#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 -1.07 -0.17 1.61 1.04 -1.26 -5.15 113.70 108.70 2cre s SER 2 Ca 0.00 1.01 -0.05 0.00 0.48 0.00 0.00 55.95 57.39 2cre s SER 2 Cb 0.00 2.04 -0.03 0.00 0.10 0.00 0.00 66.02 68.13 2cre s SER 2 CO 0.00 -0.25 -0.01 -0.94 0.98 0.00 0.00 173.24 173.02 2cre s SER 3 N 2.82 4.92 0.00 7.02 1.04 -1.26 -5.03 113.70 123.21 2cre s SER 3 Ca 0.11 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.42 2cre s SER 3 Cb -0.14 -1.82 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2cre s SER 3 CO -0.19 0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2cre n GLY 4 N 3.74 -0.01 3.24 7.32 0.00 -1.26 -5.13 105.19 113.09 2cre n GLY 4 Ca -0.17 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 2cre n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cre n SER 5 N 2.86 -2.48 -4.34 1.61 3.41 -1.26 -5.01 113.62 108.40 2cre n SER 5 Ca 0.00 -0.17 -0.31 0.00 -0.26 0.00 0.00 58.87 58.13 2cre n SER 5 Cb 0.00 -0.92 -0.15 0.00 -0.26 0.00 0.00 64.21 62.88 2cre n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2cre s SER 6 N -1.86 3.20 -0.16 4.04 0.01 -1.26 -5.10 113.70 112.57 2cre s SER 6 Ca 0.54 -0.52 -0.29 0.00 1.31 0.00 0.00 55.95 56.99 2cre s SER 6 Cb -0.10 -0.35 -0.00 0.00 0.21 0.00 0.00 66.02 65.77 2cre s SER 6 CO 0.63 0.29 1.05 -0.83 0.41 0.00 0.00 173.24 174.79 2cre s GLY 7 N -0.99 1.99 0.61 3.44 0.00 -1.26 -4.82 107.32 106.28 2cre s GLY 7 Ca 0.11 0.31 0.02 0.00 0.00 0.00 0.00 44.72 45.16 2cre s GLY 7 CO 0.01 2.10 0.84 1.08 0.00 0.00 0.00 173.10 177.13 2cre s LEU 8 N 2.67 3.17 -0.07 0.66 2.01 -0.28 -4.90 118.68 121.94 2cre s LEU 8 Ca 0.47 -0.25 0.01 0.00 0.01 0.00 0.00 54.13 54.37 2cre s LEU 8 Cb -0.17 -2.41 0.02 0.00 0.01 0.00 0.00 46.19 43.64 2cre s LEU 8 CO 0.12 -1.40 -0.08 -0.76 1.01 0.00 0.00 176.35 175.24 2cre s LEU 9 N -4.86 1.42 0.20 1.79 1.43 -1.26 -0.34 118.68 117.05 2cre s LEU 9 Ca 0.61 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.52 2cre s LEU 9 Cb -0.08 -0.69 -0.05 0.00 0.03 0.00 0.00 46.19 45.41 2cre s LEU 9 CO 0.40 -0.03 -0.04 0.00 0.23 0.00 0.00 176.35 176.91 2cre s ALA 10 N 0.98 1.71 0.32 4.21 0.00 -0.24 -3.29 121.76 125.45 2cre s ALA 10 Ca -0.09 -1.68 0.08 0.00 0.00 0.00 0.00 51.96 50.27 2cre s ALA 10 Cb -0.15 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 2cre s ALA 10 CO 0.00 -0.19 0.24 0.50 0.00 0.00 0.00 175.76 176.31 2cre s ARG 11 N -3.82 2.68 -0.42 0.00 3.52 -0.58 -1.06 118.95 119.28 2cre s ARG 11 Ca 0.24 -1.30 -0.04 0.00 -0.13 0.00 0.00 55.73 54.51 2cre s ARG 11 Cb 0.04 -2.43 0.11 0.00 -1.56 0.00 0.00 34.95 31.12 2cre s ARG 11 CO 0.06 0.16 0.23 0.00 -0.81 0.00 0.00 175.30 174.94 2cre s ALA 12 N -2.30 3.20 0.01 6.12 0.00 -0.80 -1.39 121.76 126.60 2cre s ALA 12 Ca 0.39 -2.54 0.31 0.00 0.00 0.00 0.00 51.96 50.11 2cre s ALA 12 Cb -0.06 -2.48 1.14 0.00 0.00 0.00 0.00 23.12 21.72 2cre s ALA 12 CO 0.25 -1.82 1.90 -0.07 0.00 0.00 0.00 175.76 176.02 2cre h LEU 13 N 8.12 0.00 -7.76 0.00 3.38 -1.80 0.37 115.31 117.61 2cre h LEU 13 Ca -0.14 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 2cre h LEU 13 Cb 1.05 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.59 2cre h LEU 13 CO 0.73 0.03 -0.50 -0.31 0.09 0.00 0.00 178.44 178.47 2cre s TYR 14 N -3.58 0.05 0.41 1.13 1.51 -1.25 -4.83 117.35 110.79 2cre s TYR 14 Ca 0.02 -0.15 -0.23 0.00 -1.01 0.00 0.00 57.07 55.71 2cre s TYR 14 Cb 0.08 -0.05 -0.09 0.00 -0.11 0.00 0.00 41.96 41.79 2cre s TYR 14 CO 0.58 -0.28 1.01 0.16 -1.11 0.00 0.00 175.55 175.90 2cre s ASP 15 N -1.37 6.80 -0.13 2.29 1.47 -1.26 -4.39 116.67 120.07 2cre s ASP 15 Ca -0.15 1.90 0.02 0.00 1.18 0.00 0.00 52.55 55.51 2cre s ASP 15 Cb -0.08 -2.57 0.01 0.00 -0.34 0.00 0.00 42.92 39.94 2cre s ASP 15 CO 0.01 -0.46 -0.21 0.21 0.68 0.00 0.00 175.17 175.40 2cre s ASN 16 N -1.81 3.20 -0.91 2.11 2.47 0.62 -4.94 114.94 115.68 2cre s ASN 16 Ca 0.60 -0.57 -0.03 0.00 0.42 0.00 0.00 52.86 53.27 2cre s ASN 16 Cb -0.17 -1.46 0.23 0.00 -1.45 0.00 0.00 41.25 38.40 2cre s ASN 16 CO 0.22 0.10 0.82 0.00 -3.72 0.00 0.00 177.10 174.51 2cre s PRO 18 N -1.22 0.67 -0.05 0.00 0.04 -1.26 -5.01 135.00 128.17 2cre s PRO 18 Ca 0.27 0.62 0.14 0.00 0.04 0.00 0.00 61.00 62.06 2cre s PRO 18 Cb -0.09 -1.76 0.26 0.00 0.04 0.00 0.00 34.50 32.96 2cre s PRO 18 CO -0.11 -2.59 1.12 -0.40 0.04 0.00 0.00 177.00 175.06 2cre n ASP 19 N -4.09 0.99 -3.50 6.66 5.75 -1.26 -5.03 116.55 116.07 2cre n ASP 19 Ca 0.06 -2.48 -0.12 0.00 -0.01 0.00 0.00 54.79 52.24 2cre n ASP 19 Cb 0.57 -0.32 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 2cre n ASP 19 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2cre h SER 21 N 2.19 0.68 -0.54 0.00 4.64 -2.00 -3.05 113.55 115.47 2cre h SER 21 Ca -0.34 -0.24 0.07 0.00 -0.47 0.00 0.00 61.79 60.82 2cre h SER 21 Cb 1.28 -0.19 -0.06 0.00 -0.31 0.00 0.00 62.40 63.13 2cre h SER 21 CO 0.41 0.89 0.22 0.44 -0.87 0.00 0.00 176.83 177.92 2cre h ASP 22 N 0.59 0.26 -4.23 4.97 5.19 -1.95 -3.43 116.42 117.81 2cre h ASP 22 Ca 0.09 0.06 -0.49 0.00 -0.62 0.00 0.00 57.03 56.07 2cre h ASP 22 Cb 0.70 0.02 0.12 0.00 0.18 0.00 0.00 39.33 40.35 2cre h ASP 22 CO 0.05 0.17 0.31 -1.61 -3.12 0.00 0.00 179.24 175.05 2cre s GLU 23 N -6.12 1.83 -0.08 3.56 8.01 -1.15 -1.97 118.70 122.78 2cre s GLU 23 Ca -0.13 0.68 -0.00 0.00 0.01 0.00 0.00 54.97 55.53 2cre s GLU 23 Cb 0.15 -1.89 -0.03 0.00 -4.31 0.00 0.00 34.13 28.05 2cre s GLU 23 CO 0.74 -1.81 -0.05 -1.17 0.01 0.00 0.00 175.26 172.98 2cre s LEU 24 N -5.91 3.30 -0.38 1.80 0.20 -0.59 -4.48 118.68 112.62 2cre s LEU 24 Ca 0.62 0.03 -0.05 0.00 0.69 0.00 0.00 54.13 55.41 2cre s LEU 24 Cb -0.15 -1.73 0.08 0.00 -0.43 0.00 0.00 46.19 43.95 2cre s LEU 24 CO 0.55 0.36 0.17 0.00 -0.29 0.00 0.00 176.35 177.13 2cre s ALA 25 N -0.79 3.11 0.17 5.97 0.00 -1.26 -4.46 121.76 124.50 2cre s ALA 25 Ca 0.12 -2.16 0.03 0.00 0.00 0.00 0.00 51.96 49.95 2cre s ALA 25 Cb -0.11 -2.37 -0.05 0.00 0.00 0.00 0.00 23.12 20.59 2cre s ALA 25 CO 0.02 -1.59 -0.04 -0.59 0.00 0.00 0.00 175.76 173.56 2cre s PHE 26 N 1.28 1.27 0.51 0.00 -0.12 -1.22 -5.00 117.98 114.69 2cre s PHE 26 Ca 0.03 -0.91 0.06 0.00 -0.05 0.00 0.00 56.93 56.05 2cre s PHE 26 Cb -0.22 -0.70 0.02 0.00 -0.63 0.00 0.00 43.02 41.49 2cre s PHE 26 CO -0.01 -0.08 0.34 -1.12 -0.05 0.00 0.00 175.22 174.31 2cre s SER 27 N -3.19 4.61 0.27 1.98 0.01 -1.26 -0.27 113.70 115.85 2cre s SER 27 Ca 0.21 -1.21 -0.29 0.00 1.31 0.00 0.00 55.95 55.97 2cre s SER 27 Cb 0.05 0.21 -0.09 0.00 0.21 0.00 0.00 66.02 66.40 2cre s SER 27 CO 0.03 -0.97 1.19 -0.60 0.41 0.00 0.00 173.24 173.29 2cre s ARG 28 N -4.19 4.52 0.00 12.44 3.00 -1.26 -3.20 118.95 130.26 2cre s ARG 28 Ca 0.34 1.94 0.00 0.00 -1.00 0.00 0.00 55.73 57.01 2cre s ARG 28 Cb -0.01 -3.17 0.00 0.00 0.00 0.00 0.00 34.95 31.77 2cre s ARG 28 CO 0.21 0.02 0.00 0.41 0.00 0.00 0.00 175.30 175.93 2cre n GLY 29 N 1.38 0.51 3.65 8.12 0.00 0.12 -4.98 105.19 113.98 2cre n GLY 29 Ca 0.01 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.80 5.02 -0.31 1.61 1.01 -1.19 -4.91 116.67 115.08 2cre s ASP 30 Ca 0.00 0.08 -0.18 0.00 0.71 0.00 0.00 52.55 53.16 2cre s ASP 30 Cb 0.00 -1.36 -0.01 0.00 1.01 0.00 0.00 42.92 42.56 2cre s ASP 30 CO 0.00 0.37 0.52 -0.63 0.21 0.00 0.00 175.17 175.64 2cre s ILE 31 N -0.86 5.03 -0.14 0.77 -1.09 -1.26 -1.90 121.20 121.75 2cre s ILE 31 Ca 0.13 0.57 -0.04 0.00 -2.23 0.00 0.00 60.65 59.08 2cre s ILE 31 Cb -0.11 -3.91 -0.03 0.00 -1.58 0.00 0.00 42.46 36.82 2cre s ILE 31 CO 0.02 -0.10 0.02 -0.76 -1.23 0.00 0.00 174.94 172.89 2cre s LEU 32 N 2.38 3.60 -0.69 2.97 2.01 -0.23 -4.97 118.68 123.75 2cre s LEU 32 Ca 0.20 0.07 -0.21 0.00 0.01 0.00 0.00 54.13 54.20 2cre s LEU 32 Cb -0.15 -1.87 0.09 0.00 0.01 0.00 0.00 46.19 44.28 2cre s LEU 32 CO 0.12 0.26 0.91 -0.89 1.01 0.00 0.00 176.35 177.75 2cre s THR 33 N -0.16 4.58 -0.59 5.49 2.01 -1.25 -1.08 115.64 124.64 2cre s THR 33 Ca 0.05 -0.82 -0.26 0.00 0.31 0.00 0.00 61.69 60.97 2cre s THR 33 Cb -0.12 -4.64 -0.08 0.00 0.01 0.00 0.00 72.50 67.66 2cre s THR 33 CO 0.02 -1.36 2.36 -0.63 -0.69 0.00 0.00 174.62 174.32 2cre s ILE 34 N 3.31 3.04 0.11 1.82 1.01 0.53 -2.42 121.20 128.61 2cre s ILE 34 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 60.65 60.63 2cre s ILE 34 Cb -0.17 -3.11 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 2cre s ILE 34 CO 0.05 -0.10 1.70 -0.07 0.00 0.00 0.00 174.94 176.51 2cre h LEU 35 N 20.20 -0.28 -8.56 2.97 3.38 0.18 -0.73 115.31 132.47 2cre h LEU 35 Ca -0.17 0.05 -0.25 0.00 0.09 0.00 0.00 57.88 57.60 2cre h LEU 35 Cb 1.18 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.94 2cre h LEU 35 CO 1.12 -0.14 -0.41 -1.83 0.09 0.00 0.00 178.44 177.27 2cre s GLU 36 N -6.16 1.50 -0.01 1.13 -1.05 -1.20 -4.41 118.70 108.49 2cre s GLU 36 Ca -0.14 -1.65 0.00 0.00 -0.15 0.00 0.00 54.97 53.03 2cre s GLU 36 Cb 0.08 0.35 -0.01 0.00 -0.44 0.00 0.00 34.13 34.12 2cre s GLU 36 CO 0.67 -0.56 -0.01 1.04 0.95 0.00 0.00 175.26 177.35 2cre n GLN 37 N -0.41 0.02 -1.98 -4.83 6.02 -1.26 -3.62 117.38 111.32 2cre n GLN 37 Ca 0.02 0.01 -0.26 0.00 -0.01 0.00 0.00 57.00 56.76 2cre n GLN 37 Cb 0.64 -0.98 -0.05 0.00 1.02 0.00 0.00 30.24 30.86 2cre n GLN 37 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2cre s HIS 38 N -2.02 1.69 -0.38 1.08 2.46 -1.26 -4.87 115.29 112.00 2cre s HIS 38 Ca -0.01 0.84 0.01 0.00 0.47 0.00 0.00 55.06 56.37 2cre s HIS 38 Cb 0.00 -3.96 0.11 0.00 -0.13 0.00 0.00 32.58 28.61 2cre s HIS 38 CO 0.02 -1.78 0.15 0.08 -2.47 0.00 0.00 174.74 170.74 2cre s VAL 39 N 10.67 1.40 0.10 0.89 1.01 -1.26 -4.98 120.40 128.23 2cre s VAL 39 Ca 0.73 -2.10 -0.15 0.00 0.00 0.00 0.00 61.98 60.47 2cre s VAL 39 Cb -0.08 -2.02 -0.08 0.00 0.00 0.00 0.00 36.38 34.20 2cre s VAL 39 CO 0.03 -0.75 1.42 1.55 0.00 0.00 0.00 175.10 177.35 2cre h PRO 40 N 7.41 0.71 -0.90 2.72 0.13 -1.96 -3.06 132.00 137.05 2cre h PRO 40 Ca -0.07 -0.37 0.26 0.00 -0.87 0.00 0.00 66.00 64.95 2cre h PRO 40 Cb 0.98 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.08 2cre h PRO 40 CO 0.50 0.99 0.91 0.93 -0.23 0.00 0.00 178.00 181.09 2cre h GLU 41 N 0.46 0.00 -3.24 0.86 4.39 -2.01 -3.34 114.58 111.69 2cre h GLU 41 Ca 0.05 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.40 2cre h GLU 41 Cb 0.85 0.00 -0.38 0.00 -0.10 0.00 0.00 28.75 29.12 2cre h GLU 41 CO 0.07 0.00 -0.71 -1.12 -1.16 0.00 0.00 179.01 176.09 2cre s SER 42 N -4.36 1.03 -0.52 1.42 0.01 -1.16 -5.11 113.70 105.01 2cre s SER 42 Ca -0.04 0.15 -0.26 0.00 1.31 0.00 0.00 55.95 57.11 2cre s SER 42 Cb 0.17 -0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.41 2cre s SER 42 CO 0.57 -0.25 1.02 -1.83 0.41 0.00 0.00 173.24 173.16 2cre s GLU 43 N 2.21 3.49 0.00 12.44 -1.05 -1.26 -3.68 118.70 130.85 2cre s GLU 43 Ca 0.04 0.10 0.00 0.00 -0.15 0.00 0.00 54.97 54.97 2cre s GLU 43 Cb -0.12 -3.98 0.00 0.00 -0.44 0.00 0.00 34.13 29.59 2cre s GLU 43 CO -0.04 -1.43 0.00 0.41 0.95 0.00 0.00 175.26 175.15 2cre n GLY 44 N 5.01 1.15 3.20 -3.83 0.00 -1.26 -5.08 105.19 104.39 2cre n GLY 44 Ca 0.06 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.19 1.04 -0.02 1.61 0.52 -1.24 -2.81 118.94 115.85 2cre s TRP 45 Ca 0.00 -0.92 0.02 0.00 0.02 0.00 0.00 56.10 55.22 2cre s TRP 45 Cb 0.00 -0.59 0.00 0.00 -1.15 0.00 0.00 33.47 31.74 2cre s TRP 45 CO 0.00 -0.13 -0.07 -1.58 0.02 0.00 0.00 176.95 175.19 2cre s TRP 46 N -3.59 0.74 -0.64 -1.98 0.51 0.18 -4.71 118.94 109.46 2cre s TRP 46 Ca 0.16 -0.17 -0.23 0.00 -2.12 0.00 0.00 56.10 53.75 2cre s TRP 46 Cb 0.05 -0.53 0.06 0.00 -0.81 0.00 0.00 33.47 32.24 2cre s TRP 46 CO -0.01 -0.07 0.96 0.21 -0.51 0.00 0.00 176.95 177.52 2cre s LYS 47 N 0.15 3.15 0.40 4.98 2.20 -1.24 0.92 119.74 130.31 2cre s LYS 47 Ca -0.02 -0.72 0.08 0.00 -0.36 0.00 0.00 55.97 54.94 2cre s LYS 47 Cb -0.07 -4.19 -0.02 0.00 -1.51 0.00 0.00 37.83 32.04 2cre s LYS 47 CO 0.00 -1.75 0.35 0.00 -0.36 0.00 0.00 175.35 173.59 2cre s LEU 49 N -4.09 1.87 -0.16 0.00 1.98 -1.01 -2.16 118.68 115.10 2cre s LEU 49 Ca 0.47 -0.43 -0.11 0.00 -2.89 0.00 0.00 54.13 51.18 2cre s LEU 49 Cb -0.03 -1.11 0.05 0.00 0.66 0.00 0.00 46.19 45.76 2cre s LEU 49 CO 0.27 0.10 0.40 -0.22 -1.89 0.00 0.00 176.35 175.01 2cre s LEU 50 N 0.49 0.14 -0.42 -0.68 2.96 -1.26 -3.81 118.68 116.09 2cre s LEU 50 Ca -0.16 0.84 -0.05 0.00 -0.22 0.00 0.00 54.13 54.53 2cre s LEU 50 Cb -0.17 1.31 0.05 0.00 0.50 0.00 0.00 46.19 47.89 2cre s LEU 50 CO 0.06 -0.17 0.13 1.41 -1.32 0.00 0.00 176.35 176.46 2cre n HIS 51 N 3.79 -1.82 -2.53 5.38 8.25 -1.26 0.32 115.22 127.35 2cre n HIS 51 Ca -0.20 0.15 -0.07 0.00 -0.26 0.00 0.00 57.72 57.34 2cre n HIS 51 Cb 0.56 -1.22 0.04 0.00 1.12 0.00 0.00 29.99 30.48 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 -0.63 0.10 0.31 -1.41 0.00 -1.26 -5.01 105.19 97.30 2cre n GLY 52 Ca 0.02 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.29 0.42 -3.10 1.61 1.74 0.15 -5.05 116.66 110.14 2cre n ARG 53 Ca -0.10 0.17 -0.14 0.00 -0.77 0.00 0.00 57.85 57.01 2cre n ARG 53 Cb 0.57 -1.23 0.07 0.00 -1.02 0.00 0.00 32.46 30.84 2cre n ARG 53 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2cre n GLN 54 N -4.18 -3.87 -4.67 5.56 6.02 -1.23 -4.94 117.38 110.07 2cre n GLN 54 Ca -0.19 0.73 -0.30 0.00 -0.01 0.00 0.00 57.00 57.23 2cre n GLN 54 Cb 0.50 -5.27 -0.09 0.00 1.02 0.00 0.00 30.24 26.40 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 -3.77 2.73 0.73 1.08 0.00 -0.92 -4.91 107.32 102.26 2cre s GLY 55 Ca 0.18 -1.37 -0.10 0.00 0.00 0.00 0.00 44.72 43.43 2cre s GLY 55 CO 0.62 -2.12 1.09 1.08 0.00 0.00 0.00 173.10 173.77 2cre s LEU 56 N -3.77 2.78 -0.13 0.66 1.43 -0.83 -1.05 118.68 117.77 2cre s LEU 56 Ca 0.21 0.84 -0.18 0.00 -1.03 0.00 0.00 54.13 53.97 2cre s LEU 56 Cb 0.06 -3.50 0.04 0.00 0.03 0.00 0.00 46.19 42.82 2cre s LEU 56 CO 0.11 -1.56 0.47 0.00 0.23 0.00 0.00 176.35 175.60 2cre s ALA 57 N -3.38 -1.16 -0.38 4.21 0.00 0.26 -1.55 121.76 119.77 2cre s ALA 57 Ca 0.59 1.14 -0.28 0.00 0.00 0.00 0.00 51.96 53.41 2cre s ALA 57 Cb -0.11 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 2cre s ALA 57 CO 0.49 -0.25 1.71 -1.25 0.00 0.00 0.00 175.76 176.46 2cre s PRO 58 N -0.22 3.32 0.18 0.00 0.04 -1.26 0.51 135.00 137.56 2cre s PRO 58 Ca -0.04 1.22 0.11 0.00 0.04 0.00 0.00 61.00 62.33 2cre s PRO 58 Cb -0.03 -4.18 0.57 0.00 0.04 0.00 0.00 34.50 30.90 2cre s PRO 58 CO 0.02 -1.88 1.28 0.00 0.04 0.00 0.00 177.00 176.46 2cre n ALA 59 N 10.19 0.89 0.19 8.56 0.00 -1.12 -0.19 120.51 139.04 2cre n ALA 59 Ca 0.21 0.10 0.09 0.00 0.00 0.00 0.00 53.44 53.83 2cre n ALA 59 Cb 0.48 -1.03 0.16 0.00 0.00 0.00 0.00 19.45 19.05 2cre n ALA 59 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2cre h ASN 60 N 0.00 0.00 -0.25 0.00 -1.24 -1.88 -3.17 115.58 109.04 2cre h ASN 60 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2cre h ASN 60 Cb 0.16 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.21 2cre h ASN 60 CO 0.00 0.20 0.00 0.54 -1.29 0.00 0.00 177.43 176.88 2cre n ARG 61 N -3.16 1.98 -4.06 6.67 1.74 0.73 -4.99 116.66 115.57 2cre n ARG 61 Ca 0.03 -1.83 -0.22 0.00 -0.77 0.00 0.00 57.85 55.06 2cre n ARG 61 Cb 0.59 -1.33 -0.04 0.00 -1.02 0.00 0.00 32.46 30.67 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 -1.12 3.93 -0.26 0.55 2.01 -1.08 -2.34 118.68 120.36 2cre s LEU 62 Ca 0.25 -0.18 -0.00 0.00 0.01 0.00 0.00 54.13 54.20 2cre s LEU 62 Cb 0.14 -2.47 0.08 0.00 0.01 0.00 0.00 46.19 43.95 2cre s LEU 62 CO 0.20 -0.06 0.04 -1.58 1.01 0.00 0.00 176.35 175.96 2cre s GLN 63 N -3.89 1.00 -0.12 1.70 0.74 -0.49 -4.90 119.66 113.71 2cre s GLN 63 Ca 0.34 -0.96 -0.29 0.00 0.05 0.00 0.00 55.36 54.49 2cre s GLN 63 Cb -0.08 -2.28 -0.04 0.00 1.10 0.00 0.00 33.01 31.70 2cre s GLN 63 CO 0.26 -0.80 1.62 0.42 -0.55 0.00 0.00 175.29 176.24 2cre s ILE 64 N 1.56 3.67 -1.05 -2.34 -1.09 -1.26 -1.52 121.20 119.16 2cre s ILE 64 Ca 0.03 0.79 -0.14 0.00 -2.23 0.00 0.00 60.65 59.11 2cre s ILE 64 Cb -0.18 -3.57 0.20 0.00 -1.58 0.00 0.00 42.46 37.33 2cre s ILE 64 CO -0.15 -0.13 1.16 -0.76 -1.23 0.00 0.00 174.94 173.83 2cre s LEU 65 N 4.41 5.72 0.19 2.97 1.43 -1.21 -5.01 118.68 127.18 2cre s LEU 65 Ca 0.72 -2.91 -0.30 0.00 -1.03 0.00 0.00 54.13 50.61 2cre s LEU 65 Cb -0.30 -2.31 -0.17 0.00 0.03 0.00 0.00 46.19 43.44 2cre s LEU 65 CO 0.28 -0.66 0.76 -0.24 0.23 0.00 0.00 176.35 176.72 2cre n SER 66 N 4.72 -0.29 -4.51 2.29 2.88 -1.26 -4.80 113.62 112.65 2cre n SER 66 Ca 0.26 1.14 -0.41 0.00 -1.33 0.00 0.00 58.87 58.54 2cre n SER 66 Cb 0.44 -1.04 0.01 0.00 -0.75 0.00 0.00 64.21 62.87 2cre n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cre n GLY 67 N 1.79 -1.02 2.84 0.46 0.00 -1.26 -4.97 105.19 103.03 2cre n GLY 67 Ca 0.16 0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 2cre n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cre n PRO 68 N 0.27 -2.76 -3.62 1.61 -0.04 -1.26 -5.07 135.00 124.14 2cre n PRO 68 Ca 0.11 -1.42 -0.28 0.00 -0.04 0.00 0.00 63.50 61.87 2cre n PRO 68 Cb 0.41 -1.33 -0.16 0.00 -0.04 0.00 0.00 33.50 32.38 2cre n PRO 68 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cre s SER 69 N -3.89 3.04 0.31 3.54 1.04 -1.26 -5.14 113.70 111.34 2cre s SER 69 Ca 0.58 -1.00 -0.03 0.00 0.48 0.00 0.00 55.95 55.98 2cre s SER 69 Cb -0.06 -0.41 -0.05 0.00 0.10 0.00 0.00 66.02 65.61 2cre s SER 69 CO 0.44 -0.38 0.55 -0.44 0.98 0.00 0.00 173.24 174.40 2cre s SER 70 N 2.02 6.40 0.00 7.02 0.01 -1.26 -5.36 113.70 122.53 2cre s SER 70 Ca 0.05 0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.95 2cre s SER 70 Cb -0.16 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 63.95 2cre s SER 70 CO -0.20 -0.23 0.13 0.61 0.41 0.00 0.00 173.24 173.96