#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1thn s LEU 3 N 0.00 0.97 0.15 2.46 2.96 -1.26 -1.53 118.68 122.43 1thn s LEU 3 Ca 0.00 -0.11 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 1thn s LEU 3 Cb 0.00 -0.46 -0.04 0.00 0.50 0.00 0.00 46.19 46.19 1thn s LEU 3 CO 0.00 -0.12 0.00 0.00 -1.32 0.00 0.00 176.35 174.91 1thn s ALA 4 N 1.45 3.23 -0.06 5.97 0.00 -0.24 -4.99 121.76 127.12 1thn s ALA 4 Ca -0.03 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 50.67 1thn s ALA 4 Cb -0.13 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 21.94 1thn s ALA 4 CO -0.03 0.55 -0.10 0.42 0.00 0.00 0.00 175.76 176.60 1thn s ILE 5 N -1.58 0.96 -0.22 0.00 1.01 -1.26 -2.16 121.20 117.95 1thn s ILE 5 Ca 0.27 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.53 1thn s ILE 5 Cb -0.10 -0.89 0.03 0.00 0.01 0.00 0.00 42.46 41.50 1thn s ILE 5 CO 0.18 0.31 -0.13 -0.62 0.00 0.00 0.00 174.94 174.69 1thn s ASP 6 N 0.66 3.79 0.12 3.58 2.15 -0.54 -4.99 116.67 121.45 1thn s ASP 6 Ca -0.13 -0.81 0.06 0.00 0.43 0.00 0.00 52.55 52.11 1thn s ASP 6 Cb -0.15 -1.57 -0.04 0.00 -0.30 0.00 0.00 42.92 40.86 1thn s ASP 6 CO 0.03 -0.07 -0.03 -0.76 -0.17 0.00 0.00 175.17 174.17 1thn s LEU 7 N 1.29 3.32 -0.28 -1.34 1.43 -1.26 -1.11 118.68 120.73 1thn s LEU 7 Ca 0.01 -0.29 -0.20 0.00 -1.03 0.00 0.00 54.13 52.63 1thn s LEU 7 Cb -0.15 -2.04 0.08 0.00 0.03 0.00 0.00 46.19 44.10 1thn s LEU 7 CO -0.08 0.15 0.72 -0.70 0.23 0.00 0.00 176.35 176.67 1thn s GLU 8 N -2.45 0.75 -0.32 1.70 2.12 -0.72 -5.00 118.70 114.78 1thn s GLU 8 Ca 0.25 1.10 -0.03 0.00 0.36 0.00 0.00 54.97 56.65 1thn s GLU 8 Cb -0.11 0.26 0.05 0.00 0.26 0.00 0.00 34.13 34.59 1thn s GLU 8 CO 0.17 -0.12 0.05 0.08 -0.54 0.00 0.00 175.26 174.89 1thn s VAL 9 N 1.06 3.25 -0.24 3.70 1.01 -1.26 -0.63 120.40 127.28 1thn s VAL 9 Ca -0.05 -1.36 -0.05 0.00 0.00 0.00 0.00 61.98 60.52 1thn s VAL 9 Cb -0.05 -2.89 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 1thn s VAL 9 CO -0.11 -0.18 -0.00 -0.54 0.00 0.00 0.00 175.10 174.27 1thn s LYS 10 N 1.29 3.28 7.86 2.72 1.02 -0.84 -4.96 119.74 130.11 1thn s LYS 10 Ca -0.03 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.26 1thn s LYS 10 Cb -0.20 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 33.99 1thn s LYS 10 CO -0.00 -0.28 0.00 1.04 -0.92 0.00 0.00 175.35 175.19 1thn n GLN 11 N 4.81 0.00 -0.75 1.68 6.02 -1.26 -1.15 117.38 126.73 1thn n GLN 11 Ca -0.17 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 56.84 1thn n GLN 11 Cb 0.50 0.00 0.29 0.00 1.02 0.00 0.00 30.24 32.05 1thn n GLN 11 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1thn n ASP 12 N 7.60 4.31 -4.61 1.08 5.75 -1.26 -4.99 116.55 124.43 1thn n ASP 12 Ca 0.00 -3.17 -0.28 0.00 -0.01 0.00 0.00 54.79 51.33 1thn n ASP 12 Cb 0.00 -0.64 -0.09 0.00 -1.03 0.00 0.00 41.12 39.36 1thn n ASP 12 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1thn s VAL 13 N -2.93 3.47 -0.17 2.12 1.01 -0.30 -1.06 120.40 122.54 1thn s VAL 13 Ca 0.49 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1thn s VAL 13 Cb 0.39 -2.68 0.04 0.00 0.00 0.00 0.00 36.38 34.14 1thn s VAL 13 CO 0.10 0.01 -0.09 -0.22 0.00 0.00 0.00 175.10 174.90 1thn s LEU 14 N -2.53 1.86 -0.24 3.92 2.96 -0.30 -1.98 118.68 122.37 1thn s LEU 14 Ca 0.24 -0.69 -0.15 0.00 -0.22 0.00 0.00 54.13 53.31 1thn s LEU 14 Cb -0.10 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1thn s LEU 14 CO 0.16 -0.14 0.36 -0.63 -1.32 0.00 0.00 176.35 174.78 1thn s ILE 15 N 1.52 5.20 -0.22 6.68 1.01 0.20 -1.97 121.20 133.63 1thn s ILE 15 Ca 0.01 0.60 -0.02 0.00 0.00 0.00 0.00 60.65 61.24 1thn s ILE 15 Cb -0.15 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1thn s ILE 15 CO -0.08 0.22 -0.09 -0.69 0.00 0.00 0.00 174.94 174.29 1thn s VAL 16 N 1.65 2.81 -0.13 2.92 1.01 -0.13 -1.76 120.40 126.77 1thn s VAL 16 Ca 0.16 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 1thn s VAL 16 Cb -0.15 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1thn s VAL 16 CO 0.08 0.37 -0.06 -0.13 0.00 0.00 0.00 175.10 175.36 1thn s ARG 17 N 1.37 3.45 -0.13 2.72 0.52 -0.27 -0.07 118.95 126.54 1thn s ARG 17 Ca 0.03 -0.56 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 1thn s ARG 17 Cb -0.15 -2.80 -0.01 0.00 0.52 0.00 0.00 34.95 32.52 1thn s ARG 17 CO -0.06 0.31 -0.17 -0.51 0.02 0.00 0.00 175.30 174.89 1thn s LEU 18 N 0.15 2.44 -0.19 2.53 1.43 -0.62 -1.47 118.68 122.95 1thn s LEU 18 Ca -0.03 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.60 1thn s LEU 18 Cb -0.14 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 1thn s LEU 18 CO 0.03 0.13 -0.09 -0.55 0.23 0.00 0.00 176.35 176.11 1thn s SER 19 N 0.55 4.06 0.00 2.29 0.15 -0.92 -3.07 113.70 116.76 1thn s SER 19 Ca -0.11 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.13 1thn s SER 19 Cb -0.16 -1.67 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 1thn s SER 19 CO 0.04 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.11 1thn n GLY 20 N 4.49 -0.93 3.57 9.45 0.00 0.69 -1.08 105.19 121.37 1thn n GLY 20 Ca -0.19 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.28 1thn n GLY 20 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1thn s GLU 21 N 0.00 3.55 -0.50 1.61 2.02 -0.58 -2.28 118.70 122.52 1thn s GLU 21 Ca 0.00 0.17 -0.19 0.00 0.02 0.00 0.00 54.97 54.97 1thn s GLU 21 Cb 0.00 -3.92 0.05 0.00 0.10 0.00 0.00 34.13 30.37 1thn s GLU 21 CO 0.00 -1.19 0.62 -1.17 0.02 0.00 0.00 175.26 173.54 1thn s LEU 22 N 3.69 4.93 0.00 1.80 2.96 0.16 -4.42 118.68 127.81 1thn s LEU 22 Ca 0.36 -0.87 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1thn s LEU 22 Cb -0.10 -2.46 0.00 0.00 0.50 0.00 0.00 46.19 44.12 1thn s LEU 22 CO 0.25 -0.87 0.00 -0.90 -1.32 0.00 0.00 176.35 173.51 1thn n ASP 23 N 6.15 0.32 0.06 3.68 5.68 -1.26 -2.68 116.55 128.51 1thn n ASP 23 Ca -0.06 -0.70 -0.11 0.00 -0.50 0.00 0.00 54.79 53.42 1thn n ASP 23 Cb 0.46 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.39 1thn n ASP 23 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1thn h HIS 24 N 0.70 -0.69 0.63 2.11 -0.00 -1.95 0.51 115.15 116.46 1thn h HIS 24 Ca 0.00 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.36 1thn h HIS 24 Cb 0.00 0.30 0.01 0.00 -0.00 0.00 0.00 27.41 27.72 1thn h HIS 24 CO 0.00 -0.35 -0.30 1.25 -0.00 0.00 0.00 177.93 178.53 1thn h HIS 25 N -0.40 -0.78 0.00 5.26 -0.00 -1.97 -3.15 115.15 114.11 1thn h HIS 25 Ca 0.06 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.40 1thn h HIS 25 Cb 0.48 0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 28.15 1thn h HIS 25 CO -0.29 -0.48 -0.04 1.79 -0.00 0.00 0.00 177.93 178.92 1thn h THR 26 N -0.87 0.09 0.00 6.26 1.35 -1.85 -3.16 112.91 114.72 1thn h THR 26 Ca -0.09 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1thn h THR 26 Cb 0.65 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1thn h THR 26 CO 0.14 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 175.45 1thn h ALA 27 N 1.96 1.00 0.11 6.62 0.00 0.07 -2.71 119.26 126.31 1thn h ALA 27 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1thn h ALA 27 Cb 0.69 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1thn h ALA 27 CO 0.01 0.00 -1.19 1.49 0.00 0.00 0.00 179.25 179.55 1thn h GLU 28 N 0.00 0.41 -0.12 0.00 4.57 -1.65 -2.31 114.58 115.48 1thn h GLU 28 Ca 0.00 -0.59 -0.11 0.00 -1.18 0.00 0.00 59.36 57.48 1thn h GLU 28 Cb 0.15 0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1thn h GLU 28 CO 0.00 1.25 -0.42 0.93 -1.18 0.00 0.00 179.01 179.59 1thn h GLU 29 N 0.16 0.27 -0.27 1.92 4.39 -1.69 -0.75 114.58 118.61 1thn h GLU 29 Ca -0.15 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.41 1thn h GLU 29 Cb 1.88 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.52 1thn h GLU 29 CO 0.21 0.64 0.11 1.25 -1.16 0.00 0.00 179.01 180.06 1thn h LEU 30 N 0.22 0.37 0.50 1.33 5.85 -1.52 -2.39 115.31 119.67 1thn h LEU 30 Ca 0.02 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1thn h LEU 30 Cb 0.83 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1thn h LEU 30 CO 0.07 0.43 -0.26 -0.09 -0.34 0.00 0.00 178.44 178.25 1thn h ARG 31 N 0.29 -0.68 -0.61 1.25 2.43 -0.98 -1.13 114.38 114.94 1thn h ARG 31 Ca 0.09 0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 1thn h ARG 31 Cb 0.18 0.16 -0.10 0.00 -0.42 0.00 0.00 29.97 29.78 1thn h ARG 31 CO -0.01 -0.45 -0.49 0.93 -1.51 0.00 0.00 179.97 178.43 1thn h GLU 32 N -0.71 -0.23 0.12 0.20 5.08 -1.09 0.10 114.58 118.06 1thn h GLU 32 Ca -0.06 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1thn h GLU 32 Cb 0.56 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1thn h GLU 32 CO 0.10 -0.15 -0.06 1.96 -1.00 0.00 0.00 179.01 179.86 1thn h GLN 33 N -0.23 -0.15 0.68 2.33 4.20 -1.37 0.79 115.11 121.36 1thn h GLN 33 Ca 0.15 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.84 1thn h GLN 33 Cb 0.55 0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.37 1thn h GLN 33 CO -0.71 -0.05 -0.33 0.28 -0.67 0.00 0.00 178.83 177.35 1thn h VAL 34 N -0.22 0.18 -0.94 -0.54 2.07 -0.92 1.04 116.25 116.91 1thn h VAL 34 Ca -0.02 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.38 1thn h VAL 34 Cb 0.18 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 30.09 1thn h VAL 34 CO 0.03 0.02 0.56 0.71 0.02 0.00 0.00 177.57 178.91 1thn h THR 35 N -1.13 0.84 0.27 2.57 1.35 -0.86 0.51 112.91 116.46 1thn h THR 35 Ca -0.09 -0.29 -0.01 0.00 -0.55 0.00 0.00 66.41 65.47 1thn h THR 35 Cb 0.74 -0.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.07 1thn h THR 35 CO 0.15 0.15 -0.18 -0.78 -0.25 0.00 0.00 175.52 174.62 1thn h ASP 36 N 0.85 -0.46 -0.83 5.36 1.82 0.87 -0.79 116.42 123.22 1thn h ASP 36 Ca 0.49 0.03 0.03 0.00 -0.39 0.00 0.00 57.03 57.19 1thn h ASP 36 Cb 0.57 0.15 -0.05 0.00 0.68 0.00 0.00 39.33 40.67 1thn h ASP 36 CO -0.30 -0.29 0.53 0.58 -1.61 0.00 0.00 179.24 178.16 1thn h VAL 37 N -0.44 1.13 0.00 2.25 2.07 0.45 -0.21 116.25 121.49 1thn h VAL 37 Ca -0.02 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1thn h VAL 37 Cb 0.38 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1thn h VAL 37 CO 0.01 0.19 -0.25 -0.07 0.02 0.00 0.00 177.57 177.47 1thn h LEU 38 N 1.04 0.00 -1.12 2.57 3.38 -0.05 0.57 115.31 121.70 1thn h LEU 38 Ca 0.33 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.22 1thn h LEU 38 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1thn h LEU 38 CO -0.12 0.25 -0.38 -0.08 0.09 0.00 0.00 178.44 178.20 1thn h GLU 39 N 0.00 0.00 0.00 1.13 4.81 0.46 -3.27 114.58 117.71 1thn h GLU 39 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1thn h GLU 39 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1thn h GLU 39 CO 0.03 0.38 -1.88 0.09 -0.73 0.00 0.00 179.01 176.90 1thn n ASN 40 N -3.74 0.55 -4.18 1.04 3.02 -0.56 -5.02 115.26 106.37 1thn n ASN 40 Ca -0.01 -0.01 -0.14 0.00 -0.03 0.00 0.00 54.58 54.39 1thn n ASN 40 Cb 0.46 1.88 -0.11 0.00 -0.61 0.00 0.00 39.78 41.41 1thn n ASN 40 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1thn s ARG 41 N -3.35 0.87 -0.88 3.52 0.52 0.08 -5.08 118.95 114.63 1thn s ARG 41 Ca -0.07 -1.22 -0.25 0.00 -0.52 0.00 0.00 55.73 53.67 1thn s ARG 41 Cb 0.13 -0.48 0.03 0.00 0.52 0.00 0.00 34.95 35.14 1thn s ARG 41 CO 0.81 0.06 1.45 0.00 0.02 0.00 0.00 175.30 177.65 1thn s ALA 42 N -2.75 2.61 -0.25 2.13 0.00 -1.26 -4.59 121.76 117.65 1thn s ALA 42 Ca 0.08 -1.76 -0.06 0.00 0.00 0.00 0.00 51.96 50.22 1thn s ALA 42 Cb -0.01 -4.42 -0.02 0.00 0.00 0.00 0.00 23.12 18.68 1thn s ALA 42 CO -0.01 -3.61 0.04 0.42 0.00 0.00 0.00 175.76 172.60 1thn s ILE 43 N 5.94 3.97 -0.16 0.00 -1.09 -1.26 -4.70 121.20 123.89 1thn s ILE 43 Ca 0.45 -0.35 0.14 0.00 -2.23 0.00 0.00 60.65 58.67 1thn s ILE 43 Cb -0.04 -2.87 -0.24 0.00 -1.58 0.00 0.00 42.46 37.72 1thn s ILE 43 CO 0.02 0.32 0.20 -1.14 -1.23 0.00 0.00 174.94 173.11 1thn n ARG 44 N 4.88 0.67 -4.24 2.79 0.63 -0.22 -4.95 116.66 116.22 1thn n ARG 44 Ca -0.17 0.09 -0.15 0.00 -0.92 0.00 0.00 57.85 56.70 1thn n ARG 44 Cb 0.51 -1.59 -0.10 0.00 0.45 0.00 0.00 32.46 31.72 1thn n ARG 44 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1thn s HIS 45 N -2.52 1.27 -0.02 -0.14 3.76 -1.09 -3.48 115.29 113.07 1thn s HIS 45 Ca -0.11 -0.69 0.02 0.00 -0.15 0.00 0.00 55.06 54.13 1thn s HIS 45 Cb 0.07 -0.65 0.00 0.00 1.11 0.00 0.00 32.58 33.11 1thn s HIS 45 CO 0.81 0.09 -0.06 0.42 -0.85 0.00 0.00 174.74 175.15 1thn s ILE 46 N -2.87 0.54 -0.20 0.60 1.01 -0.89 -1.15 121.20 118.24 1thn s ILE 46 Ca 0.13 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.56 1thn s ILE 46 Cb -0.00 -0.49 0.04 0.00 0.01 0.00 0.00 42.46 42.01 1thn s ILE 46 CO 0.01 0.18 -0.14 -0.69 0.00 0.00 0.00 174.94 174.30 1thn s VAL 47 N 0.23 1.85 -0.39 2.92 1.01 -0.83 -1.40 120.40 123.80 1thn s VAL 47 Ca -0.03 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.76 1thn s VAL 47 Cb -0.07 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.50 1thn s VAL 47 CO -0.00 0.27 0.24 -0.22 0.00 0.00 0.00 175.10 175.39 1thn s LEU 48 N 1.32 4.86 -0.58 3.92 2.96 -0.25 -0.96 118.68 129.95 1thn s LEU 48 Ca -0.00 -0.96 -0.22 0.00 -0.22 0.00 0.00 54.13 52.73 1thn s LEU 48 Cb -0.16 -2.07 0.06 0.00 0.50 0.00 0.00 46.19 44.52 1thn s LEU 48 CO -0.09 -0.41 0.84 0.21 -1.32 0.00 0.00 176.35 175.58 1thn s ASN 49 N 1.60 6.23 -0.09 3.68 3.84 0.90 -1.38 114.94 129.72 1thn s ASN 49 Ca 0.03 -0.84 0.09 0.00 0.21 0.00 0.00 52.86 52.35 1thn s ASN 49 Cb -0.19 -2.38 0.41 0.00 -0.55 0.00 0.00 41.25 38.54 1thn s ASN 49 CO 0.08 -1.20 1.21 0.18 -2.79 0.00 0.00 177.10 174.57 1thn n LEU 50 N 7.08 3.08 -0.29 3.21 4.77 -0.73 -1.59 117.00 132.53 1thn n LEU 50 Ca -0.04 -1.56 0.10 0.00 -0.03 0.00 0.00 56.01 54.49 1thn n LEU 50 Cb 0.46 -0.49 0.24 0.00 -2.33 0.00 0.00 43.42 41.30 1thn n LEU 50 CO 0.61 0.48 0.90 1.23 -1.33 0.00 0.00 177.39 179.28 1thn h GLY 51 N 4.70 1.19 -3.72 -0.72 0.00 -1.66 -1.38 103.07 101.47 1thn h GLY 51 Ca 0.00 0.01 -0.51 0.00 0.00 0.00 0.00 47.33 46.84 1thn h GLY 51 CO 0.18 -0.34 0.56 -1.06 0.00 0.00 0.00 176.54 175.88 1thn n GLN 52 N -5.26 2.31 -3.28 4.80 6.02 -1.18 -4.93 117.38 115.85 1thn n GLN 52 Ca 0.19 -3.12 -0.42 0.00 -0.01 0.00 0.00 57.00 53.64 1thn n GLN 52 Cb 0.61 -2.15 -0.08 0.00 1.02 0.00 0.00 30.24 29.63 1thn n GLN 52 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1thn s LEU 53 N -3.41 4.47 -0.17 1.08 2.96 -0.52 -0.23 118.68 122.87 1thn s LEU 53 Ca 0.57 -0.22 0.14 0.00 -0.22 0.00 0.00 54.13 54.40 1thn s LEU 53 Cb 0.47 -2.50 0.71 0.00 0.50 0.00 0.00 46.19 45.38 1thn s LEU 53 CO 0.07 -0.49 1.60 0.35 -1.32 0.00 0.00 176.35 176.56 1thn n THR 54 N 5.42 2.15 0.00 3.68 -2.24 -0.97 -4.90 114.28 117.42 1thn n THR 54 Ca -0.06 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 1thn n THR 54 Cb 0.49 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1thn n THR 54 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1thn n PHE 55 N 0.77 0.00 -3.85 4.78 7.35 -1.24 -4.81 117.46 120.47 1thn n PHE 55 Ca 0.25 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.81 1thn n PHE 55 Cb 0.99 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.68 1thn n PHE 55 CO 0.00 0.00 0.00 1.41 -0.76 0.00 0.00 176.76 177.41 1thn s MET 56 N 0.00 0.02 0.32 -4.13 -2.45 -1.26 0.37 119.30 112.17 1thn s MET 56 Ca 0.00 0.06 0.01 0.00 -1.25 0.00 0.00 55.69 54.52 1thn s MET 56 Cb 0.00 -0.03 -0.01 0.00 1.25 0.00 0.00 34.83 36.04 1thn s MET 56 CO 0.00 -0.03 0.05 -0.40 1.05 0.00 0.00 175.02 175.69 1thn n ASP 57 N 3.27 2.05 0.22 1.11 5.68 -1.09 -4.93 116.55 122.87 1thn n ASP 57 Ca -0.15 -2.54 0.18 0.00 -0.50 0.00 0.00 54.79 51.78 1thn n ASP 57 Cb 0.58 0.49 0.86 0.00 -1.14 0.00 0.00 41.12 41.91 1thn n ASP 57 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 1thn h SER 58 N 1.00 0.00 0.00 -1.12 0.87 -2.00 1.09 113.55 113.39 1thn h SER 58 Ca -0.26 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1thn h SER 58 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1thn h SER 58 CO 0.42 0.00 0.00 -1.20 -0.53 0.00 0.00 176.83 175.52 1thn n SER 59 N -3.56 0.00 -0.06 6.23 7.64 -1.26 -2.60 113.62 120.00 1thn n SER 59 Ca 0.01 -0.83 -0.07 0.00 1.01 0.00 0.00 58.87 58.99 1thn n SER 59 Cb 0.35 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.47 1thn n SER 59 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1thn n GLY 60 N 0.49 -0.43 0.09 0.23 0.00 0.37 -4.20 105.19 101.75 1thn n GLY 60 Ca 0.16 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1thn n GLY 60 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1thn h LEU 61 N 0.00 0.16 -0.69 0.99 3.38 -1.31 -2.68 115.31 115.16 1thn h LEU 61 Ca -0.32 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 57.65 1thn h LEU 61 Cb 1.63 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 42.26 1thn h LEU 61 CO -0.01 0.22 0.31 1.23 0.09 0.00 0.00 178.44 180.28 1thn h GLY 62 N 0.10 1.03 2.00 0.83 0.00 -1.73 0.52 103.07 105.81 1thn h GLY 62 Ca 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 1thn h GLY 62 CO -0.01 0.00 -0.16 -0.24 0.00 0.00 0.00 176.54 176.14 1thn h VAL 63 N 0.52 0.86 0.16 4.60 3.04 -1.70 0.50 116.25 124.24 1thn h VAL 63 Ca 0.35 -0.61 -0.01 0.00 -1.01 0.00 0.00 66.70 65.43 1thn h VAL 63 Cb 0.43 1.35 0.00 0.00 -2.01 0.00 0.00 31.29 31.06 1thn h VAL 63 CO -0.31 0.16 -0.08 0.40 -1.01 0.00 0.00 177.57 176.73 1thn h ILE 64 N 0.00 0.45 -0.49 3.17 2.04 -0.52 -2.84 117.51 119.31 1thn h ILE 64 Ca -0.00 -1.07 0.05 0.00 1.00 0.00 0.00 64.86 64.84 1thn h ILE 64 Cb 0.34 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1thn h ILE 64 CO 0.02 0.13 0.33 0.25 0.00 0.00 0.00 178.15 178.88 1thn h LEU 65 N -1.00 0.39 0.16 1.44 5.85 0.11 0.61 115.31 122.87 1thn h LEU 65 Ca -0.02 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1thn h LEU 65 Cb 0.38 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1thn h LEU 65 CO 0.04 0.26 -0.20 1.23 -0.34 0.00 0.00 178.44 179.43 1thn h GLY 66 N 0.45 -0.41 1.35 3.75 0.00 -0.03 -0.41 103.07 107.77 1thn h GLY 66 Ca 0.21 0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.69 1thn h GLY 66 CO -0.05 -0.19 -0.02 3.21 0.00 0.00 0.00 176.54 179.49 1thn h ARG 67 N -0.41 0.79 -0.82 4.80 -0.00 -0.98 -2.70 114.38 115.06 1thn h ARG 67 Ca 0.01 -0.22 0.15 0.00 -0.50 0.00 0.00 59.98 59.42 1thn h ARG 67 Cb 0.41 -0.09 -0.10 0.00 0.00 0.00 0.00 29.97 30.19 1thn h ARG 67 CO -0.07 0.81 0.38 -0.92 0.00 0.00 0.00 179.97 180.17 1thn h TYR 68 N 0.74 0.67 0.00 3.04 3.20 0.11 0.38 116.97 125.10 1thn h TYR 68 Ca 0.14 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 1thn h TYR 68 Cb 0.48 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1thn h TYR 68 CO 0.02 0.12 -0.17 0.87 -1.64 0.00 0.00 178.16 177.37 1thn h LYS 69 N 0.54 0.00 -0.19 1.82 1.57 -0.86 -2.18 116.57 117.27 1thn h LYS 69 Ca 0.45 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.10 1thn h LYS 69 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1thn h LYS 69 CO -0.39 0.17 -0.38 1.96 -0.57 0.00 0.00 179.45 180.24 1thn h GLN 70 N 0.00 0.60 0.01 3.15 4.20 -0.01 -2.98 115.11 120.07 1thn h GLN 70 Ca -0.00 -0.39 -0.21 0.00 0.06 0.00 0.00 58.65 58.11 1thn h GLN 70 Cb 0.98 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 1thn h GLN 70 CO 0.02 1.00 -0.91 0.82 -0.67 0.00 0.00 178.83 179.09 1thn h ILE 71 N 0.27 1.46 -0.46 2.54 1.08 -1.16 -3.15 117.51 118.09 1thn h ILE 71 Ca 0.01 -2.57 0.03 0.00 -0.39 0.00 0.00 64.86 61.94 1thn h ILE 71 Cb 0.98 2.46 -0.02 0.00 -3.07 0.00 0.00 36.82 37.17 1thn h ILE 71 CO 0.09 0.76 0.31 0.50 -0.69 0.00 0.00 178.15 179.11 1thn h LYS 72 N 0.15 0.48 0.00 2.37 3.64 -1.40 -2.12 116.57 119.69 1thn h LYS 72 Ca -0.06 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1thn h LYS 72 Cb 1.54 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 33.25 1thn h LYS 72 CO 0.15 0.32 -0.11 -0.91 -2.27 0.00 0.00 179.45 176.62 1thn h ASN 73 N 0.50 0.00 -0.34 4.20 2.35 -1.48 -2.73 115.58 118.09 1thn h ASN 73 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1thn h ASN 73 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1thn h ASN 73 CO -0.05 0.11 0.00 1.33 -1.65 0.00 0.00 177.43 177.18 1thn n VAL 74 N -3.61 1.63 -2.48 2.81 0.24 -0.84 -4.99 118.33 111.09 1thn n VAL 74 Ca -0.02 -1.39 -0.14 0.00 -2.04 0.00 0.00 64.34 60.75 1thn n VAL 74 Cb 0.24 0.14 0.01 0.00 -1.47 0.00 0.00 33.84 32.76 1thn n VAL 74 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1thn n GLY 75 N 0.14 -0.13 0.71 7.63 0.00 -1.03 -4.99 105.19 107.52 1thn n GLY 75 Ca 0.17 -0.28 -0.05 0.00 0.00 0.00 0.00 46.02 45.86 1thn n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1thn n GLY 76 N -1.12 3.17 3.34 -0.02 0.00 -0.93 -5.04 105.19 104.59 1thn n GLY 76 Ca -0.12 -2.20 -0.17 0.00 0.00 0.00 0.00 46.02 43.53 1thn n GLY 76 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1thn s GLN 77 N -2.41 1.34 -0.09 1.61 -0.21 -1.23 -4.43 119.66 114.25 1thn s GLN 77 Ca 0.05 -1.67 0.04 0.00 0.02 0.00 0.00 55.36 53.80 1thn s GLN 77 Cb -0.00 -0.69 0.00 0.00 1.00 0.00 0.00 33.01 33.32 1thn s GLN 77 CO 0.03 -0.06 -0.21 1.41 -2.12 0.00 0.00 175.29 174.34 1thn s MET 78 N -3.83 2.63 -0.03 2.91 -2.45 -1.26 -2.09 119.30 115.18 1thn s MET 78 Ca 0.27 -0.76 0.04 0.00 -1.25 0.00 0.00 55.69 54.00 1thn s MET 78 Cb 0.05 -2.04 -0.00 0.00 1.25 0.00 0.00 34.83 34.09 1thn s MET 78 CO 0.08 0.16 -0.15 0.08 1.05 0.00 0.00 175.02 176.24 1thn s VAL 79 N 0.37 1.25 0.08 10.11 1.01 -0.50 -1.63 120.40 131.09 1thn s VAL 79 Ca -0.16 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.25 1thn s VAL 79 Cb -0.17 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1thn s VAL 79 CO 0.07 0.36 -0.10 -0.69 0.00 0.00 0.00 175.10 174.75 1thn s VAL 80 N -0.01 3.39 0.06 2.92 1.01 0.24 -1.09 120.40 126.93 1thn s VAL 80 Ca -0.02 -1.15 -0.03 0.00 0.00 0.00 0.00 61.98 60.78 1thn s VAL 80 Cb -0.10 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1thn s VAL 80 CO 0.01 0.19 0.04 0.00 0.00 0.00 0.00 175.10 175.34 1thn n ALA 82 N 0.14 -1.14 -2.55 0.00 0.00 -1.03 -1.77 120.51 114.16 1thn n ALA 82 Ca -0.15 0.33 -0.43 0.00 0.00 0.00 0.00 53.44 53.20 1thn n ALA 82 Cb 0.61 -4.63 -0.02 0.00 0.00 0.00 0.00 19.45 15.41 1thn n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1thn s VAL 83 N -3.24 4.50 1.33 0.00 1.01 -1.26 -3.02 120.40 119.71 1thn s VAL 83 Ca 0.45 1.80 -0.19 0.00 0.00 0.00 0.00 61.98 64.04 1thn s VAL 83 Cb -0.20 -4.16 0.34 0.00 0.00 0.00 0.00 36.38 32.35 1thn s VAL 83 CO 0.56 -0.13 0.96 -0.94 0.00 0.00 0.00 175.10 175.55 1thn s SER 84 N 1.52 -0.37 0.12 3.32 1.04 -1.26 -4.71 113.70 113.35 1thn s SER 84 Ca 0.50 1.09 -0.10 0.00 0.48 0.00 0.00 55.95 57.91 1thn s SER 84 Cb -0.19 -1.61 -0.12 0.00 0.10 0.00 0.00 66.02 64.20 1thn s SER 84 CO 0.12 -4.97 1.32 -0.65 0.98 0.00 0.00 173.24 170.04 1thn h PRO 85 N -3.15 0.71 0.83 4.02 0.11 -1.98 -1.31 132.00 131.23 1thn h PRO 85 Ca -0.51 -0.59 -0.04 0.00 0.11 0.00 0.00 66.00 64.97 1thn h PRO 85 Cb 1.34 0.13 0.01 0.00 0.11 0.00 0.00 31.00 32.59 1thn h PRO 85 CO 0.37 1.21 -0.40 0.00 -0.21 0.00 0.00 178.00 178.97 1thn h ALA 86 N 0.62 -1.30 -0.99 -0.75 0.00 -1.99 -1.41 119.26 113.45 1thn h ALA 86 Ca -0.06 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 54.73 1thn h ALA 86 Cb 1.42 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 19.55 1thn h ALA 86 CO 0.16 -1.22 0.62 0.28 0.00 0.00 0.00 179.25 179.09 1thn h VAL 87 N -1.12 0.91 0.00 0.00 2.07 -1.92 -0.34 116.25 115.86 1thn h VAL 87 Ca -0.11 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 1thn h VAL 87 Cb 0.85 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1thn h VAL 87 CO 0.19 0.18 -0.18 0.50 0.02 0.00 0.00 177.57 178.28 1thn h LYS 88 N 0.97 0.00 -0.09 1.57 3.11 -1.10 -2.36 116.57 118.67 1thn h LYS 88 Ca 0.49 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 58.18 1thn h LYS 88 Cb 0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 1thn h LYS 88 CO -0.27 0.18 -0.60 -0.09 -2.81 0.00 0.00 179.45 175.86 1thn h ARG 89 N 0.00 0.30 0.00 1.90 2.43 0.09 -2.62 114.38 116.48 1thn h ARG 89 Ca -0.00 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1thn h ARG 89 Cb 0.35 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1thn h ARG 89 CO 0.02 0.81 0.00 -0.07 -1.51 0.00 0.00 179.97 179.22 1thn h LEU 90 N 0.22 0.00 0.00 3.80 3.38 -1.25 -1.60 115.31 119.87 1thn h LEU 90 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1thn h LEU 90 Cb 1.11 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1thn h LEU 90 CO 0.10 0.00 -1.01 -0.26 0.09 0.00 0.00 178.44 177.36 1thn h PHE 91 N 0.00 0.00 0.20 1.13 0.05 -1.29 -3.17 116.94 113.85 1thn h PHE 91 Ca 0.00 0.00 -0.29 0.00 3.82 0.00 0.00 57.97 61.50 1thn h PHE 91 Cb 0.55 0.00 0.02 0.00 2.00 0.00 0.00 35.95 38.53 1thn h PHE 91 CO 0.00 0.83 -1.31 -0.44 -0.18 0.00 0.00 178.31 177.21 1thn h ASP 92 N 0.00 0.65 0.15 2.17 3.32 -1.33 -1.01 116.42 120.38 1thn h ASP 92 Ca -0.06 -0.93 0.01 0.00 0.02 0.00 0.00 57.03 56.07 1thn h ASP 92 Cb 1.69 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.98 1thn h ASP 92 CO 0.10 1.62 -0.51 -0.03 -1.72 0.00 0.00 179.24 178.70 1thn h MET 93 N -0.07 -0.72 0.92 3.56 4.05 -1.41 -3.06 114.93 118.20 1thn h MET 93 Ca -0.24 0.05 -0.05 0.00 -0.28 0.00 0.00 59.70 59.18 1thn h MET 93 Cb 1.95 0.16 0.01 0.00 -0.80 0.00 0.00 31.60 32.93 1thn h MET 93 CO 0.20 -0.48 -0.44 0.66 0.23 0.00 0.00 176.91 177.08 1thn h SER 94 N -0.75 -1.05 0.00 1.39 4.64 -1.70 -3.47 113.55 112.61 1thn h SER 94 Ca -0.01 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1thn h SER 94 Cb 0.74 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1thn h SER 94 CO -0.25 -0.74 0.00 0.61 -0.87 0.00 0.00 176.83 175.58 1thn n GLY 95 N -1.57 1.34 0.02 -0.77 0.00 -1.10 -5.00 105.19 98.11 1thn n GLY 95 Ca -0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.98 1thn n GLY 95 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1thn n LEU 96 N 0.00 0.14 0.00 0.99 7.94 -0.43 -2.95 117.00 122.69 1thn n LEU 96 Ca 0.00 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 1thn n LEU 96 Cb 0.00 -0.48 0.02 0.00 0.53 0.00 0.00 43.42 43.49 1thn n LEU 96 CO 0.00 -0.12 0.23 2.22 -1.11 0.00 0.00 177.39 178.61 1thn n PHE 97 N -1.64 0.00 -2.76 1.96 1.16 -0.91 -0.28 117.46 114.99 1thn n PHE 97 Ca 0.06 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.61 1thn n PHE 97 Cb 0.30 0.00 0.05 0.00 -1.61 0.00 0.00 39.48 38.22 1thn n PHE 97 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 1thn n LYS 98 N -0.52 1.87 0.13 3.97 5.02 -1.15 -4.90 118.16 122.57 1thn n LYS 98 Ca 0.00 -3.56 0.00 0.00 -2.02 0.00 0.00 58.31 52.74 1thn n LYS 98 Cb 0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 1thn n LYS 98 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1thn n ILE 99 N -0.58 0.00 -3.96 -0.18 5.41 0.61 -5.13 119.36 115.54 1thn n ILE 99 Ca 0.10 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.59 1thn n ILE 99 Cb 0.81 -0.45 -0.01 0.00 -0.71 0.00 0.00 39.64 39.28 1thn n ILE 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 1thn s ILE 100 N -2.00 1.62 -0.30 1.39 -4.36 -1.19 -4.98 121.20 111.38 1thn s ILE 100 Ca 0.00 -1.53 -0.09 0.00 -0.26 0.00 0.00 60.65 58.77 1thn s ILE 100 Cb 0.00 -2.15 -0.01 0.00 1.25 0.00 0.00 42.46 41.55 1thn s ILE 100 CO 0.00 0.00 0.12 -0.13 0.24 0.00 0.00 174.94 175.17 1thn s ARG 101 N -4.25 3.30 -0.23 0.37 0.52 -0.65 -4.95 118.95 113.07 1thn s ARG 101 Ca 0.32 -0.73 -0.14 0.00 -0.52 0.00 0.00 55.73 54.65 1thn s ARG 101 Cb -0.02 -3.49 -0.04 0.00 0.52 0.00 0.00 34.95 31.92 1thn s ARG 101 CO 0.20 -0.40 0.33 0.08 0.02 0.00 0.00 175.30 175.52 1thn s VAL 102 N 1.58 5.24 0.11 3.52 1.01 -1.26 0.82 120.40 131.43 1thn s VAL 102 Ca 0.04 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1thn s VAL 102 Cb -0.17 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1thn s VAL 102 CO 0.05 0.25 0.01 -0.62 0.00 0.00 0.00 175.10 174.80 1thn n GLU 103 N 4.64 1.68 -0.04 2.72 -0.58 0.63 -4.93 120.64 124.75 1thn n GLU 103 Ca -0.10 -0.79 -0.05 0.00 -0.42 0.00 0.00 57.16 55.80 1thn n GLU 103 Cb 0.51 0.19 -0.14 0.00 -0.57 0.00 0.00 31.44 31.44 1thn n GLU 103 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1thn n ALA 104 N -2.67 1.77 -3.62 0.62 0.00 -1.26 -3.74 120.51 111.62 1thn n ALA 104 Ca -0.04 -0.94 -0.08 0.00 0.00 0.00 0.00 53.44 52.38 1thn n ALA 104 Cb 0.14 -0.56 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 1thn n ALA 104 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1thn s ASP 105 N -5.54 -0.14 0.38 0.00 1.47 -1.26 -2.46 116.67 109.12 1thn s ASP 105 Ca -0.07 -0.79 0.11 0.00 1.18 0.00 0.00 52.55 52.98 1thn s ASP 105 Cb 0.08 0.70 0.90 0.00 -0.34 0.00 0.00 42.92 44.26 1thn s ASP 105 CO 0.84 -1.33 1.87 -0.08 0.68 0.00 0.00 175.17 177.15 1thn h GLU 106 N 2.08 0.58 -0.30 2.11 4.81 -1.96 -1.53 114.58 120.36 1thn h GLU 106 Ca -0.23 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 58.88 1thn h GLU 106 Cb 1.25 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1thn h GLU 106 CO 0.29 0.38 -0.15 1.96 -0.73 0.00 0.00 179.01 180.77 1thn h GLN 107 N 0.60 0.64 0.00 1.92 1.08 -1.98 -0.60 115.11 116.76 1thn h GLN 107 Ca 0.44 -0.28 -0.02 0.00 -1.45 0.00 0.00 58.65 57.34 1thn h GLN 107 Cb 0.81 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1thn h GLN 107 CO -0.19 0.86 -0.09 0.74 -0.95 0.00 0.00 178.83 179.20 1thn h PHE 108 N 0.39 0.00 0.42 2.96 -1.00 -1.89 -0.14 116.94 117.69 1thn h PHE 108 Ca 0.07 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.83 1thn h PHE 108 Cb 0.67 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.24 1thn h PHE 108 CO 0.06 0.09 -0.20 0.00 -1.61 0.00 0.00 178.31 176.65 1thn h ALA 109 N 1.91 -0.57 -0.09 2.45 0.00 -1.06 -1.18 119.26 120.73 1thn h ALA 109 Ca -0.00 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.76 1thn h ALA 109 Cb 0.76 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1thn h ALA 109 CO 0.01 -0.57 0.11 -0.07 0.00 0.00 0.00 179.25 178.73 1thn h LEU 110 N -1.06 0.00 -0.18 0.00 3.38 -1.01 -0.00 115.31 116.44 1thn h LEU 110 Ca -0.06 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.69 1thn h LEU 110 Cb 0.53 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.29 1thn h LEU 110 CO 0.10 0.00 -0.80 -0.61 0.09 0.00 0.00 178.44 177.22 1thn h GLN 111 N 0.00 0.74 0.00 1.13 4.15 -0.86 -1.17 115.11 119.09 1thn h GLN 111 Ca 0.04 -0.62 0.00 0.00 0.77 0.00 0.00 58.65 58.84 1thn h GLN 111 Cb 0.26 0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.09 1thn h GLN 111 CO -0.00 1.23 0.00 0.00 -1.93 0.00 0.00 178.83 178.12 1thn n ALA 112 N -2.60 1.42 0.22 3.38 0.00 -0.04 -2.10 120.51 120.79 1thn n ALA 112 Ca -0.07 0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.49 1thn n ALA 112 Cb 0.75 -1.25 0.13 0.00 0.00 0.00 0.00 19.45 19.08 1thn n ALA 112 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1thn n LEU 113 N -1.88 2.74 -2.06 0.00 4.77 -1.09 -4.97 117.00 114.51 1thn n LEU 113 Ca 0.01 -1.47 -0.15 0.00 -0.03 0.00 0.00 56.01 54.37 1thn n LEU 113 Cb 0.13 -0.15 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1thn n LEU 113 CO 0.12 0.60 -0.03 0.61 -1.33 0.00 0.00 177.39 177.37 1thn n GLY 114 N 0.87 -0.15 3.69 -0.72 0.00 -0.89 -4.96 105.19 103.02 1thn n GLY 114 Ca 0.12 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1thn n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1thn s VAL 115 N -2.94 4.87 -2.00 1.61 1.01 -0.46 -5.06 120.40 117.44 1thn s VAL 115 Ca 0.18 1.79 0.29 0.00 0.00 0.00 0.00 61.98 64.24 1thn s VAL 115 Cb -0.08 -4.20 0.83 0.00 0.00 0.00 0.00 36.38 32.93 1thn s VAL 115 CO 0.22 0.07 2.09 0.00 0.00 0.00 0.00 175.10 177.48