#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cre s SER 2 N 0.00 5.79 0.30 1.61 1.04 -1.26 -4.98 113.70 116.20 2cre s SER 2 Ca 0.00 0.07 0.06 0.00 0.48 0.00 0.00 55.95 56.56 2cre s SER 2 Cb 0.00 -2.02 0.82 0.00 0.10 0.00 0.00 66.02 64.92 2cre s SER 2 CO 0.00 0.12 1.67 -1.28 0.98 0.00 0.00 173.24 174.72 2cre h SER 3 N 7.14 0.26 0.00 7.02 0.87 -2.11 -3.45 113.55 123.27 2cre h SER 3 Ca -0.38 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2cre h SER 3 Cb 1.17 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 2cre h SER 3 CO 0.68 -0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.49 2cre n GLY 4 N -1.34 0.64 3.54 5.77 0.00 -1.26 -5.10 105.19 107.44 2cre n GLY 4 Ca 0.24 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 2cre n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cre n SER 5 N 0.00 -0.32 -4.80 1.61 2.88 -1.26 -4.97 113.62 106.77 2cre n SER 5 Ca 0.00 0.66 -0.37 0.00 -1.33 0.00 0.00 58.87 57.82 2cre n SER 5 Cb 0.00 -1.30 -0.06 0.00 -0.75 0.00 0.00 64.21 62.09 2cre n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cre s SER 6 N -1.48 6.64 -0.17 -3.46 1.04 -1.26 -5.08 113.70 109.93 2cre s SER 6 Ca 0.70 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.90 2cre s SER 6 Cb -0.36 -2.22 0.03 0.00 0.10 0.00 0.00 66.02 63.57 2cre s SER 6 CO 0.53 0.23 -0.11 -0.83 0.98 0.00 0.00 173.24 174.04 2cre s GLY 7 N -0.42 1.14 0.44 7.32 0.00 -1.26 -4.71 107.32 109.83 2cre s GLY 7 Ca 0.21 -0.99 0.04 0.00 0.00 0.00 0.00 44.72 43.99 2cre s GLY 7 CO 0.09 0.66 0.62 1.08 0.00 0.00 0.00 173.10 175.55 2cre s LEU 8 N 1.48 3.62 -0.08 0.66 2.01 -0.71 -4.91 118.68 120.76 2cre s LEU 8 Ca 0.02 -0.13 0.01 0.00 0.01 0.00 0.00 54.13 54.03 2cre s LEU 8 Cb -0.14 -2.82 0.02 0.00 0.01 0.00 0.00 46.19 43.25 2cre s LEU 8 CO -0.09 -0.79 -0.07 -0.76 1.01 0.00 0.00 176.35 175.65 2cre s LEU 9 N -4.46 1.27 0.09 1.79 1.43 -1.26 0.30 118.68 117.84 2cre s LEU 9 Ca 0.52 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 53.46 2cre s LEU 9 Cb -0.10 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.41 2cre s LEU 9 CO 0.35 -0.07 -0.15 0.00 0.23 0.00 0.00 176.35 176.71 2cre s ALA 10 N 1.23 1.35 0.46 4.21 0.00 -0.73 -3.54 121.76 124.75 2cre s ALA 10 Ca -0.05 -1.12 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 2cre s ALA 10 Cb -0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 2cre s ALA 10 CO -0.02 0.17 0.70 0.50 0.00 0.00 0.00 175.76 177.11 2cre s ARG 11 N -2.06 3.10 -0.42 0.00 3.52 -0.29 -1.00 118.95 121.80 2cre s ARG 11 Ca 0.02 -0.38 -0.04 0.00 -0.13 0.00 0.00 55.73 55.21 2cre s ARG 11 Cb -0.08 -2.52 0.11 0.00 -1.56 0.00 0.00 34.95 30.90 2cre s ARG 11 CO 0.03 -0.29 0.24 0.00 -0.81 0.00 0.00 175.30 174.46 2cre s ALA 12 N -2.61 3.21 0.33 6.12 0.00 -0.92 -0.69 121.76 127.20 2cre s ALA 12 Ca 0.48 -2.54 0.32 0.00 0.00 0.00 0.00 51.96 50.23 2cre s ALA 12 Cb -0.10 -2.51 1.55 0.00 0.00 0.00 0.00 23.12 22.06 2cre s ALA 12 CO 0.39 -1.83 2.07 -0.07 0.00 0.00 0.00 175.76 176.33 2cre h LEU 13 N 8.14 0.00 -7.60 0.00 3.38 -1.77 -1.48 115.31 115.98 2cre h LEU 13 Ca -0.15 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.68 2cre h LEU 13 Cb 1.05 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.59 2cre h LEU 13 CO 0.74 0.07 -0.41 -0.31 0.09 0.00 0.00 178.44 178.62 2cre s TYR 14 N -3.95 -0.11 0.73 1.13 1.51 -1.25 -4.83 117.35 110.58 2cre s TYR 14 Ca -0.02 0.20 -0.11 0.00 -1.01 0.00 0.00 57.07 56.14 2cre s TYR 14 Cb 0.11 0.04 0.03 0.00 -0.11 0.00 0.00 41.96 42.03 2cre s TYR 14 CO 0.54 -0.28 1.08 0.16 -1.11 0.00 0.00 175.55 175.94 2cre s ASP 15 N -0.97 5.10 -0.03 2.29 -4.77 -1.26 -4.52 116.67 112.52 2cre s ASP 15 Ca -0.10 1.44 0.01 0.00 -3.30 0.00 0.00 52.55 50.59 2cre s ASP 15 Cb -0.05 -2.27 0.02 0.00 -1.09 0.00 0.00 42.92 39.53 2cre s ASP 15 CO 0.02 -1.60 -0.03 0.21 0.70 0.00 0.00 175.17 174.47 2cre s ASN 16 N -3.92 0.72 -0.93 2.11 2.47 -0.16 -4.94 114.94 110.29 2cre s ASN 16 Ca 0.59 -0.09 -0.04 0.00 0.42 0.00 0.00 52.86 53.74 2cre s ASN 16 Cb -0.14 -0.32 0.23 0.00 -1.45 0.00 0.00 41.25 39.57 2cre s ASN 16 CO 0.54 -0.05 0.85 0.00 -3.72 0.00 0.00 177.10 174.72 2cre s PRO 18 N -1.24 3.98 -0.14 0.00 0.04 -1.26 -4.97 135.00 131.40 2cre s PRO 18 Ca 0.28 1.86 0.04 0.00 0.04 0.00 0.00 61.00 63.22 2cre s PRO 18 Cb -0.09 -2.63 -0.23 0.00 0.04 0.00 0.00 34.50 31.60 2cre s PRO 18 CO -0.11 -0.39 0.26 -3.47 0.04 0.00 0.00 177.00 173.33 2cre n ASP 19 N -0.04 1.41 -4.89 6.66 -0.08 -1.26 -4.98 116.55 113.36 2cre n ASP 19 Ca 0.05 0.15 -0.25 0.00 -1.51 0.00 0.00 54.79 53.23 2cre n ASP 19 Cb 0.46 -0.24 -0.01 0.00 2.34 0.00 0.00 41.12 43.68 2cre n ASP 19 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2cre h SER 21 N 0.83 0.00 -0.88 0.00 4.64 -1.99 -3.28 113.55 112.87 2cre h SER 21 Ca -0.38 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 61.17 2cre h SER 21 Cb 1.29 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.25 2cre h SER 21 CO 0.58 0.80 0.26 -2.24 -0.87 0.00 0.00 176.83 175.36 2cre h ASP 22 N 0.00 0.05 -3.38 4.97 3.04 -1.96 -3.41 116.42 115.73 2cre h ASP 22 Ca -0.01 0.19 -0.45 0.00 -3.24 0.00 0.00 57.03 53.52 2cre h ASP 22 Cb 1.50 0.24 0.07 0.00 -1.04 0.00 0.00 39.33 40.11 2cre h ASP 22 CO 0.10 -0.13 0.16 -1.61 -2.04 0.00 0.00 179.24 175.72 2cre s GLU 23 N -5.93 2.23 -0.06 4.15 2.02 -1.24 -0.53 118.70 119.35 2cre s GLU 23 Ca -0.12 -0.43 0.02 0.00 0.02 0.00 0.00 54.97 54.46 2cre s GLU 23 Cb 0.26 -2.25 -0.03 0.00 0.10 0.00 0.00 34.13 32.21 2cre s GLU 23 CO 0.77 -1.14 -0.10 -1.17 0.02 0.00 0.00 175.26 173.65 2cre s LEU 24 N -5.13 3.01 -0.45 1.80 0.20 0.23 -4.18 118.68 114.15 2cre s LEU 24 Ca 0.60 -0.09 -0.11 0.00 0.69 0.00 0.00 54.13 55.22 2cre s LEU 24 Cb -0.10 -1.64 0.09 0.00 -0.43 0.00 0.00 46.19 44.11 2cre s LEU 24 CO 0.43 0.35 0.33 0.00 -0.29 0.00 0.00 176.35 177.18 2cre s ALA 25 N -0.79 3.40 0.10 5.97 0.00 -1.26 -4.54 121.76 124.64 2cre s ALA 25 Ca 0.12 -2.29 0.05 0.00 0.00 0.00 0.00 51.96 49.85 2cre s ALA 25 Cb -0.11 -2.83 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 2cre s ALA 25 CO 0.01 -1.77 -0.13 -0.59 0.00 0.00 0.00 175.76 173.28 2cre s PHE 26 N 1.46 1.28 0.35 0.00 -0.12 -1.24 -4.99 117.98 114.71 2cre s PHE 26 Ca 0.04 -0.54 0.07 0.00 -0.05 0.00 0.00 56.93 56.44 2cre s PHE 26 Cb -0.25 -0.69 -0.01 0.00 -0.63 0.00 0.00 43.02 41.44 2cre s PHE 26 CO 0.02 0.09 0.44 -1.12 -0.05 0.00 0.00 175.22 174.60 2cre s SER 27 N -2.23 5.74 0.22 1.98 0.01 -1.26 -0.99 113.70 117.18 2cre s SER 27 Ca 0.05 -0.31 -0.30 0.00 1.31 0.00 0.00 55.95 56.70 2cre s SER 27 Cb -0.06 -1.07 -0.10 0.00 0.21 0.00 0.00 66.02 65.00 2cre s SER 27 CO 0.02 -0.47 1.42 -0.60 0.41 0.00 0.00 173.24 174.03 2cre s ARG 28 N -4.15 4.29 0.00 12.44 3.00 -1.26 -3.05 118.95 130.22 2cre s ARG 28 Ca 0.45 2.24 0.00 0.00 -1.00 0.00 0.00 55.73 57.42 2cre s ARG 28 Cb -0.08 -3.14 0.00 0.00 0.00 0.00 0.00 34.95 31.72 2cre s ARG 28 CO 0.30 -0.40 0.00 0.41 0.00 0.00 0.00 175.30 175.61 2cre n GLY 29 N 2.48 0.90 3.41 8.12 0.00 -0.56 -4.98 105.19 114.58 2cre n GLY 29 Ca 0.08 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 2cre n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cre s ASP 30 N -2.59 3.60 -0.31 1.61 1.11 -1.17 -4.94 116.67 113.97 2cre s ASP 30 Ca 0.00 -0.42 -0.17 0.00 0.18 0.00 0.00 52.55 52.15 2cre s ASP 30 Cb 0.00 -0.55 -0.02 0.00 1.07 0.00 0.00 42.92 43.42 2cre s ASP 30 CO 0.00 0.29 0.45 -0.63 1.18 0.00 0.00 175.17 176.46 2cre s ILE 31 N -0.81 5.09 -0.02 0.77 -1.09 -1.26 -2.17 121.20 121.72 2cre s ILE 31 Ca 0.13 0.43 -0.03 0.00 -2.23 0.00 0.00 60.65 58.94 2cre s ILE 31 Cb -0.10 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 2cre s ILE 31 CO 0.03 -0.05 0.17 -0.76 -1.23 0.00 0.00 174.94 173.09 2cre s LEU 32 N 2.23 4.33 -0.60 2.97 2.01 -0.17 -4.96 118.68 124.48 2cre s LEU 32 Ca 0.17 0.34 -0.16 0.00 0.01 0.00 0.00 54.13 54.49 2cre s LEU 32 Cb -0.16 -2.52 0.14 0.00 0.01 0.00 0.00 46.19 43.67 2cre s LEU 32 CO 0.11 0.28 0.57 -0.89 1.01 0.00 0.00 176.35 177.44 2cre s THR 33 N -1.28 5.25 -0.43 5.49 2.01 -1.26 -1.77 115.64 123.66 2cre s THR 33 Ca 0.25 -1.65 -0.27 0.00 0.31 0.00 0.00 61.69 60.34 2cre s THR 33 Cb -0.12 -4.38 -0.05 0.00 0.01 0.00 0.00 72.50 67.96 2cre s THR 33 CO 0.17 -0.93 2.18 -0.63 -0.69 0.00 0.00 174.62 174.71 2cre s ILE 34 N 1.43 3.14 -0.03 1.82 1.01 0.15 -2.54 121.20 126.17 2cre s ILE 34 Ca 0.07 0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.57 2cre s ILE 34 Cb -0.25 -3.28 -0.21 0.00 0.01 0.00 0.00 42.46 38.73 2cre s ILE 34 CO 0.01 -0.24 1.20 -0.07 0.00 0.00 0.00 174.94 175.84 2cre h LEU 35 N 17.15 0.05 -7.62 2.97 3.38 -0.89 -1.89 115.31 128.47 2cre h LEU 35 Ca -0.30 -0.56 -0.27 0.00 0.09 0.00 0.00 57.88 56.85 2cre h LEU 35 Cb 1.23 -0.01 -0.31 0.00 0.09 0.00 0.00 40.66 41.65 2cre h LEU 35 CO 1.11 0.60 -0.72 -1.83 0.09 0.00 0.00 178.44 177.68 2cre s GLU 36 N -3.96 -0.02 -0.01 1.13 -1.05 -1.22 -4.68 118.70 108.88 2cre s GLU 36 Ca -0.16 0.10 -0.01 0.00 -0.15 0.00 0.00 54.97 54.75 2cre s GLU 36 Cb 0.01 -0.13 -0.27 0.00 -0.44 0.00 0.00 34.13 33.31 2cre s GLU 36 CO 0.69 -0.09 0.78 1.96 0.95 0.00 0.00 175.26 179.55 2cre h GLN 37 N 6.76 0.21 -6.57 -4.83 4.20 -1.92 -3.19 115.11 109.76 2cre h GLN 37 Ca -0.36 -0.36 -0.55 0.00 0.06 0.00 0.00 58.65 57.44 2cre h GLN 37 Cb 1.16 0.13 -0.07 0.00 0.30 0.00 0.00 27.48 29.01 2cre h GLN 37 CO 0.49 1.04 1.00 -1.58 -0.67 0.00 0.00 178.83 179.11 2cre s HIS 38 N -2.61 2.57 -0.38 2.96 2.46 -1.26 -4.86 115.29 114.17 2cre s HIS 38 Ca -0.10 0.50 0.01 0.00 0.47 0.00 0.00 55.06 55.94 2cre s HIS 38 Cb 0.07 -4.47 0.12 0.00 -0.13 0.00 0.00 32.58 28.17 2cre s HIS 38 CO 0.84 -1.63 0.17 0.08 -2.47 0.00 0.00 174.74 171.72 2cre s VAL 39 N 5.10 1.30 0.20 0.89 1.01 -1.26 -4.98 120.40 122.66 2cre s VAL 39 Ca 0.47 -2.11 -0.04 0.00 0.00 0.00 0.00 61.98 60.30 2cre s VAL 39 Cb -0.08 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 2cre s VAL 39 CO 0.27 -0.79 1.55 1.55 0.00 0.00 0.00 175.10 177.69 2cre h PRO 40 N 7.32 0.66 -0.04 2.72 0.13 -1.96 -2.91 132.00 137.91 2cre h PRO 40 Ca -0.06 -0.34 0.01 0.00 -0.87 0.00 0.00 66.00 64.74 2cre h PRO 40 Cb 0.97 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 2cre h PRO 40 CO 0.48 0.95 0.08 1.05 -0.23 0.00 0.00 178.00 180.33 2cre h GLU 41 N 0.53 0.00 -2.67 0.86 4.11 -2.01 -3.38 114.58 112.03 2cre h GLU 41 Ca 0.04 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.16 2cre h GLU 41 Cb 0.94 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 29.84 2cre h GLU 41 CO 0.09 0.00 -0.63 -1.12 0.07 0.00 0.00 179.01 177.42 2cre s SER 42 N -5.61 1.27 -0.55 3.06 0.01 -1.10 -5.11 113.70 105.68 2cre s SER 42 Ca -0.05 -0.11 -0.28 0.00 1.31 0.00 0.00 55.95 56.83 2cre s SER 42 Cb 0.14 0.35 0.02 0.00 0.21 0.00 0.00 66.02 66.73 2cre s SER 42 CO 0.48 -0.31 1.37 -0.70 0.41 0.00 0.00 173.24 174.49 2cre s GLU 43 N 2.32 3.37 0.00 12.44 -6.30 -1.25 -3.32 118.70 125.95 2cre s GLU 43 Ca 0.06 0.47 0.00 0.00 -2.50 0.00 0.00 54.97 52.99 2cre s GLU 43 Cb -0.15 -4.09 0.00 0.00 0.00 0.00 0.00 34.13 29.89 2cre s GLU 43 CO -0.11 -1.85 0.00 0.41 0.02 0.00 0.00 175.26 173.74 2cre n GLY 44 N 5.20 1.12 3.11 -1.50 0.00 -1.26 -5.10 105.19 106.76 2cre n GLY 44 Ca 0.12 -0.04 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 2cre n GLY 44 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2cre s TRP 45 N -2.05 0.63 -0.03 1.61 0.52 -1.21 -3.23 118.94 115.18 2cre s TRP 45 Ca 0.00 -0.98 0.03 0.00 0.02 0.00 0.00 56.10 55.17 2cre s TRP 45 Cb 0.00 -0.42 0.00 0.00 -1.15 0.00 0.00 33.47 31.90 2cre s TRP 45 CO 0.00 -0.29 -0.11 -1.58 0.02 0.00 0.00 176.95 174.98 2cre s TRP 46 N -3.66 1.19 -0.73 -1.98 0.51 0.16 -4.58 118.94 109.85 2cre s TRP 46 Ca 0.07 -0.32 -0.21 0.00 -2.12 0.00 0.00 56.10 53.53 2cre s TRP 46 Cb 0.06 -0.83 0.09 0.00 -0.81 0.00 0.00 33.47 31.98 2cre s TRP 46 CO -0.08 -0.12 0.97 0.21 -0.51 0.00 0.00 176.95 177.42 2cre s LYS 47 N 0.17 3.25 0.32 4.98 2.20 -1.21 0.15 119.74 129.60 2cre s LYS 47 Ca -0.04 -1.19 0.07 0.00 -0.36 0.00 0.00 55.97 54.45 2cre s LYS 47 Cb -0.10 -4.45 -0.03 0.00 -1.51 0.00 0.00 37.83 31.75 2cre s LYS 47 CO 0.01 -1.76 0.29 0.00 -0.36 0.00 0.00 175.35 173.53 2cre s LEU 49 N -3.99 2.24 -0.12 0.00 1.98 -1.05 -2.64 118.68 115.10 2cre s LEU 49 Ca 0.40 -0.56 -0.06 0.00 -2.89 0.00 0.00 54.13 51.02 2cre s LEU 49 Cb -0.07 -1.49 0.05 0.00 0.66 0.00 0.00 46.19 45.34 2cre s LEU 49 CO 0.27 0.08 0.28 -0.22 -1.89 0.00 0.00 176.35 174.87 2cre s LEU 50 N 0.84 0.35 -1.53 -0.68 2.96 -1.26 -4.00 118.68 115.35 2cre s LEU 50 Ca -0.06 0.60 -0.07 0.00 -0.22 0.00 0.00 54.13 54.38 2cre s LEU 50 Cb -0.15 0.87 0.07 0.00 0.50 0.00 0.00 46.19 47.48 2cre s LEU 50 CO -0.02 -0.17 0.19 1.41 -1.32 0.00 0.00 176.35 176.44 2cre n HIS 51 N 4.14 -1.13 -3.42 5.38 8.25 -1.26 0.90 115.22 128.09 2cre n HIS 51 Ca -0.24 0.59 -0.19 0.00 -0.26 0.00 0.00 57.72 57.62 2cre n HIS 51 Cb 0.54 -2.28 0.08 0.00 1.12 0.00 0.00 29.99 29.44 2cre n HIS 51 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cre n GLY 52 N -1.97 -0.37 0.08 -1.41 0.00 -1.26 -4.96 105.19 95.30 2cre n GLY 52 Ca -0.16 0.12 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 2cre n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cre n ARG 53 N -4.26 0.47 -3.41 1.61 5.12 0.26 -5.02 116.66 111.42 2cre n ARG 53 Ca -0.14 0.38 -0.17 0.00 -1.93 0.00 0.00 57.85 55.98 2cre n ARG 53 Cb 0.61 -1.54 0.09 0.00 -1.16 0.00 0.00 32.46 30.46 2cre n ARG 53 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2cre n GLN 54 N -4.47 -6.49 -4.67 5.56 6.02 -1.24 -4.93 117.38 107.16 2cre n GLN 54 Ca -0.10 0.84 -0.30 0.00 -0.01 0.00 0.00 57.00 57.43 2cre n GLN 54 Cb 0.37 -5.84 -0.09 0.00 1.02 0.00 0.00 30.24 25.70 2cre n GLN 54 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2cre s GLY 55 N -4.33 2.79 0.56 1.08 0.00 -1.08 -4.94 107.32 101.40 2cre s GLY 55 Ca 0.01 -1.06 -0.08 0.00 0.00 0.00 0.00 44.72 43.59 2cre s GLY 55 CO 0.72 -2.10 0.92 1.08 0.00 0.00 0.00 173.10 173.72 2cre s LEU 56 N -3.78 3.39 -0.02 0.66 1.43 0.31 -1.76 118.68 118.92 2cre s LEU 56 Ca 0.17 1.16 -0.03 0.00 -1.03 0.00 0.00 54.13 54.40 2cre s LEU 56 Cb 0.04 -4.15 0.00 0.00 0.03 0.00 0.00 46.19 42.12 2cre s LEU 56 CO 0.09 -0.77 0.08 0.00 0.23 0.00 0.00 176.35 175.97 2cre s ALA 57 N -2.99 -0.19 -0.43 4.21 0.00 0.40 0.74 121.76 123.50 2cre s ALA 57 Ca 0.52 0.07 -0.28 0.00 0.00 0.00 0.00 51.96 52.27 2cre s ALA 57 Cb -0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 2cre s ALA 57 CO 0.50 -0.08 1.76 -1.25 0.00 0.00 0.00 175.76 176.68 2cre s PRO 58 N -0.38 3.14 0.46 0.00 0.04 -1.26 0.38 135.00 137.39 2cre s PRO 58 Ca -0.04 1.09 0.28 0.00 0.04 0.00 0.00 61.00 62.37 2cre s PRO 58 Cb -0.03 -4.23 1.54 0.00 0.04 0.00 0.00 34.50 31.82 2cre s PRO 58 CO 0.00 -2.09 1.85 0.00 0.04 0.00 0.00 177.00 176.80 2cre h ALA 59 N 13.21 1.07 0.00 8.56 0.00 -1.88 0.20 119.26 140.41 2cre h ALA 59 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2cre h ALA 59 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2cre h ALA 59 CO 1.10 -0.07 0.00 -0.91 0.00 0.00 0.00 179.25 179.37 2cre h ASN 60 N 0.00 0.00 -0.28 0.00 4.21 -1.88 -3.08 115.58 114.55 2cre h ASN 60 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2cre h ASN 60 Cb 0.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.36 2cre h ASN 60 CO 0.00 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.68 2cre n ARG 61 N -3.03 2.29 -3.97 0.81 1.74 0.66 -5.00 116.66 110.17 2cre n ARG 61 Ca 0.03 -1.86 -0.21 0.00 -0.77 0.00 0.00 57.85 55.04 2cre n ARG 61 Cb 0.46 -1.27 -0.03 0.00 -1.02 0.00 0.00 32.46 30.60 2cre n ARG 61 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cre s LEU 62 N -1.00 4.02 -0.30 0.55 2.01 -1.05 -2.16 118.68 120.75 2cre s LEU 62 Ca 0.22 -0.13 -0.00 0.00 0.01 0.00 0.00 54.13 54.22 2cre s LEU 62 Cb 0.12 -2.59 0.09 0.00 0.01 0.00 0.00 46.19 43.83 2cre s LEU 62 CO 0.16 -0.11 0.08 -1.58 1.01 0.00 0.00 176.35 175.91 2cre s GLN 63 N -3.94 0.84 0.07 1.70 0.74 0.13 -4.87 119.66 114.33 2cre s GLN 63 Ca 0.35 -1.08 -0.31 0.00 0.05 0.00 0.00 55.36 54.38 2cre s GLN 63 Cb -0.08 -2.15 -0.07 0.00 1.10 0.00 0.00 33.01 31.81 2cre s GLN 63 CO 0.27 -0.92 1.45 0.42 -0.55 0.00 0.00 175.29 175.96 2cre s ILE 64 N 1.56 3.34 -0.27 -2.34 -1.09 -1.26 -1.14 121.20 120.01 2cre s ILE 64 Ca 0.08 0.88 -0.06 0.00 -2.23 0.00 0.00 60.65 59.31 2cre s ILE 64 Cb -0.17 -3.56 -0.01 0.00 -1.58 0.00 0.00 42.46 37.14 2cre s ILE 64 CO -0.21 0.03 0.05 -0.76 -1.23 0.00 0.00 174.94 172.83 2cre s LEU 65 N 1.77 3.53 0.24 2.97 1.43 -1.23 -4.98 118.68 122.40 2cre s LEU 65 Ca 0.66 -0.50 0.09 0.00 -1.03 0.00 0.00 54.13 53.35 2cre s LEU 65 Cb -0.36 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2cre s LEU 65 CO 0.29 -0.11 -0.02 -0.94 0.23 0.00 0.00 176.35 175.81 2cre s SER 66 N 1.53 4.53 0.00 2.29 1.04 -1.26 -4.86 113.70 116.97 2cre s SER 66 Ca 0.04 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2cre s SER 66 Cb -0.16 -0.85 0.00 0.00 0.10 0.00 0.00 66.02 65.11 2cre s SER 66 CO 0.02 0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2cre n GLY 67 N -0.63 1.86 0.23 7.32 0.00 -1.26 -5.02 105.19 107.68 2cre n GLY 67 Ca -0.08 -0.88 0.10 0.00 0.00 0.00 0.00 46.02 45.16 2cre n GLY 67 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cre h PRO 68 N 0.00 0.00 -7.38 1.61 0.13 -2.00 -3.45 132.00 120.91 2cre h PRO 68 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2cre h PRO 68 Cb 0.00 0.00 0.10 0.00 0.13 0.00 0.00 31.00 31.23 2cre h PRO 68 CO 0.00 0.22 0.36 -1.12 -0.23 0.00 0.00 178.00 177.23 2cre s SER 69 N -6.21 5.04 -1.52 1.44 0.01 -1.26 -3.86 113.70 107.34 2cre s SER 69 Ca -0.00 1.44 -0.11 0.00 1.31 0.00 0.00 55.95 58.59 2cre s SER 69 Cb 0.11 -2.26 0.08 0.00 0.21 0.00 0.00 66.02 64.16 2cre s SER 69 CO 0.63 -1.64 0.84 -0.24 0.41 0.00 0.00 173.24 173.24 2cre n SER 70 N -3.24 -3.41 0.00 2.44 2.88 -1.26 -5.11 113.62 105.92 2cre n SER 70 Ca 0.07 -0.86 0.00 0.00 -1.33 0.00 0.00 58.87 56.75 2cre n SER 70 Cb 0.55 -3.60 0.00 0.00 -0.75 0.00 0.00 64.21 60.41 2cre n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42