc2 n GLY 85 N 3.38 0.88 0.12 -1.39 0.00 -1.26 -4.92 105.19 102.00 1tc2 n GLY 85 Ca 0.04 -0.44 0.02 0.00 0.00 0.00 0.00 46.02 45.65 1tc2 n GLY 85 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1tc2 h LEU 86 N 0.00 0.00 -8.49 0.99 3.38 -1.97 -3.47 115.31 105.75 1tc2 h LEU 86 Ca -0.26 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.50 1tc2 h LEU 86 Cb 0.92 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.52 1tc2 h LEU 86 CO 0.36 0.49 -0.61 0.28 0.09 0.00 0.00 178.44 179.05 1tc2 s THR 87 N -2.97 0.05 0.00 0.22 -1.32 -1.26 -5.01 115.64 105.34 1tc2 s THR 87 Ca 0.01 -1.92 0.00 0.00 -1.21 0.00 0.00 61.69 58.57 1tc2 s THR 87 Cb 0.08 -2.26 0.00 0.00 -1.51 0.00 0.00 72.50 68.81 1tc2 s THR 87 CO 0.77 -0.22 0.00 -1.20 -2.21 0.00 0.00 174.62 171.76 1tc2 n SER 88 N -0.19 1.44 -0.09 8.08 7.64 -1.26 -4.74 113.62 124.49 1tc2 n SER 88 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1tc2 n SER 88 Cb 0.65 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 64.08 1tc2 n SER 88 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1tc2 n SER 89 N -0.63 0.14 -1.49 6.43 3.41 -1.26 -4.79 113.62 115.43 1tc2 n SER 89 Ca 0.00 -1.47 -0.15 0.00 -0.26 0.00 0.00 58.87 56.99 1tc2 n SER 89 Cb 0.06 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 1tc2 n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tc2 n GLY 90 N 0.22 0.50 3.75 5.00 0.00 -1.26 -4.43 105.19 108.97 1tc2 n GLY 90 Ca 0.00 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 1tc2 n GLY 90 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tc2 s GLN 91 N -4.14 4.30 0.09 1.61 -0.21 -1.26 -4.26 119.66 115.80 1tc2 s GLN 91 Ca 0.00 2.26 0.03 0.00 0.02 0.00 0.00 55.36 57.67 1tc2 s GLN 91 Cb 0.00 -3.11 -0.04 0.00 1.00 0.00 0.00 33.01 30.87 1tc2 s GLN 91 CO 0.00 -0.35 -0.10 0.14 -2.12 0.00 0.00 175.29 172.86 1tc2 s VAL 92 N -0.27 0.89 0.02 1.09 -7.23 -1.26 -4.66 120.40 108.98 1tc2 s VAL 92 Ca 0.56 -1.62 -0.28 0.00 -1.81 0.00 0.00 61.98 58.84 1tc2 s VAL 92 Cb -0.41 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 1tc2 s VAL 92 CO 0.45 -0.57 0.89 -0.60 -0.31 0.00 0.00 175.10 174.96 1tc2 s ARG 93 N -2.77 4.56 -0.46 4.82 3.52 0.16 -4.86 118.95 123.91 1tc2 s ARG 93 Ca 0.05 1.26 -0.23 0.00 -0.13 0.00 0.00 55.73 56.68 1tc2 s ARG 93 Cb -0.03 -3.42 0.03 0.00 -1.56 0.00 0.00 34.95 29.97 1tc2 s ARG 93 CO -0.00 0.09 0.78 -1.64 -0.81 0.00 0.00 175.30 173.72 1tc2 s MET 94 N 0.54 3.37 -0.04 5.12 -1.94 -1.26 -0.70 119.30 124.38 1tc2 s MET 94 Ca 0.46 -0.19 0.04 0.00 -1.71 0.00 0.00 55.69 54.29 1tc2 s MET 94 Cb -0.21 -3.96 -0.25 0.00 2.01 0.00 0.00 34.83 32.42 1tc2 s MET 94 CO 0.26 -1.15 0.68 -0.07 -0.01 0.00 0.00 175.02 174.72 1tc2 h LEU 95 N 10.17 0.18 -7.32 -0.03 3.38 -1.25 -3.46 115.31 116.97 1tc2 h LEU 95 Ca -0.25 -0.34 -0.24 0.00 0.09 0.00 0.00 57.88 57.14 1tc2 h LEU 95 Cb 1.09 -0.06 -0.32 0.00 0.09 0.00 0.00 40.66 41.45 1tc2 h LEU 95 CO 0.97 1.30 -0.57 -0.22 0.09 0.00 0.00 178.44 180.01 1tc2 s LEU 96 N -6.55 0.25 0.00 1.67 2.96 -1.03 -4.93 118.68 111.05 1tc2 s LEU 96 Ca -0.09 0.42 0.02 0.00 -0.22 0.00 0.00 54.13 54.26 1tc2 s LEU 96 Cb 0.08 0.50 0.02 0.00 0.50 0.00 0.00 46.19 47.28 1tc2 s LEU 96 CO 0.82 -0.19 0.18 -0.67 -1.32 0.00 0.00 176.35 175.16 1tc2 n ASP 97 N 4.71 2.95 -4.76 3.68 -0.08 -1.26 -1.16 116.55 120.64 1tc2 n ASP 97 Ca -0.17 -2.88 -0.39 0.00 -1.51 0.00 0.00 54.79 49.84 1tc2 n ASP 97 Cb 0.51 0.15 0.03 0.00 2.34 0.00 0.00 41.12 44.16 1tc2 n ASP 97 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1tc2 s THR 98 N -2.57 2.00 0.06 5.18 -4.23 -1.26 -4.82 115.64 110.00 1tc2 s THR 98 Ca 0.13 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.49 1tc2 s THR 98 Cb -0.01 -3.00 -0.22 0.00 1.34 0.00 0.00 72.50 70.61 1tc2 s THR 98 CO 0.08 0.00 1.18 0.08 -0.54 0.00 0.00 174.62 175.43 1tc2 h ARG 99 N 1.86 0.62 -6.30 3.99 -0.00 -1.93 -3.45 114.38 109.16 1tc2 h ARG 99 Ca -0.51 -0.63 -0.45 0.00 -0.00 0.00 0.00 59.98 58.39 1tc2 h ARG 99 Cb 1.29 0.17 -0.00 0.00 -0.00 0.00 0.00 29.97 31.42 1tc2 h ARG 99 CO 0.59 1.24 -0.36 -1.01 -0.00 0.00 0.00 179.97 180.43 1tc2 s HIS 100 N -3.37 3.04 0.28 4.08 3.76 -1.26 -5.09 115.29 116.72 1tc2 s HIS 100 Ca -0.11 -0.26 -0.28 0.00 -0.15 0.00 0.00 55.06 54.27 1tc2 s HIS 100 Cb 0.06 -1.99 -0.09 0.00 1.11 0.00 0.00 32.58 31.67 1tc2 s HIS 100 CO 0.88 -0.00 0.93 0.45 -0.85 0.00 0.00 174.74 176.15 1tc2 s SER 101 N -4.15 7.47 0.01 1.40 0.15 -1.26 -4.95 113.70 112.37 1tc2 s SER 101 Ca 0.45 1.86 0.23 0.00 0.70 0.00 0.00 55.95 59.19 1tc2 s SER 101 Cb -0.09 -2.58 0.07 0.00 -1.71 0.00 0.00 66.02 61.71 1tc2 s SER 101 CO 0.30 0.05 1.09 2.30 1.20 0.00 0.00 173.24 178.18 1tc2 n ILE 102 N 1.02 0.03 -1.70 6.45 -5.35 -1.26 -4.90 119.36 113.64 1tc2 n ILE 102 Ca -0.00 -0.05 -0.56 0.00 -0.27 0.00 0.00 62.75 61.87 1tc2 n ILE 102 Cb 0.49 0.58 -0.07 0.00 -1.74 0.00 0.00 39.64 38.90 1tc2 n ILE 102 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1tc2 n GLU 103 N -1.60 1.36 -0.86 6.28 2.13 -1.25 0.06 120.64 126.76 1tc2 n GLU 103 Ca 0.04 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.36 1tc2 n GLU 103 Cb 0.36 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 29.85 1tc2 n GLU 103 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1tc2 n GLY 104 N 4.22 0.56 3.60 8.31 0.00 0.60 -4.85 105.19 117.64 1tc2 n GLY 104 Ca 0.26 -0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1tc2 n GLY 104 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tc2 s HIS 105 N -2.00 2.56 -0.36 1.61 3.76 0.11 -3.96 115.29 117.01 1tc2 s HIS 105 Ca 0.00 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.37 1tc2 s HIS 105 Cb 0.00 -1.25 0.01 0.00 1.11 0.00 0.00 32.58 32.45 1tc2 s HIS 105 CO 0.00 0.59 0.72 -1.01 -0.85 0.00 0.00 174.74 174.20 1tc2 s HIS 106 N -2.43 3.13 -0.02 1.40 3.76 -1.26 0.19 115.29 120.06 1tc2 s HIS 106 Ca 0.32 0.48 0.05 0.00 -0.15 0.00 0.00 55.06 55.76 1tc2 s HIS 106 Cb -0.04 -3.29 -0.03 0.00 1.11 0.00 0.00 32.58 30.33 1tc2 s HIS 106 CO 0.19 -0.68 -0.15 0.08 -0.85 0.00 0.00 174.74 173.33 1tc2 s VAL 107 N 2.93 3.03 -0.14 -0.90 1.01 -0.19 -0.96 120.40 125.18 1tc2 s VAL 107 Ca 0.29 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 1tc2 s VAL 107 Cb -0.14 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 34.06 1tc2 s VAL 107 CO 0.16 0.51 -0.00 -0.22 0.00 0.00 0.00 175.10 175.54 1tc2 s LEU 108 N -0.98 1.11 -0.03 3.92 2.96 0.76 -1.41 118.68 125.02 1tc2 s LEU 108 Ca 0.13 -0.52 -0.28 0.00 -0.22 0.00 0.00 54.13 53.23 1tc2 s LEU 108 Cb -0.11 -0.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.91 1tc2 s LEU 108 CO 0.02 -0.23 0.90 -0.63 -1.32 0.00 0.00 176.35 175.09 1tc2 s ILE 109 N 1.83 4.92 -0.21 6.68 1.01 -0.04 -1.00 121.20 134.38 1tc2 s ILE 109 Ca 0.02 1.87 -0.04 0.00 0.00 0.00 0.00 60.65 62.50 1tc2 s ILE 109 Cb -0.15 -4.23 -0.01 0.00 0.01 0.00 0.00 42.46 38.07 1tc2 s ILE 109 CO -0.07 0.18 -0.03 -0.69 0.00 0.00 0.00 174.94 174.33 1tc2 s VAL 110 N 1.00 3.56 0.09 2.92 1.01 0.97 -0.52 120.40 129.42 1tc2 s VAL 110 Ca 0.47 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 62.06 1tc2 s VAL 110 Cb -0.20 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1tc2 s VAL 110 CO 0.25 0.43 -0.11 -1.61 0.00 0.00 0.00 175.10 174.05 1tc2 s GLU 111 N 1.29 0.82 -0.02 2.72 0.41 -0.51 -1.70 118.70 121.71 1tc2 s GLU 111 Ca 0.04 -1.07 -0.12 0.00 -0.41 0.00 0.00 54.97 53.41 1tc2 s GLU 111 Cb -0.14 -0.62 -0.32 0.00 -1.78 0.00 0.00 34.13 31.26 1tc2 s GLU 111 CO -0.01 0.11 0.80 0.38 -0.49 0.00 0.00 175.26 176.05 1tc2 h ASP 112 N 3.85 0.67 -4.44 -0.19 2.03 -1.87 -1.76 116.42 114.71 1tc2 h ASP 112 Ca -0.38 -0.89 -0.11 0.00 -0.73 0.00 0.00 57.03 54.92 1tc2 h ASP 112 Cb 1.19 -0.22 -0.22 0.00 -0.83 0.00 0.00 39.33 39.25 1tc2 h ASP 112 CO 0.48 1.73 -0.21 -0.51 -1.03 0.00 0.00 179.24 179.70 1tc2 s ILE 113 N -2.59 0.02 -0.09 4.15 2.07 -1.26 -1.04 121.20 122.47 1tc2 s ILE 113 Ca -0.13 -0.19 0.02 0.00 -1.41 0.00 0.00 60.65 58.94 1tc2 s ILE 113 Cb 0.05 -0.64 0.01 0.00 0.13 0.00 0.00 42.46 42.02 1tc2 s ILE 113 CO 0.88 -0.11 -0.14 0.54 -1.91 0.00 0.00 174.94 174.20 1tc2 s VAL 114 N -0.54 1.38 0.00 4.00 0.11 -0.94 -4.99 120.40 119.41 1tc2 s VAL 114 Ca -0.07 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.39 1tc2 s VAL 114 Cb -0.04 -1.25 0.00 0.00 -1.53 0.00 0.00 36.38 33.56 1tc2 s VAL 114 CO 0.03 0.41 0.00 -0.67 -3.33 0.00 0.00 175.10 171.54 1tc2 n ASP 115 N 3.99 0.00 0.19 3.54 2.03 -1.26 -1.46 116.55 123.58 1tc2 n ASP 115 Ca -0.20 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.17 1tc2 n ASP 115 Cb 0.52 0.00 0.31 0.00 -0.72 0.00 0.00 41.12 41.23 1tc2 n ASP 115 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1tc2 h THR 116 N 0.00 0.82 0.00 5.18 1.35 -1.88 -2.57 112.91 115.81 1tc2 h THR 116 Ca 0.00 -1.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 1tc2 h THR 116 Cb 0.00 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1tc2 h THR 116 CO 0.00 0.36 0.00 0.00 -0.25 0.00 0.00 175.52 175.63 1tc2 n ALA 117 N -2.27 0.00 -0.00 6.62 0.00 -1.26 -1.36 120.51 122.23 1tc2 n ALA 117 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1tc2 n ALA 117 Cb 0.53 -0.81 -0.04 0.00 0.00 0.00 0.00 19.45 19.13 1tc2 n ALA 117 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1tc2 h LEU 118 N 0.00 -0.15 -0.09 0.00 3.38 -1.90 0.22 115.31 116.77 1tc2 h LEU 118 Ca 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1tc2 h LEU 118 Cb 0.41 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1tc2 h LEU 118 CO 0.00 -0.06 -0.08 0.74 0.09 0.00 0.00 178.44 179.13 1tc2 h THR 119 N -0.02 1.35 -0.70 0.22 2.02 -1.87 -2.49 112.91 111.42 1tc2 h THR 119 Ca 0.06 -1.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.02 1tc2 h THR 119 Cb 0.11 1.95 -0.03 0.00 -1.74 0.00 0.00 68.15 68.44 1tc2 h THR 119 CO -0.13 0.34 0.36 0.25 0.37 0.00 0.00 175.52 176.71 1tc2 h LEU 120 N -0.18 0.87 -0.75 2.58 5.85 -1.86 0.25 115.31 122.06 1tc2 h LEU 120 Ca 0.02 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1tc2 h LEU 120 Cb 0.58 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1tc2 h LEU 120 CO 0.02 0.72 0.14 -1.13 -0.34 0.00 0.00 178.44 177.85 1tc2 h ASN 121 N 0.98 1.04 -0.07 1.25 -1.24 -0.53 -0.78 115.58 116.23 1tc2 h ASN 121 Ca 0.24 -0.23 -0.00 0.00 0.71 0.00 0.00 56.30 57.03 1tc2 h ASN 121 Cb 0.05 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.83 1tc2 h ASN 121 CO -0.04 1.01 0.03 0.22 -1.29 0.00 0.00 177.43 177.36 1tc2 h TYR 122 N 1.03 0.10 -0.70 0.67 3.20 -0.86 -2.26 116.97 118.14 1tc2 h TYR 122 Ca 0.21 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 1tc2 h TYR 122 Cb 0.39 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1tc2 h TYR 122 CO 0.03 0.17 0.28 -0.07 -1.64 0.00 0.00 178.16 176.93 1tc2 h LEU 123 N -0.01 0.96 0.14 2.82 3.38 -0.75 -1.46 115.31 120.38 1tc2 h LEU 123 Ca 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1tc2 h LEU 123 Cb 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1tc2 h LEU 123 CO -0.00 0.85 -0.07 0.22 0.09 0.00 0.00 178.44 179.53 1tc2 h TYR 124 N 1.02 -0.19 -0.55 1.13 3.20 -1.04 -0.71 116.97 119.82 1tc2 h TYR 124 Ca 0.24 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1tc2 h TYR 124 Cb 0.20 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 1tc2 h TYR 124 CO 0.02 -0.12 0.34 0.45 -1.64 0.00 0.00 178.16 177.21 1tc2 h HIS 125 N -0.20 0.72 0.10 -3.82 3.86 -1.20 0.23 115.15 114.85 1tc2 h HIS 125 Ca -0.02 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1tc2 h HIS 125 Cb 0.15 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.34 1tc2 h HIS 125 CO -0.07 0.49 -0.33 1.98 0.86 0.00 0.00 177.93 180.86 1tc2 h MET 126 N 0.75 -0.52 -0.15 2.45 1.85 -0.97 -0.66 114.93 117.68 1tc2 h MET 126 Ca 0.20 0.04 -0.07 0.00 -0.61 0.00 0.00 59.70 59.25 1tc2 h MET 126 Cb -0.03 0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.10 1tc2 h MET 126 CO -0.04 -0.35 -0.24 1.88 -0.40 0.00 0.00 176.91 177.76 1tc2 h TYR 127 N -0.54 0.29 -0.82 1.39 -1.99 -0.99 -2.42 116.97 111.88 1tc2 h TYR 127 Ca 0.04 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.75 1tc2 h TYR 127 Cb 0.58 -0.08 -0.05 0.00 2.00 0.00 0.00 36.73 39.19 1tc2 h TYR 127 CO -0.30 0.50 0.54 0.35 -0.00 0.00 0.00 178.16 179.25 1tc2 h PHE 128 N 0.24 0.98 0.00 4.88 3.57 0.06 -0.03 116.94 126.65 1tc2 h PHE 128 Ca 0.04 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1tc2 h PHE 128 Cb 0.57 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.98 1tc2 h PHE 128 CO 0.01 0.57 0.00 0.25 -2.23 0.00 0.00 178.31 176.91 1tc2 n THR 129 N -4.45 0.11 0.67 4.41 -2.24 -0.35 -2.29 114.28 110.14 1tc2 n THR 129 Ca 0.11 0.03 0.12 0.00 -2.27 0.00 0.00 64.05 62.03 1tc2 n THR 129 Cb 0.12 -0.68 0.25 0.00 -2.10 0.00 0.00 70.33 67.92 1tc2 n THR 129 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1tc2 n ARG 130 N -1.09 2.26 -3.31 -0.78 1.74 -0.02 -5.00 116.66 110.47 1tc2 n ARG 130 Ca 0.15 -1.89 -0.17 0.00 -0.77 0.00 0.00 57.85 55.16 1tc2 n ARG 130 Cb 0.10 -1.48 0.07 0.00 -1.02 0.00 0.00 32.46 30.14 1tc2 n ARG 130 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1tc2 n ARG 131 N 1.13 -6.12 -1.19 5.56 -4.01 -0.97 -3.78 116.66 107.29 1tc2 n ARG 131 Ca 0.18 0.72 -0.31 0.00 -1.04 0.00 0.00 57.85 57.40 1tc2 n ARG 131 Cb 0.53 -5.38 0.10 0.00 -3.04 0.00 0.00 32.46 24.67 1tc2 n ARG 131 CO 0.00 0.00 0.00 -1.25 -3.04 0.00 0.00 177.63 173.34 1tc2 s PRO 132 N -5.54 2.03 0.41 2.89 0.04 -1.26 -0.29 135.00 133.28 1tc2 s PRO 132 Ca 0.20 1.19 0.08 0.00 0.04 0.00 0.00 61.00 62.50 1tc2 s PRO 132 Cb -0.09 -1.87 0.86 0.00 0.04 0.00 0.00 34.50 33.44 1tc2 s PRO 132 CO 0.62 -1.81 2.04 0.00 0.04 0.00 0.00 177.00 177.89 1tc2 h ALA 133 N -1.25 1.68 -2.82 8.56 0.00 0.19 -3.41 119.26 122.21 1tc2 h ALA 133 Ca -0.44 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1tc2 h ALA 133 Cb 1.24 -0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.75 1tc2 h ALA 133 CO 0.50 0.27 0.11 -1.54 0.00 0.00 0.00 179.25 178.60 1tc2 s SER 134 N -6.73 -0.47 -0.13 0.00 1.04 -0.85 -4.92 113.70 101.64 1tc2 s SER 134 Ca -0.08 -0.03 -0.05 0.00 0.48 0.00 0.00 55.95 56.28 1tc2 s SER 134 Cb 0.17 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.90 1tc2 s SER 134 CO 0.73 -0.89 0.27 -0.22 0.98 0.00 0.00 173.24 174.11 1tc2 s LEU 135 N -2.59 -0.31 0.21 2.42 2.96 -1.25 -1.03 118.68 119.10 1tc2 s LEU 135 Ca 0.00 0.61 -0.00 0.00 -0.22 0.00 0.00 54.13 54.52 1tc2 s LEU 135 Cb -0.00 0.73 -0.04 0.00 0.50 0.00 0.00 46.19 47.37 1tc2 s LEU 135 CO -0.10 -0.24 0.13 -0.54 -1.32 0.00 0.00 176.35 174.28 1tc2 s LYS 136 N 2.41 1.25 0.05 1.98 1.02 -0.50 -5.01 119.74 120.95 1tc2 s LYS 136 Ca 0.01 -1.67 0.06 0.00 0.02 0.00 0.00 55.97 54.39 1tc2 s LYS 136 Cb -0.12 0.16 -0.02 0.00 -0.52 0.00 0.00 37.83 37.32 1tc2 s LYS 136 CO -0.09 -0.38 -0.16 0.95 -0.92 0.00 0.00 175.35 174.76 1tc2 s THR 137 N -4.06 1.28 -0.09 2.17 -4.23 -1.26 -0.86 115.64 108.59 1tc2 s THR 137 Ca 0.39 -1.15 0.01 0.00 -1.18 0.00 0.00 61.69 59.76 1tc2 s THR 137 Cb 0.07 -1.16 0.02 0.00 1.34 0.00 0.00 72.50 72.77 1tc2 s THR 137 CO 0.13 -0.01 -0.10 0.54 -0.54 0.00 0.00 174.62 174.64 1tc2 s VAL 138 N -0.95 1.10 -0.04 2.29 0.11 0.33 -1.73 120.40 121.50 1tc2 s VAL 138 Ca 0.03 -0.40 0.03 0.00 -2.93 0.00 0.00 61.98 58.71 1tc2 s VAL 138 Cb -0.09 -1.05 0.00 0.00 -1.53 0.00 0.00 36.38 33.72 1tc2 s VAL 138 CO 0.02 0.36 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.32 1tc2 s VAL 139 N 1.10 1.16 0.04 2.04 1.01 -0.58 -1.43 120.40 123.75 1tc2 s VAL 139 Ca -0.06 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 1tc2 s VAL 139 Cb -0.14 -1.02 -0.18 0.00 0.00 0.00 0.00 36.38 35.04 1tc2 s VAL 139 CO -0.02 0.35 1.42 0.25 0.00 0.00 0.00 175.10 177.11 1tc2 h LEU 140 N 6.37 -0.70 -8.88 3.92 5.85 -1.23 -2.31 115.31 118.33 1tc2 h LEU 140 Ca -0.33 -0.02 -0.69 0.00 0.84 0.00 0.00 57.88 57.69 1tc2 h LEU 140 Cb 1.17 0.18 -0.24 0.00 0.37 0.00 0.00 40.66 42.15 1tc2 h LEU 140 CO 0.48 -0.41 -0.82 -0.76 -0.34 0.00 0.00 178.44 176.60 1tc2 s LEU 141 N -9.82 2.51 -0.12 2.25 1.43 -0.20 -0.90 118.68 113.83 1tc2 s LEU 141 Ca -0.16 -0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1tc2 s LEU 141 Cb 0.03 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.80 1tc2 s LEU 141 CO 0.56 0.28 -0.04 -0.62 0.23 0.00 0.00 176.35 176.76 1tc2 s ASP 142 N -1.20 2.20 -1.10 2.29 -1.08 -0.35 -2.21 116.67 115.21 1tc2 s ASP 142 Ca 0.13 -0.35 -0.13 0.00 -0.52 0.00 0.00 52.55 51.68 1tc2 s ASP 142 Cb -0.10 -0.72 0.21 0.00 -1.46 0.00 0.00 42.92 40.85 1tc2 s ASP 142 CO 0.03 -0.17 1.21 -0.54 0.52 0.00 0.00 175.17 176.22 1tc2 s LYS 143 N 1.79 4.02 0.48 4.34 1.02 -0.53 -0.44 119.74 130.41 1tc2 s LYS 143 Ca 0.04 -2.72 0.21 0.00 0.02 0.00 0.00 55.97 53.52 1tc2 s LYS 143 Cb -0.13 -4.79 1.22 0.00 -0.52 0.00 0.00 37.83 33.61 1tc2 s LYS 143 CO -0.07 -1.52 1.95 0.00 -0.92 0.00 0.00 175.35 174.79 1tc2 h ARG 144 N 7.23 0.21 -0.06 1.68 3.08 -1.83 -1.11 114.38 123.58 1tc2 h ARG 144 Ca 0.22 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1tc2 h ARG 144 Cb 0.91 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1tc2 h ARG 144 CO 1.09 0.14 0.00 0.39 -1.07 0.00 0.00 179.97 180.51 1tc2 n GLU 145 N -4.42 1.48 0.00 0.04 1.02 -1.26 -3.93 120.64 113.57 1tc2 n GLU 145 Ca 0.13 -0.71 0.13 0.00 -0.02 0.00 0.00 57.16 56.69 1tc2 n GLU 145 Cb 0.58 -1.43 0.43 0.00 -0.02 0.00 0.00 31.44 31.01 1tc2 n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tc2 n GLY 146 N 1.07 -0.52 3.64 0.62 0.00 -0.42 -4.99 105.19 104.60 1tc2 n GLY 146 Ca 0.18 -0.40 -0.46 0.00 0.00 0.00 0.00 46.02 45.34 1tc2 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tc2 n ARG 147 N -0.51 1.75 0.00 1.61 5.12 -0.97 -3.65 116.66 120.02 1tc2 n ARG 147 Ca 0.14 0.62 0.04 0.00 -1.93 0.00 0.00 57.85 56.72 1tc2 n ARG 147 Cb 0.34 -2.25 -0.01 0.00 -1.16 0.00 0.00 32.46 29.39 1tc2 n ARG 147 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1tc2 n ARG 148 N 2.11 2.66 -3.71 5.56 1.74 -0.46 -4.94 116.66 119.61 1tc2 n ARG 148 Ca 0.13 -0.43 -0.13 0.00 -0.77 0.00 0.00 57.85 56.65 1tc2 n ARG 148 Cb 0.29 -0.97 -0.09 0.00 -1.02 0.00 0.00 32.46 30.66 1tc2 n ARG 148 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tc2 s VAL 149 N -1.22 -0.00 0.28 1.55 0.11 -1.20 -5.01 120.40 114.91 1tc2 s VAL 149 Ca 0.06 0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 58.81 1tc2 s VAL 149 Cb 0.06 -0.68 -0.11 0.00 -1.53 0.00 0.00 36.38 34.12 1tc2 s VAL 149 CO 0.20 0.00 1.51 -2.16 -3.33 0.00 0.00 175.10 171.33 1tc2 s PRO 150 N 0.35 4.19 -0.29 1.54 0.04 -1.26 -4.80 135.00 134.78 1tc2 s PRO 150 Ca -0.01 2.45 -0.17 0.00 0.04 0.00 0.00 61.00 63.30 1tc2 s PRO 150 Cb -0.04 -3.06 0.12 0.00 0.04 0.00 0.00 34.50 31.57 1tc2 s PRO 150 CO -0.01 -0.52 0.89 0.12 0.04 0.00 0.00 177.00 177.53 1tc2 s PHE 151 N -0.13 -0.71 -0.08 0.56 5.36 -1.26 -5.02 117.98 116.69 1tc2 s PHE 151 Ca 0.60 1.47 0.05 0.00 -0.96 0.00 0.00 56.93 58.08 1tc2 s PHE 151 Cb -0.45 0.43 -0.00 0.00 -0.34 0.00 0.00 43.02 42.66 1tc2 s PHE 151 CO 0.47 -0.35 -0.23 -1.12 -1.46 0.00 0.00 175.22 172.53 1tc2 s SER 152 N 1.26 2.92 0.15 6.13 0.01 -1.26 -5.08 113.70 117.84 1tc2 s SER 152 Ca -0.08 -0.51 -0.19 0.00 1.31 0.00 0.00 55.95 56.48 1tc2 s SER 152 Cb -0.04 -1.13 -0.07 0.00 0.21 0.00 0.00 66.02 64.98 1tc2 s SER 152 CO -0.15 0.18 0.64 0.00 0.41 0.00 0.00 173.24 174.32 1tc2 s ALA 153 N 0.18 3.51 0.15 1.44 0.00 -1.26 -4.94 121.76 120.84 1tc2 s ALA 153 Ca -0.13 0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.84 1tc2 s ALA 153 Cb -0.16 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1tc2 s ALA 153 CO 0.06 0.38 1.43 -0.44 0.00 0.00 0.00 175.76 177.19 1tc2 h ASP 154 N 3.93 0.78 -3.98 0.00 3.32 -1.84 -3.44 116.42 115.19 1tc2 h ASP 154 Ca -0.48 -0.45 -0.44 0.00 0.02 0.00 0.00 57.03 55.68 1tc2 h ASP 154 Cb 1.20 -0.23 -0.30 0.00 0.22 0.00 0.00 39.33 40.23 1tc2 h ASP 154 CO 0.65 1.21 -0.79 -0.31 -1.72 0.00 0.00 179.24 178.27 1tc2 s TYR 155 N -3.95 1.02 -0.02 4.55 1.51 -0.71 -5.02 117.35 114.74 1tc2 s TYR 155 Ca -0.09 -0.22 0.00 0.00 -1.01 0.00 0.00 57.07 55.75 1tc2 s TYR 155 Cb 0.10 -0.68 0.02 0.00 -0.11 0.00 0.00 41.96 41.29 1tc2 s TYR 155 CO 0.87 -0.06 0.02 0.08 -1.11 0.00 0.00 175.55 175.35 1tc2 s VAL 156 N -0.06 -0.02 0.02 0.71 1.01 -1.26 -1.52 120.40 119.27 1tc2 s VAL 156 Ca 0.01 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.97 1tc2 s VAL 156 Cb -0.06 -0.08 -0.31 0.00 0.00 0.00 0.00 36.38 35.93 1tc2 s VAL 156 CO 0.00 0.07 1.03 0.58 0.00 0.00 0.00 175.10 176.78 1tc2 h VAL 157 N 5.98 1.33 -2.43 2.92 2.07 -0.88 -3.48 116.25 121.76 1tc2 h VAL 157 Ca -0.40 -2.52 -0.09 0.00 0.82 0.00 0.00 66.70 64.51 1tc2 h VAL 157 Cb 1.15 2.90 -0.22 0.00 -1.52 0.00 0.00 31.29 33.60 1tc2 h VAL 157 CO 0.49 0.75 -0.06 0.00 0.02 0.00 0.00 177.57 178.78 1tc2 s ALA 158 N -2.77 -1.34 -0.06 1.67 0.00 -0.07 -5.01 121.76 114.18 1tc2 s ALA 158 Ca -0.10 1.32 -0.13 0.00 0.00 0.00 0.00 51.96 53.04 1tc2 s ALA 158 Cb 0.04 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 1tc2 s ALA 158 CO 0.91 -0.28 0.35 -0.80 0.00 0.00 0.00 175.76 175.94 1tc2 s ASN 159 N -0.23 6.67 0.12 0.00 0.01 -1.26 -1.22 114.94 119.02 1tc2 s ASN 159 Ca -0.04 0.79 0.02 0.00 -0.71 0.00 0.00 52.86 52.92 1tc2 s ASN 159 Cb -0.03 -2.21 -0.04 0.00 0.41 0.00 0.00 41.25 39.37 1tc2 s ASN 159 CO 0.03 0.28 -0.05 0.27 -1.51 0.00 0.00 177.10 176.12 1tc2 s ILE 160 N -0.71 0.69 0.92 0.60 -4.36 0.41 -4.87 121.20 113.88 1tc2 s ILE 160 Ca 0.21 -1.95 -0.13 0.00 -0.26 0.00 0.00 60.65 58.52 1tc2 s ILE 160 Cb -0.15 -1.80 0.19 0.00 1.25 0.00 0.00 42.46 41.95 1tc2 s ILE 160 CO 0.10 -0.77 1.26 -2.16 0.24 0.00 0.00 174.94 173.61 1tc2 s PRO 161 N -3.85 0.82 -1.30 0.37 0.04 -1.26 -4.15 135.00 125.66 1tc2 s PRO 161 Ca 0.15 -0.57 -0.17 0.00 0.04 0.00 0.00 61.00 60.46 1tc2 s PRO 161 Cb 0.05 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.66 1tc2 s PRO 161 CO -0.02 -2.24 2.03 -1.71 0.04 0.00 0.00 177.00 175.09 1tc2 n ASN 162 N -3.59 3.93 -4.44 6.66 2.85 -1.26 -4.88 115.26 114.53 1tc2 n ASN 162 Ca 0.15 -2.83 -0.26 0.00 -0.11 0.00 0.00 54.58 51.54 1tc2 n ASN 162 Cb 0.60 -1.62 -0.11 0.00 1.24 0.00 0.00 39.78 39.89 1tc2 n ASN 162 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1tc2 s ALA 163 N 4.31 2.62 -0.47 5.20 0.00 -1.26 -5.08 121.76 127.08 1tc2 s ALA 163 Ca 0.52 -1.74 -0.22 0.00 0.00 0.00 0.00 51.96 50.51 1tc2 s ALA 163 Cb 0.10 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.95 1tc2 s ALA 163 CO 0.00 0.37 0.77 0.12 0.00 0.00 0.00 175.76 177.02 1tc2 s PHE 164 N -2.02 2.98 0.17 0.00 5.36 -1.26 -5.04 117.98 118.17 1tc2 s PHE 164 Ca 0.25 0.02 -0.04 0.00 -0.96 0.00 0.00 56.93 56.20 1tc2 s PHE 164 Cb -0.07 -3.66 -0.05 0.00 -0.34 0.00 0.00 43.02 38.90 1tc2 s PHE 164 CO 0.12 -1.03 0.40 0.14 -1.46 0.00 0.00 175.22 173.39 1tc2 s VAL 165 N 3.24 5.16 0.05 3.12 -7.23 -1.26 -0.65 120.40 122.83 1tc2 s VAL 165 Ca 0.27 -0.05 -0.07 0.00 -1.81 0.00 0.00 61.98 60.31 1tc2 s VAL 165 Cb -0.13 -3.66 -0.00 0.00 0.56 0.00 0.00 36.38 33.14 1tc2 s VAL 165 CO 0.20 -0.04 0.15 0.27 -0.31 0.00 0.00 175.10 175.37 1tc2 s ILE 166 N -1.75 0.13 0.00 -0.62 -4.36 0.27 -4.63 121.20 110.24 1tc2 s ILE 166 Ca 0.41 -1.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.73 1tc2 s ILE 166 Cb -0.12 -1.02 0.00 0.00 1.25 0.00 0.00 42.46 42.58 1tc2 s ILE 166 CO 0.26 -0.59 0.00 0.61 0.24 0.00 0.00 174.94 175.46 1tc2 n GLY 167 N 0.54 2.21 3.88 6.27 0.00 0.32 -0.87 105.19 117.55 1tc2 n GLY 167 Ca -0.18 -1.98 -0.25 0.00 0.00 0.00 0.00 46.02 43.61 1tc2 n GLY 167 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1tc2 n TYR 168 N 0.96 -1.78 0.00 1.61 9.36 -0.17 -1.21 117.16 125.93 1tc2 n TYR 168 Ca 0.00 0.79 0.00 0.00 3.32 0.00 0.00 57.90 62.01 1tc2 n TYR 168 Cb 0.00 -3.94 0.00 0.00 -0.63 0.00 0.00 39.34 34.77 1tc2 n TYR 168 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1tc2 n GLY 169 N -1.80 2.96 3.73 2.98 0.00 0.96 -4.56 105.19 109.46 1tc2 n GLY 169 Ca -0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1tc2 n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tc2 s LEU 170 N 0.00 4.47 0.41 0.99 1.43 -0.35 -4.15 118.68 121.48 1tc2 s LEU 170 Ca 0.00 1.90 0.04 0.00 -1.03 0.00 0.00 54.13 55.05 1tc2 s LEU 170 Cb 0.00 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.58 1tc2 s LEU 170 CO 0.00 -0.17 0.03 1.51 0.23 0.00 0.00 176.35 177.95 1tc2 s ASP 171 N 0.13 3.46 -0.11 2.29 -4.77 -1.26 -0.52 116.67 115.89 1tc2 s ASP 171 Ca 0.49 -1.48 -0.02 0.00 -3.30 0.00 0.00 52.55 48.24 1tc2 s ASP 171 Cb -0.26 0.00 0.04 0.00 -1.09 0.00 0.00 42.92 41.62 1tc2 s ASP 171 CO 0.31 -0.64 0.03 -0.47 0.70 0.00 0.00 175.17 175.10 1tc2 s TYR 172 N -2.95 0.60 -1.52 2.11 5.04 -0.93 -4.79 117.35 114.92 1tc2 s TYR 172 Ca 0.27 -0.29 -0.12 0.00 -2.44 0.00 0.00 57.07 54.49 1tc2 s TYR 172 Cb 0.07 -0.79 0.08 0.00 0.35 0.00 0.00 41.96 41.66 1tc2 s TYR 172 CO 0.13 -0.40 0.89 -3.47 -1.34 0.00 0.00 175.55 171.36 1tc2 n ASP 173 N 5.16 -3.83 -2.02 4.32 2.03 -1.26 -1.10 116.55 119.86 1tc2 n ASP 173 Ca -0.07 -0.83 -0.20 0.00 0.52 0.00 0.00 54.79 54.21 1tc2 n ASP 173 Cb 0.49 -3.71 -0.05 0.00 -0.72 0.00 0.00 41.12 37.14 1tc2 n ASP 173 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1tc2 n ASP 174 N -2.85 -5.58 -4.47 1.67 -0.08 -1.26 -4.98 116.55 98.99 1tc2 n ASP 174 Ca -0.02 0.24 -0.28 0.00 -1.51 0.00 0.00 54.79 53.21 1tc2 n ASP 174 Cb 0.55 -4.78 -0.11 0.00 2.34 0.00 0.00 41.12 39.12 1tc2 n ASP 174 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1tc2 s THR 175 N -2.88 2.67 0.00 5.18 2.01 -0.26 -4.74 115.64 117.63 1tc2 s THR 175 Ca 0.00 -1.72 0.00 0.00 0.31 0.00 0.00 61.69 60.28 1tc2 s THR 175 Cb 0.00 -2.25 0.00 0.00 0.01 0.00 0.00 72.50 70.26 1tc2 s THR 175 CO 0.00 0.00 0.00 -1.22 -0.69 0.00 0.00 174.62 172.71 1tc2 n TYR 176 N 0.53 0.00 0.19 4.92 4.02 -1.26 -2.19 117.16 123.37 1tc2 n TYR 176 Ca -0.14 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.82 1tc2 n TYR 176 Cb 0.54 -0.53 0.59 0.00 -0.02 0.00 0.00 39.34 39.92 1tc2 n TYR 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tc2 h ARG 177 N 1.37 0.13 0.00 -0.72 3.08 -1.85 -2.73 114.38 113.66 1tc2 h ARG 177 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1tc2 h ARG 177 Cb 0.16 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1tc2 h ARG 177 CO 0.00 0.09 0.00 -0.85 -1.07 0.00 0.00 179.97 178.14 1tc2 n GLU 178 N -4.52 0.38 -1.91 0.04 0.00 -1.26 -0.03 120.64 113.33 1tc2 n GLU 178 Ca -0.01 0.05 -0.39 0.00 0.00 0.00 0.00 57.16 56.82 1tc2 n GLU 178 Cb 0.10 -1.50 0.02 0.00 0.00 0.00 0.00 31.44 30.06 1tc2 n GLU 178 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1tc2 s LEU 179 N -2.53 4.00 0.40 -1.84 1.43 -1.04 -4.81 118.68 114.30 1tc2 s LEU 179 Ca 0.24 2.70 0.24 0.00 -1.03 0.00 0.00 54.13 56.29 1tc2 s LEU 179 Cb 0.16 -4.13 0.52 0.00 0.03 0.00 0.00 46.19 42.78 1tc2 s LEU 179 CO 0.36 -1.25 1.67 0.03 0.23 0.00 0.00 176.35 177.40 1tc2 h ARG 180 N 1.96 0.00 -6.03 1.70 3.08 -1.92 -0.42 114.38 112.75 1tc2 h ARG 180 Ca -0.50 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.00 1tc2 h ARG 180 Cb 1.27 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.25 1tc2 h ARG 180 CO 0.59 0.00 -0.51 -0.51 -1.07 0.00 0.00 179.97 178.48 1tc2 s ASP 181 N -5.80 4.61 -0.20 7.04 1.01 -1.26 -3.80 116.67 118.27 1tc2 s ASP 181 Ca 0.07 -0.89 -0.04 0.00 0.71 0.00 0.00 52.55 52.41 1tc2 s ASP 181 Cb 0.07 -0.61 -0.02 0.00 1.01 0.00 0.00 42.92 43.37 1tc2 s ASP 181 CO 0.64 -0.43 -0.04 -0.63 0.21 0.00 0.00 175.17 174.92 1tc2 s ILE 182 N -2.50 3.56 0.29 0.77 1.01 -0.15 -3.23 121.20 120.95 1tc2 s ILE 182 Ca 0.40 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.64 1tc2 s ILE 182 Cb -0.00 -2.60 -0.06 0.00 0.01 0.00 0.00 42.46 39.81 1tc2 s ILE 182 CO 0.23 0.44 0.06 0.68 0.00 0.00 0.00 174.94 176.35 1tc2 s VAL 183 N 1.12 1.02 -0.23 2.92 -7.23 -0.05 -0.89 120.40 117.05 1tc2 s VAL 183 Ca 0.02 -2.01 -0.09 0.00 -1.81 0.00 0.00 61.98 58.09 1tc2 s VAL 183 Cb -0.15 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.07 1tc2 s VAL 183 CO -0.00 -0.05 0.12 -0.69 -0.31 0.00 0.00 175.10 174.17 1tc2 s VAL 184 N -3.42 5.03 0.18 1.32 1.01 -0.33 -0.57 120.40 123.62 1tc2 s VAL 184 Ca 0.36 0.06 -0.31 0.00 0.00 0.00 0.00 61.98 62.09 1tc2 s VAL 184 Cb 0.08 -3.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.04 1tc2 s VAL 184 CO 0.14 0.37 1.42 -0.22 0.00 0.00 0.00 175.10 176.81 1tc2 s LEU 185 N 1.02 4.38 -0.01 3.92 2.96 0.17 -1.20 118.68 129.93 1tc2 s LEU 185 Ca 0.06 2.49 -0.30 0.00 -0.22 0.00 0.00 54.13 56.16 1tc2 s LEU 185 Cb -0.14 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.89 1tc2 s LEU 185 CO 0.04 -0.67 1.63 -0.13 -1.32 0.00 0.00 176.35 175.90 1tc2 s ARG 186 N 0.45 4.20 0.19 1.98 0.52 0.06 -4.67 118.95 121.67 1tc2 s ARG 186 Ca 0.62 2.22 0.11 0.00 -0.52 0.00 0.00 55.73 58.16 1tc2 s ARG 186 Cb -0.39 -3.82 0.59 0.00 0.52 0.00 0.00 34.95 31.84 1tc2 s ARG 186 CO 0.36 -0.78 1.28 -0.35 0.02 0.00 0.00 175.30 175.82 1tc2 n PRO 187 N 6.47 0.07 0.11 3.54 -0.04 -1.26 0.49 135.00 144.38 1tc2 n PRO 187 Ca 0.16 0.53 -0.01 0.00 -0.04 0.00 0.00 63.50 64.15 1tc2 n PRO 187 Cb 0.42 -1.83 -0.02 0.00 -0.04 0.00 0.00 33.50 32.03 1tc2 n PRO 187 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1tc2 h GLU 188 N 0.00 0.00 0.22 0.54 3.07 -1.96 -3.23 114.58 113.22 1tc2 h GLU 188 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.52 1tc2 h GLU 188 Cb 0.20 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.13 1tc2 h GLU 188 CO 0.00 0.67 -1.59 0.28 -1.40 0.00 0.00 179.01 176.97 1tc2 h VAL 189 N 0.00 1.13 -0.00 3.13 2.07 -0.31 -3.55 116.25 118.72 1tc2 h VAL 189 Ca -0.01 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 64.91 1tc2 h VAL 189 Cb 1.51 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 34.20 1tc2 h VAL 189 CO 0.09 0.83 0.00 -1.22 0.02 0.00 0.00 177.57 177.28