#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 4.33 -1.20 1.61 0.01 -1.26 -4.76 113.70 112.44 2cre s SER 2 Ca 0.00 -1.33 -0.05 0.00 1.31 0.00 0.00 55.95 55.88 2cre s SER 2 Cb 0.00 0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.29 2cre s SER 2 CO 0.00 -0.77 1.03 -1.20 0.41 0.00 0.00 173.24 172.72 2cre n SER 3 N -1.35 -4.70 0.00 2.44 7.64 -1.26 -4.87 113.62 111.52 2cre n SER 3 Ca -0.07 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.29 2cre n SER 3 Cb 0.65 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 59.17 2cre n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cre n GLY 4 N -1.63 2.51 3.64 0.23 0.00 -1.26 -5.15 105.19 103.53 2cre n GLY 4 Ca -0.08 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 2cre n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cre s SER 5 N 0.00 2.66 0.13 1.61 0.01 -1.26 -4.74 113.70 112.11 2cre s SER 5 Ca 0.00 1.70 -0.19 0.00 1.31 0.00 0.00 55.95 58.77 2cre s SER 5 Cb 0.00 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.87 2cre s SER 5 CO 0.00 -3.18 1.76 -1.28 0.41 0.00 0.00 173.24 170.95 2cre h SER 6 N -1.92 0.14 -4.60 2.44 0.87 -1.92 -3.49 113.55 105.08 2cre h SER 6 Ca -0.51 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 2cre h SER 6 Cb 1.29 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2cre h SER 6 CO 0.50 0.12 -0.83 0.61 -0.53 0.00 0.00 176.83 176.69 2cre n GLY 7 N -1.17 -4.89 3.98 5.77 0.00 -1.26 -5.01 105.19 102.61 2cre n GLY 7 Ca -0.02 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 2cre n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cre s LEU 8 N -0.50 3.11 -0.07 0.99 2.01 -0.52 -4.86 118.68 118.84 2cre s LEU 8 Ca 0.00 -0.16 0.02 0.00 0.01 0.00 0.00 54.13 54.00 2cre s LEU 8 Cb 0.00 -2.47 0.01 0.00 0.01 0.00 0.00 46.19 43.74 2cre s LEU 8 CO 0.00 -1.48 -0.13 -0.76 1.01 0.00 0.00 176.35 174.99 2cre s LEU 9 N -4.95 1.66 0.21 1.79 1.43 -1.26 -0.39 118.68 117.17 2cre s LEU 9 Ca 0.61 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.43 2cre s LEU 9 Cb -0.08 -0.84 -0.05 0.00 0.03 0.00 0.00 46.19 45.25 2cre s LEU 9 CO 0.41 0.04 0.03 0.00 0.23 0.00 0.00 176.35 177.06 2cre s ALA 10 N 0.65 1.57 0.26 4.21 0.00 -0.64 -3.63 121.76 124.18 2cre s ALA 10 Ca -0.15 -1.72 0.07 0.00 0.00 0.00 0.00 51.96 50.17 2cre s ALA 10 Cb -0.16 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 2cre s ALA 10 CO 0.04 -0.35 0.19 0.50 0.00 0.00 0.00 175.76 176.14 2cre s ARG 11 N -3.94 2.84 -0.43 0.00 3.52 -0.95 -1.67 118.95 118.32 2cre s ARG 11 Ca 0.29 -1.12 -0.05 0.00 -0.13 0.00 0.00 55.73 54.73 2cre s ARG 11 Cb 0.07 -2.51 0.11 0.00 -1.56 0.00 0.00 34.95 31.06 2cre s ARG 11 CO 0.08 0.36 0.24 0.00 -0.81 0.00 0.00 175.30 175.18 2cre s ALA 12 N -2.17 3.22 0.18 6.12 0.00 -1.05 -2.02 121.76 126.04 2cre s ALA 12 Ca 0.34 -2.54 -0.08 0.00 0.00 0.00 0.00 51.96 49.67 2cre s ALA 12 Cb -0.07 -2.53 0.07 0.00 0.00 0.00 0.00 23.12 20.58 2cre s ALA 12 CO 0.25 -1.83 1.60 -0.07 0.00 0.00 0.00 175.76 175.71 2cre h LEU 13 N 8.16 1.00 -8.28 0.00 3.38 -1.88 0.10 115.31 117.79 2cre h LEU 13 Ca -0.15 -0.34 -0.38 0.00 0.09 0.00 0.00 57.88 57.10 2cre h LEU 13 Cb 1.05 -0.27 -0.23 0.00 0.09 0.00 0.00 40.66 41.30 2cre h LEU 13 CO 0.74 1.12 -0.77 -0.31 0.09 0.00 0.00 178.44 179.31 2cre s TYR 14 N -4.81 1.02 0.45 1.13 1.51 -1.26 -4.71 117.35 110.67 2cre s TYR 14 Ca -0.11 -0.41 -0.22 0.00 -1.01 0.00 0.00 57.07 55.32 2cre s TYR 14 Cb 0.13 -0.59 -0.09 0.00 -0.11 0.00 0.00 41.96 41.30 2cre s TYR 14 CO 0.86 0.01 1.05 0.16 -1.11 0.00 0.00 175.55 176.52 2cre s ASP 15 N -1.40 6.50 -0.07 2.29 1.47 -1.26 -4.44 116.67 119.76 2cre s ASP 15 Ca -0.03 1.99 0.05 0.00 1.18 0.00 0.00 52.55 55.74 2cre s ASP 15 Cb -0.09 -2.57 -0.01 0.00 -0.34 0.00 0.00 42.92 39.91 2cre s ASP 15 CO 0.01 -0.67 -0.21 0.21 0.68 0.00 0.00 175.17 175.19 2cre s ASN 16 N -1.78 3.40 -0.83 2.11 2.47 -0.34 -4.93 114.94 115.04 2cre s ASN 16 Ca 0.63 -0.43 -0.01 0.00 0.42 0.00 0.00 52.86 53.47 2cre s ASN 16 Cb -0.19 -0.99 0.20 0.00 -1.45 0.00 0.00 41.25 38.82 2cre s ASN 16 CO 0.24 0.25 0.69 0.00 -3.72 0.00 0.00 177.10 174.55 2cre s PRO 18 N -1.15 1.13 0.00 0.00 0.04 -1.26 -5.01 135.00 128.76 2cre s PRO 18 Ca 0.25 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.07 2cre s PRO 18 Cb -0.09 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2cre s PRO 18 CO -0.11 -2.32 0.00 -0.25 0.04 0.00 0.00 177.00 174.36 2cre n ASP 19 N -3.93 3.83 -4.33 6.66 9.92 -1.26 -5.02 116.55 122.42 2cre n ASP 19 Ca 0.07 0.00 -0.32 0.00 -0.53 0.00 0.00 54.79 54.01 2cre n ASP 19 Cb 0.55 0.54 -0.15 0.00 -0.64 0.00 0.00 41.12 41.42 2cre n ASP 19 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cre n SER 21 N 2.84 0.28 -0.37 0.00 7.64 -1.26 -0.77 113.62 121.99 2cre n SER 21 Ca -0.17 1.57 -0.10 0.00 1.01 0.00 0.00 58.87 61.18 2cre n SER 21 Cb 0.52 -0.74 -0.09 0.00 -1.01 0.00 0.00 64.21 62.89 2cre n SER 21 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2cre n ASP 22 N -5.16 -0.92 -3.38 6.43 2.03 -1.26 -4.47 116.55 109.81 2cre n ASP 22 Ca 0.34 1.56 -0.27 0.00 0.52 0.00 0.00 54.79 56.95 2cre n ASP 22 Cb 1.16 -0.21 0.23 0.00 -0.72 0.00 0.00 41.12 41.59 2cre n ASP 22 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2cre n GLU 23 N -5.07 -3.30 -5.01 -0.67 1.02 0.05 0.51 120.64 108.17 2cre n GLU 23 Ca 0.02 -1.48 -0.27 0.00 -0.02 0.00 0.00 57.16 55.40 2cre n GLU 23 Cb 0.23 -1.50 -0.16 0.00 -0.02 0.00 0.00 31.44 29.99 2cre n GLU 23 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2cre s LEU 24 N 0.00 2.04 -0.46 -4.62 0.20 0.34 -3.53 118.68 112.65 2cre s LEU 24 Ca 0.62 -0.38 -0.11 0.00 0.69 0.00 0.00 54.13 54.95 2cre s LEU 24 Cb -0.07 -1.07 0.10 0.00 -0.43 0.00 0.00 46.19 44.72 2cre s LEU 24 CO 0.48 0.25 0.35 0.00 -0.29 0.00 0.00 176.35 177.15 2cre s ALA 25 N -0.49 3.43 0.15 5.97 0.00 -1.26 -4.49 121.76 125.06 2cre s ALA 25 Ca 0.08 -2.32 0.05 0.00 0.00 0.00 0.00 51.96 49.77 2cre s ALA 25 Cb -0.08 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 2cre s ALA 25 CO -0.01 -1.80 -0.11 -0.59 0.00 0.00 0.00 175.76 173.25 2cre s PHE 26 N 1.47 1.34 0.26 0.00 -0.12 -1.25 -5.01 117.98 114.67 2cre s PHE 26 Ca 0.04 -0.70 0.09 0.00 -0.05 0.00 0.00 56.93 56.31 2cre s PHE 26 Cb -0.25 -0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 41.42 2cre s PHE 26 CO 0.02 0.13 0.03 0.45 -0.05 0.00 0.00 175.22 175.80 2cre s SER 27 N -3.05 4.71 0.46 1.98 0.15 -1.26 -1.19 113.70 115.50 2cre s SER 27 Ca 0.16 -0.57 -0.24 0.00 0.70 0.00 0.00 55.95 56.00 2cre s SER 27 Cb 0.01 -0.94 -0.09 0.00 -1.71 0.00 0.00 66.02 63.29 2cre s SER 27 CO 0.02 0.00 1.22 -1.14 1.20 0.00 0.00 173.24 174.54 2cre n ARG 28 N -0.88 1.70 -2.22 5.44 0.00 -1.26 -2.83 116.66 116.62 2cre n ARG 28 Ca -0.07 0.61 -0.05 0.00 -0.00 0.00 0.00 57.85 58.34 2cre n ARG 28 Cb 0.58 -2.35 0.00 0.00 0.00 0.00 0.00 32.46 30.70 2cre n ARG 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2cre n GLY 29 N 0.90 0.25 3.24 5.14 0.00 0.35 -4.97 105.19 110.10 2cre n GLY 29 Ca 0.08 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.84 2.74 -0.28 1.61 1.01 -1.13 -4.94 116.67 112.85 2cre s ASP 30 Ca 0.03 -0.44 -0.23 0.00 0.71 0.00 0.00 52.55 52.61 2cre s ASP 30 Cb -0.01 -0.55 -0.00 0.00 1.01 0.00 0.00 42.92 43.36 2cre s ASP 30 CO 0.03 0.25 0.78 -0.63 0.21 0.00 0.00 175.17 175.81 2cre s ILE 31 N -0.30 4.83 -0.14 0.77 -1.09 -1.26 -2.51 121.20 121.50 2cre s ILE 31 Ca 0.02 1.32 -0.04 0.00 -2.23 0.00 0.00 60.65 59.73 2cre s ILE 31 Cb -0.11 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.63 2cre s ILE 31 CO 0.01 -0.15 -0.01 -0.76 -1.23 0.00 0.00 174.94 172.81 2cre s LEU 32 N 2.86 3.46 -0.65 2.97 2.01 -0.67 -4.97 118.68 123.68 2cre s LEU 32 Ca 0.32 -0.00 -0.20 0.00 0.01 0.00 0.00 54.13 54.26 2cre s LEU 32 Cb -0.15 -1.83 0.10 0.00 0.01 0.00 0.00 46.19 44.32 2cre s LEU 32 CO 0.10 0.24 0.83 -0.89 1.01 0.00 0.00 176.35 177.64 2cre s THR 33 N -0.03 4.65 -0.63 5.49 2.01 -1.25 -1.62 115.64 124.25 2cre s THR 33 Ca 0.03 -0.84 -0.26 0.00 0.31 0.00 0.00 61.69 60.93 2cre s THR 33 Cb -0.13 -4.58 -0.07 0.00 0.01 0.00 0.00 72.50 67.73 2cre s THR 33 CO 0.02 -1.28 2.24 -0.63 -0.69 0.00 0.00 174.62 174.28 2cre s ILE 34 N 3.14 3.13 0.08 1.82 1.01 0.48 -2.62 121.20 128.24 2cre s ILE 34 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 60.65 60.54 2cre s ILE 34 Cb -0.20 -3.33 -0.16 0.00 0.01 0.00 0.00 42.46 38.78 2cre s ILE 34 CO 0.06 -0.32 1.67 -0.07 0.00 0.00 0.00 174.94 176.28 2cre h LEU 35 N 19.39 -0.49 -7.65 2.97 3.38 -0.60 -1.39 115.31 130.93 2cre h LEU 35 Ca -0.15 0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.57 2cre h LEU 35 Cb 1.16 0.14 -0.31 0.00 0.09 0.00 0.00 40.66 41.73 2cre h LEU 35 CO 1.14 -0.33 -0.73 -1.83 0.09 0.00 0.00 178.44 176.78 2cre s GLU 36 N -6.11 0.03 -0.06 1.13 -1.05 -1.21 -4.31 118.70 107.12 2cre s GLU 36 Ca -0.16 0.07 -0.10 0.00 -0.15 0.00 0.00 54.97 54.64 2cre s GLU 36 Cb 0.05 -0.16 -0.30 0.00 -0.44 0.00 0.00 34.13 33.28 2cre s GLU 36 CO 0.64 -0.07 0.63 1.96 0.95 0.00 0.00 175.26 179.36 2cre h GLN 37 N 6.68 0.37 -6.05 -4.83 4.20 -1.92 -3.13 115.11 110.44 2cre h GLN 37 Ca -0.34 -0.63 -0.51 0.00 0.06 0.00 0.00 58.65 57.23 2cre h GLN 37 Cb 1.17 0.23 -0.04 0.00 0.30 0.00 0.00 27.48 29.14 2cre h GLN 37 CO 0.50 1.29 1.31 -1.58 -0.67 0.00 0.00 178.83 179.68 2cre s HIS 38 N -2.58 1.76 -0.42 2.96 2.46 -1.26 -4.82 115.29 113.39 2cre s HIS 38 Ca -0.17 0.67 0.02 0.00 0.47 0.00 0.00 55.06 56.06 2cre s HIS 38 Cb 0.06 -4.16 0.12 0.00 -0.13 0.00 0.00 32.58 28.46 2cre s HIS 38 CO 0.84 -2.29 0.19 0.08 -2.47 0.00 0.00 174.74 171.09 2cre s VAL 39 N 8.53 1.64 0.15 0.89 1.01 -1.26 -4.97 120.40 126.38 2cre s VAL 39 Ca 0.63 -2.45 -0.10 0.00 0.00 0.00 0.00 61.98 60.06 2cre s VAL 39 Cb -0.12 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 2cre s VAL 39 CO 0.20 -0.79 1.48 1.55 0.00 0.00 0.00 175.10 177.54 2cre h PRO 40 N 7.07 0.93 0.00 2.72 0.13 -1.94 -2.92 132.00 137.99 2cre h PRO 40 Ca -0.05 -0.49 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2cre h PRO 40 Cb 0.95 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.10 2cre h PRO 40 CO 0.52 1.15 0.24 1.05 -0.23 0.00 0.00 178.00 180.73 2cre h GLU 41 N 0.76 0.00 -2.47 0.86 4.11 -2.00 -3.36 114.58 112.48 2cre h GLU 41 Ca 0.06 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.24 2cre h GLU 41 Cb 0.98 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.90 2cre h GLU 41 CO 0.10 0.00 -0.56 -1.12 0.07 0.00 0.00 179.01 177.49 2cre s SER 42 N -4.59 0.81 -0.77 3.06 0.01 -1.10 -5.10 113.70 106.01 2cre s SER 42 Ca -0.04 0.12 -0.26 0.00 1.31 0.00 0.00 55.95 57.09 2cre s SER 42 Cb 0.10 0.66 0.02 0.00 0.21 0.00 0.00 66.02 67.00 2cre s SER 42 CO 0.31 -0.30 1.48 -1.61 0.41 0.00 0.00 173.24 173.53 2cre s GLU 43 N 2.41 3.09 0.00 12.44 2.02 -1.26 -3.31 118.70 134.09 2cre s GLU 43 Ca 0.07 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 54.85 2cre s GLU 43 Cb -0.15 -4.48 0.00 0.00 0.10 0.00 0.00 34.13 29.60 2cre s GLU 43 CO -0.12 -2.37 0.00 0.41 0.02 0.00 0.00 175.26 173.20 2cre n GLY 44 N 5.80 1.02 3.01 -1.39 0.00 -1.26 -5.11 105.19 107.27 2cre n GLY 44 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.00 0.17 -0.04 1.61 0.52 -1.21 -3.37 118.94 114.62 2cre s TRP 45 Ca 0.00 -0.37 0.05 0.00 0.02 0.00 0.00 56.10 55.80 2cre s TRP 45 Cb 0.00 -0.13 -0.01 0.00 -1.15 0.00 0.00 33.47 32.18 2cre s TRP 45 CO 0.00 -0.20 -0.19 -1.58 0.02 0.00 0.00 176.95 174.99 2cre s TRP 46 N -1.32 1.89 -0.77 -1.98 0.51 0.12 -4.51 118.94 112.88 2cre s TRP 46 Ca -0.14 -0.53 -0.22 0.00 -2.12 0.00 0.00 56.10 53.09 2cre s TRP 46 Cb -0.09 -1.26 0.08 0.00 -0.81 0.00 0.00 33.47 31.40 2cre s TRP 46 CO -0.00 -0.16 1.07 0.21 -0.51 0.00 0.00 176.95 177.56 2cre s LYS 47 N -0.06 3.29 0.39 4.98 2.47 -1.18 0.61 119.74 130.24 2cre s LYS 47 Ca -0.03 -1.08 0.08 0.00 -1.56 0.00 0.00 55.97 53.38 2cre s LYS 47 Cb -0.12 -4.52 -0.01 0.00 -1.46 0.00 0.00 37.83 31.72 2cre s LYS 47 CO 0.02 -1.86 0.42 0.00 0.16 0.00 0.00 175.35 174.09 2cre s LEU 49 N -4.16 1.95 -0.13 0.00 1.98 -1.08 -2.63 118.68 114.62 2cre s LEU 49 Ca 0.48 -0.51 -0.07 0.00 -2.89 0.00 0.00 54.13 51.14 2cre s LEU 49 Cb -0.06 -1.27 0.05 0.00 0.66 0.00 0.00 46.19 45.57 2cre s LEU 49 CO 0.29 0.08 0.30 -0.22 -1.89 0.00 0.00 176.35 174.92 2cre s LEU 50 N 0.69 0.25 -1.73 -0.68 2.96 -1.26 -3.96 118.68 114.95 2cre s LEU 50 Ca -0.12 0.64 -0.19 0.00 -0.22 0.00 0.00 54.13 54.25 2cre s LEU 50 Cb -0.16 0.94 0.19 0.00 0.50 0.00 0.00 46.19 47.65 2cre s LEU 50 CO 0.02 -0.17 0.48 1.41 -1.32 0.00 0.00 176.35 176.77 2cre n HIS 51 N 4.24 -1.11 -3.00 5.38 8.25 -1.26 0.77 115.22 128.49 2cre n HIS 51 Ca -0.25 0.64 -0.12 0.00 -0.26 0.00 0.00 57.72 57.73 2cre n HIS 51 Cb 0.54 -1.89 0.06 0.00 1.12 0.00 0.00 29.99 29.81 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 -1.26 -0.05 0.06 -1.41 0.00 -1.26 -4.99 105.19 96.28 2cre n GLY 52 Ca 0.05 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.11 0.34 -3.14 1.61 5.12 0.23 -5.03 116.66 112.69 2cre n ARG 53 Ca -0.13 0.32 -0.14 0.00 -1.93 0.00 0.00 57.85 55.97 2cre n ARG 53 Cb 0.59 -1.30 0.07 0.00 -1.16 0.00 0.00 32.46 30.65 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 -3.91 -4.26 -2.89 5.56 6.02 -1.23 -4.94 117.38 111.74 2cre n GLN 54 Ca -0.07 0.73 -0.10 0.00 -0.01 0.00 0.00 57.00 57.55 2cre n GLN 54 Cb 0.26 -5.31 -0.02 0.00 1.02 0.00 0.00 30.24 26.19 2cre n GLN 54 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cre n GLY 55 N -1.17 3.87 3.94 1.08 0.00 -1.08 -4.91 105.19 106.91 2cre n GLY 55 Ca -0.18 -2.09 -0.24 0.00 0.00 0.00 0.00 46.02 43.51 2cre n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cre s LEU 56 N 0.00 3.56 -0.09 0.99 1.43 0.18 -1.58 118.68 123.17 2cre s LEU 56 Ca 0.05 0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 2cre s LEU 56 Cb 0.00 -3.35 0.03 0.00 0.03 0.00 0.00 46.19 42.90 2cre s LEU 56 CO 0.03 -0.75 0.31 0.00 0.23 0.00 0.00 176.35 176.17 2cre s ALA 57 N -2.67 -0.78 -0.51 4.21 0.00 0.20 0.13 121.76 122.34 2cre s ALA 57 Ca 0.49 0.75 -0.27 0.00 0.00 0.00 0.00 51.96 52.93 2cre s ALA 57 Cb -0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 2cre s ALA 57 CO 0.40 -0.18 1.80 -1.25 0.00 0.00 0.00 175.76 176.54 2cre s PRO 58 N -0.19 2.91 0.40 0.00 0.04 -1.26 0.16 135.00 137.05 2cre s PRO 58 Ca -0.03 0.87 0.20 0.00 0.04 0.00 0.00 61.00 62.08 2cre s PRO 58 Cb -0.03 -4.30 1.10 0.00 0.04 0.00 0.00 34.50 31.31 2cre s PRO 58 CO 0.01 -2.38 1.57 0.00 0.04 0.00 0.00 177.00 176.25 2cre h ALA 59 N 13.99 1.15 0.00 8.56 0.00 -1.90 0.31 119.26 141.37 2cre h ALA 59 Ca -0.28 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 2cre h ALA 59 Cb 1.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2cre h ALA 59 CO 1.15 -0.15 -0.35 -0.91 0.00 0.00 0.00 179.25 179.00 2cre h ASN 60 N 0.00 0.00 -0.50 0.00 4.21 -1.88 -2.97 115.58 114.44 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 0.39 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.59 2cre h ASN 60 CO 0.00 0.35 0.00 0.54 -1.29 0.00 0.00 177.43 177.03 2cre n ARG 61 N -3.37 2.59 -4.04 0.81 1.74 0.11 -4.96 116.66 109.53 2cre n ARG 61 Ca 0.01 -2.31 -0.29 0.00 -0.77 0.00 0.00 57.85 54.48 2cre n ARG 61 Cb 0.55 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 30.48 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 -1.11 3.88 -0.34 0.55 2.01 -1.12 -2.80 118.68 119.75 2cre s LEU 62 Ca 0.37 -0.01 0.03 0.00 0.01 0.00 0.00 54.13 54.53 2cre s LEU 62 Cb 0.20 -2.53 0.10 0.00 0.01 0.00 0.00 46.19 43.97 2cre s LEU 62 CO 0.27 0.14 0.07 -1.58 1.01 0.00 0.00 176.35 176.26 2cre s GLN 63 N -2.63 1.34 -0.03 1.70 0.74 -0.86 -4.92 119.66 114.99 2cre s GLN 63 Ca 0.30 -1.75 -0.30 0.00 0.05 0.00 0.00 55.36 53.67 2cre s GLN 63 Cb -0.12 -2.94 -0.07 0.00 1.10 0.00 0.00 33.01 30.98 2cre s GLN 63 CO 0.23 -0.96 1.80 0.42 -0.55 0.00 0.00 175.29 176.23 2cre s ILE 64 N 0.99 3.35 0.57 -2.34 -1.09 -1.26 -2.24 121.20 119.17 2cre s ILE 64 Ca 0.11 0.42 0.07 0.00 -2.23 0.00 0.00 60.65 59.02 2cre s ILE 64 Cb -0.19 -3.28 0.10 0.00 -1.58 0.00 0.00 42.46 37.51 2cre s ILE 64 CO -0.11 -0.05 0.78 0.18 -1.23 0.00 0.00 174.94 174.51 2cre n LEU 65 N 7.52 0.00 0.00 2.97 4.77 -1.24 -5.02 117.00 126.00 2cre n LEU 65 Ca 0.19 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.91 2cre n LEU 65 Cb 0.42 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2cre n LEU 65 CO 0.65 -0.75 -0.21 -0.24 -1.33 0.00 0.00 177.39 175.51 2cre n SER 66 N -2.48 1.72 -3.53 -1.43 2.88 -1.26 -4.95 113.62 104.56 2cre n SER 66 Ca 0.15 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.66 2cre n SER 66 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2cre n SER 66 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cre s GLY 67 N -3.40 -0.05 0.15 0.46 0.00 -1.26 -5.05 107.32 98.17 2cre s GLY 67 Ca 0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 44.72 44.49 2cre s GLY 67 CO 0.00 0.91 1.49 -0.56 0.00 0.00 0.00 173.10 174.94 2cre h PRO 68 N 2.00 0.91 -5.08 2.90 0.13 -2.06 -3.42 132.00 127.38 2cre h PRO 68 Ca -0.26 -0.48 -0.66 0.00 -0.87 0.00 0.00 66.00 63.73 2cre h PRO 68 Cb 1.23 0.02 -0.27 0.00 0.13 0.00 0.00 31.00 32.10 2cre h PRO 68 CO 0.31 1.13 -0.73 0.45 -0.23 0.00 0.00 178.00 178.93 2cre s SER 69 N -6.84 4.27 0.07 1.44 0.15 -1.26 -5.10 113.70 106.42 2cre s SER 69 Ca -0.11 -0.36 0.01 0.00 0.70 0.00 0.00 55.95 56.19 2cre s SER 69 Cb 0.11 -1.72 -0.04 0.00 -1.71 0.00 0.00 66.02 62.67 2cre s SER 69 CO 0.88 0.03 -0.05 -0.94 1.20 0.00 0.00 173.24 174.36 2cre s SER 70 N 1.18 0.80 0.00 5.45 1.04 -1.26 -5.11 113.70 115.80 2cre s SER 70 Ca 0.02 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.54 2cre s SER 70 Cb -0.14 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.10 2cre s SER 70 CO -0.01 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.34