#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 4.10 1.18 1.61 1.04 -1.26 -5.12 113.70 115.25 2cre s SER 2 Ca 0.00 -1.29 -0.18 0.00 0.48 0.00 0.00 55.95 54.97 2cre s SER 2 Cb 0.00 -1.33 0.21 0.00 0.10 0.00 0.00 66.02 65.01 2cre s SER 2 CO 0.00 -0.22 0.42 -1.20 0.98 0.00 0.00 173.24 173.22 2cre n SER 3 N 4.57 -2.88 -0.06 7.02 7.64 -1.26 -4.98 113.62 123.67 2cre n SER 3 Ca -0.12 -0.38 -0.20 0.00 1.01 0.00 0.00 58.87 59.17 2cre n SER 3 Cb 0.43 -0.95 -0.13 0.00 -1.01 0.00 0.00 64.21 62.56 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 1.99 -0.48 2.78 0.23 0.00 -1.26 -4.91 105.19 103.54 2cre n GLY 4 Ca 0.05 -0.21 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 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 -6.84 1.22 0.09 1.61 0.01 -1.26 -5.03 113.70 103.50 2cre s SER 5 Ca -0.29 -0.07 -0.20 0.00 1.31 0.00 0.00 55.95 56.71 2cre s SER 5 Cb 0.08 0.36 -0.08 0.00 0.21 0.00 0.00 66.02 66.58 2cre s SER 5 CO 0.68 -0.31 1.60 0.77 0.41 0.00 0.00 173.24 176.40 2cre h SER 6 N 8.33 0.32 -5.70 2.44 4.64 -1.91 -3.48 113.55 118.18 2cre h SER 6 Ca -0.16 -0.20 -0.13 0.00 -0.47 0.00 0.00 61.79 60.83 2cre h SER 6 Cb 1.14 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2cre h SER 6 CO 0.24 0.44 -0.71 0.61 -0.87 0.00 0.00 176.83 176.54 2cre n GLY 7 N -0.61 -0.86 4.01 -0.77 0.00 -1.23 -5.02 105.19 100.72 2cre n GLY 7 Ca -0.04 1.20 -0.20 0.00 0.00 0.00 0.00 46.02 46.99 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 -2.65 3.28 -0.07 0.99 2.01 0.17 -4.90 118.68 117.51 2cre s LEU 8 Ca 0.28 -0.53 0.02 0.00 0.01 0.00 0.00 54.13 53.91 2cre s LEU 8 Cb -0.06 -2.17 0.02 0.00 0.01 0.00 0.00 46.19 43.99 2cre s LEU 8 CO 0.80 -1.22 -0.11 -0.76 1.01 0.00 0.00 176.35 176.08 2cre s LEU 9 N -4.66 1.55 0.06 1.79 1.43 -1.26 -0.12 118.68 117.48 2cre s LEU 9 Ca 0.60 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.46 2cre s LEU 9 Cb -0.08 -0.77 -0.03 0.00 0.03 0.00 0.00 46.19 45.34 2cre s LEU 9 CO 0.38 0.00 -0.10 0.00 0.23 0.00 0.00 176.35 176.87 2cre s ALA 10 N 0.81 0.85 0.35 4.21 0.00 0.02 -3.26 121.76 124.74 2cre s ALA 10 Ca -0.12 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 50.94 2cre s ALA 10 Cb -0.15 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 2cre s ALA 10 CO 0.02 0.01 0.51 0.50 0.00 0.00 0.00 175.76 176.79 2cre s ARG 11 N -2.01 3.17 -0.43 0.00 3.52 -0.56 0.15 118.95 122.78 2cre s ARG 11 Ca -0.04 -0.81 -0.05 0.00 -0.13 0.00 0.00 55.73 54.70 2cre s ARG 11 Cb -0.08 -2.76 0.11 0.00 -1.56 0.00 0.00 34.95 30.67 2cre s ARG 11 CO 0.00 0.04 0.26 0.00 -0.81 0.00 0.00 175.30 174.79 2cre s ALA 12 N -2.25 3.24 -0.77 6.12 0.00 -0.92 -1.23 121.76 125.96 2cre s ALA 12 Ca 0.44 -2.54 0.22 0.00 0.00 0.00 0.00 51.96 50.08 2cre s ALA 12 Cb -0.10 -2.56 0.89 0.00 0.00 0.00 0.00 23.12 21.35 2cre s ALA 12 CO 0.33 -1.84 1.69 1.28 0.00 0.00 0.00 175.76 177.22 2cre n LEU 13 N 4.70 0.39 -3.66 0.00 4.77 -1.03 -2.39 117.00 119.79 2cre n LEU 13 Ca -0.04 0.57 -0.08 0.00 -0.03 0.00 0.00 56.01 56.43 2cre n LEU 13 Cb 0.41 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.93 2cre n LEU 13 CO 0.37 -0.30 0.26 -0.31 -1.33 0.00 0.00 177.39 176.08 2cre s TYR 14 N -3.13 -0.92 1.07 -1.77 2.02 -1.26 -4.93 117.35 108.44 2cre s TYR 14 Ca 0.08 1.87 -0.13 0.00 -0.37 0.00 0.00 57.07 58.51 2cre s TYR 14 Cb 0.12 0.52 0.18 0.00 -0.40 0.00 0.00 41.96 42.37 2cre s TYR 14 CO 0.42 -0.47 0.74 -0.40 -1.57 0.00 0.00 175.55 174.28 2cre n ASP 15 N 4.27 -1.44 -3.94 2.29 5.68 -1.26 -4.66 116.55 117.49 2cre n ASP 15 Ca -0.21 0.06 -0.16 0.00 -0.50 0.00 0.00 54.79 53.97 2cre n ASP 15 Cb 0.58 -1.24 -0.15 0.00 -1.14 0.00 0.00 41.12 39.17 2cre n ASP 15 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2cre s ASN 16 N -2.28 0.62 -0.71 -1.12 2.47 0.32 -4.92 114.94 109.32 2cre s ASN 16 Ca 0.64 -0.09 0.03 0.00 0.42 0.00 0.00 52.86 53.86 2cre s ASN 16 Cb -0.21 -0.11 0.17 0.00 -1.45 0.00 0.00 41.25 39.64 2cre s ASN 16 CO 0.64 0.04 0.51 0.00 -3.72 0.00 0.00 177.10 174.57 2cre s PRO 18 N -1.23 4.16 0.00 0.00 0.04 -1.26 -4.95 135.00 131.76 2cre s PRO 18 Ca 0.24 1.93 0.23 0.00 0.04 0.00 0.00 61.00 63.44 2cre s PRO 18 Cb -0.08 -2.81 0.12 0.00 0.04 0.00 0.00 34.50 31.76 2cre s PRO 18 CO -0.13 -0.25 1.14 -3.47 0.04 0.00 0.00 177.00 174.32 2cre n ASP 19 N 0.33 0.74 -4.01 6.66 2.03 -1.26 -4.96 116.55 116.08 2cre n ASP 19 Ca 0.03 -0.61 -0.16 0.00 0.52 0.00 0.00 54.79 54.57 2cre n ASP 19 Cb 0.45 0.66 -0.09 0.00 -0.72 0.00 0.00 41.12 41.41 2cre n ASP 19 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cre h SER 21 N 2.37 0.83 -0.95 0.00 0.87 -2.01 -3.24 113.55 111.42 2cre h SER 21 Ca -0.34 -0.38 0.15 0.00 -1.23 0.00 0.00 61.79 59.99 2cre h SER 21 Cb 1.25 -0.23 -0.15 0.00 -0.44 0.00 0.00 62.40 62.82 2cre h SER 21 CO 0.51 1.13 -0.37 -0.90 -0.53 0.00 0.00 176.83 176.67 2cre n ASP 22 N -4.04 -0.61 -4.58 6.23 5.75 -1.26 -4.46 116.55 113.58 2cre n ASP 22 Ca -0.02 1.66 -0.29 0.00 -0.01 0.00 0.00 54.79 56.13 2cre n ASP 22 Cb 0.54 -0.38 0.15 0.00 -1.03 0.00 0.00 41.12 40.40 2cre n ASP 22 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2cre s GLU 23 N -5.90 0.84 -0.01 0.11 2.02 -1.22 -0.03 118.70 114.51 2cre s GLU 23 Ca -0.13 0.14 0.03 0.00 0.02 0.00 0.00 54.97 55.02 2cre s GLU 23 Cb 0.19 -1.82 -0.03 0.00 0.10 0.00 0.00 34.13 32.57 2cre s GLU 23 CO 0.68 -2.37 -0.08 -1.17 0.02 0.00 0.00 175.26 172.35 2cre s LEU 24 N -6.09 3.13 -0.45 1.80 0.20 0.25 -4.10 118.68 113.42 2cre s LEU 24 Ca 0.66 -0.14 -0.10 0.00 0.69 0.00 0.00 54.13 55.24 2cre s LEU 24 Cb -0.12 -1.77 0.09 0.00 -0.43 0.00 0.00 46.19 43.96 2cre s LEU 24 CO 0.53 0.30 0.32 0.00 -0.29 0.00 0.00 176.35 177.21 2cre s ALA 25 N -0.95 3.38 0.19 5.97 0.00 -1.26 -4.46 121.76 124.63 2cre s ALA 25 Ca 0.16 -2.28 0.02 0.00 0.00 0.00 0.00 51.96 49.87 2cre s ALA 25 Cb -0.11 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 2cre s ALA 25 CO 0.06 -1.75 0.00 -0.59 0.00 0.00 0.00 175.76 173.48 2cre s PHE 26 N 1.45 1.33 0.27 0.00 -0.12 -1.25 -5.00 117.98 114.66 2cre s PHE 26 Ca 0.04 -0.99 0.09 0.00 -0.05 0.00 0.00 56.93 56.02 2cre s PHE 26 Cb -0.25 -0.76 -0.05 0.00 -0.63 0.00 0.00 43.02 41.33 2cre s PHE 26 CO 0.02 -0.15 -0.13 0.45 -0.05 0.00 0.00 175.22 175.36 2cre s SER 27 N -3.22 3.15 0.25 1.98 0.15 -1.26 -0.52 113.70 114.23 2cre s SER 27 Ca 0.26 -1.10 -0.31 0.00 0.70 0.00 0.00 55.95 55.50 2cre s SER 27 Cb 0.06 -0.23 -0.13 0.00 -1.71 0.00 0.00 66.02 64.00 2cre s SER 27 CO 0.06 -0.16 1.39 -1.14 1.20 0.00 0.00 173.24 174.59 2cre n ARG 28 N -0.58 2.04 -1.58 5.44 3.00 -1.26 -3.14 116.66 120.58 2cre n ARG 28 Ca -0.06 0.73 0.00 0.00 -0.00 0.00 0.00 57.85 58.52 2cre n ARG 28 Cb 0.62 -2.37 0.00 0.00 0.00 0.00 0.00 32.46 30.71 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 1.97 0.97 2.69 5.14 0.00 -1.01 -4.97 105.19 109.98 2cre n GLY 29 Ca 0.11 -0.46 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.65 1.08 -0.46 1.61 1.01 -1.19 -4.98 116.67 111.10 2cre s ASP 30 Ca 0.00 0.07 -0.26 0.00 0.71 0.00 0.00 52.55 53.06 2cre s ASP 30 Cb 0.00 -0.15 0.03 0.00 1.01 0.00 0.00 42.92 43.80 2cre s ASP 30 CO 0.00 -0.24 0.98 -0.63 0.21 0.00 0.00 175.17 175.49 2cre s ILE 31 N 2.06 4.41 0.14 0.77 1.09 -1.26 -2.17 121.20 126.26 2cre s ILE 31 Ca 0.04 0.90 -0.24 0.00 -1.10 0.00 0.00 60.65 60.24 2cre s ILE 31 Cb -0.12 -4.47 -0.08 0.00 -1.06 0.00 0.00 42.46 36.73 2cre s ILE 31 CO -0.03 -0.86 0.74 -0.76 -0.10 0.00 0.00 174.94 173.94 2cre s LEU 32 N 3.91 4.58 -0.69 2.97 2.01 0.39 -4.83 118.68 127.01 2cre s LEU 32 Ca 0.40 1.58 -0.21 0.00 0.01 0.00 0.00 54.13 55.91 2cre s LEU 32 Cb -0.09 -3.23 0.09 0.00 0.01 0.00 0.00 46.19 42.97 2cre s LEU 32 CO 0.27 0.21 0.92 -0.89 1.01 0.00 0.00 176.35 177.87 2cre s THR 33 N -1.06 4.56 -0.09 5.49 2.01 -1.24 -0.80 115.64 124.50 2cre s THR 33 Ca 0.35 -0.80 -0.29 0.00 0.31 0.00 0.00 61.69 61.26 2cre s THR 33 Cb -0.22 -4.65 -0.05 0.00 0.01 0.00 0.00 72.50 67.59 2cre s THR 33 CO 0.25 -1.37 1.76 -0.63 -0.69 0.00 0.00 174.62 173.94 2cre s ILE 34 N 3.37 3.44 -0.05 1.82 1.01 0.83 -1.43 121.20 130.19 2cre s ILE 34 Ca 0.21 0.52 -0.15 0.00 0.00 0.00 0.00 60.65 61.22 2cre s ILE 34 Cb -0.17 -3.39 -0.31 0.00 0.01 0.00 0.00 42.46 38.61 2cre s ILE 34 CO 0.05 -0.10 0.75 -0.07 0.00 0.00 0.00 174.94 175.57 2cre h LEU 35 N 11.17 0.58 -6.71 2.97 3.38 -0.73 0.48 115.31 126.44 2cre h LEU 35 Ca -0.40 -0.91 -0.22 0.00 0.09 0.00 0.00 57.88 56.43 2cre h LEU 35 Cb 1.19 -0.19 -0.32 0.00 0.09 0.00 0.00 40.66 41.43 2cre h LEU 35 CO 0.96 1.66 -0.54 -1.83 0.09 0.00 0.00 178.44 178.79 2cre s GLU 36 N -2.53 0.26 0.18 1.13 -1.05 -1.22 -3.80 118.70 111.68 2cre s GLU 36 Ca -0.15 0.46 -0.08 0.00 -0.15 0.00 0.00 54.97 55.05 2cre s GLU 36 Cb 0.04 -0.67 0.08 0.00 -0.44 0.00 0.00 34.13 33.15 2cre s GLU 36 CO 0.85 -0.58 1.62 1.96 0.95 0.00 0.00 175.26 180.05 2cre h GLN 37 N 8.25 1.00 -6.49 -4.83 4.20 -1.90 -3.31 115.11 112.02 2cre h GLN 37 Ca -0.18 -0.36 -0.57 0.00 0.06 0.00 0.00 58.65 57.61 2cre h GLN 37 Cb 1.15 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.80 2cre h GLN 37 CO 0.25 1.04 0.97 -1.01 -0.67 0.00 0.00 178.83 179.41 2cre s HIS 38 N -4.85 2.69 -0.35 2.96 3.76 -1.26 -4.84 115.29 113.39 2cre s HIS 38 Ca -0.11 0.81 0.00 0.00 -0.15 0.00 0.00 55.06 55.61 2cre s HIS 38 Cb 0.13 -4.14 0.12 0.00 1.11 0.00 0.00 32.58 29.80 2cre s HIS 38 CO 0.86 -1.57 0.16 0.08 -0.85 0.00 0.00 174.74 173.42 2cre s VAL 39 N 4.62 0.88 0.26 -0.90 1.01 -1.26 -4.98 120.40 120.03 2cre s VAL 39 Ca 0.54 -1.75 0.04 0.00 0.00 0.00 0.00 61.98 60.81 2cre s VAL 39 Cb -0.13 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.61 2cre s VAL 39 CO 0.27 -0.79 1.64 1.55 0.00 0.00 0.00 175.10 177.77 2cre h PRO 40 N 7.55 0.33 -0.38 2.72 0.13 -1.96 -3.03 132.00 137.37 2cre h PRO 40 Ca -0.08 -0.17 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 2cre h PRO 40 Cb 0.98 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 2cre h PRO 40 CO 0.44 0.72 0.19 0.93 -0.23 0.00 0.00 178.00 180.06 2cre h GLU 41 N 0.27 0.52 -3.79 0.86 5.08 -2.00 -3.41 114.58 112.10 2cre h GLU 41 Ca 0.02 -0.05 -0.37 0.00 -1.00 0.00 0.00 59.36 57.96 2cre h GLU 41 Cb 0.91 -0.11 -0.34 0.00 0.50 0.00 0.00 28.75 29.71 2cre h GLU 41 CO 0.07 0.39 -0.75 0.45 -1.00 0.00 0.00 179.01 178.18 2cre s SER 42 N -6.71 0.63 -0.18 1.42 0.15 -1.14 -5.13 113.70 102.74 2cre s SER 42 Ca -0.08 -0.05 -0.18 0.00 0.70 0.00 0.00 55.95 56.34 2cre s SER 42 Cb 0.17 -0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 64.15 2cre s SER 42 CO 0.74 -0.09 0.49 -1.61 1.20 0.00 0.00 173.24 173.96 2cre s GLU 43 N 1.05 4.23 0.00 5.44 0.41 -1.26 -3.99 118.70 124.58 2cre s GLU 43 Ca -0.09 0.39 0.00 0.00 -0.41 0.00 0.00 54.97 54.85 2cre s GLU 43 Cb -0.14 -3.52 0.00 0.00 -1.78 0.00 0.00 34.13 28.69 2cre s GLU 43 CO -0.01 -0.04 0.00 0.41 -0.49 0.00 0.00 175.26 175.12 2cre n GLY 44 N 3.72 0.59 3.17 -1.39 0.00 -1.26 -5.06 105.19 104.96 2cre n GLY 44 Ca -0.06 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 44.97 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 1.23 -0.05 1.61 0.52 -1.26 -2.31 118.94 116.69 2cre s TRP 45 Ca 0.00 -0.45 0.03 0.00 0.02 0.00 0.00 56.10 55.70 2cre s TRP 45 Cb 0.00 -0.69 0.00 0.00 -1.15 0.00 0.00 33.47 31.63 2cre s TRP 45 CO 0.00 0.06 -0.15 -1.58 0.02 0.00 0.00 176.95 175.30 2cre s TRP 46 N -1.25 1.55 -0.66 -1.98 0.51 0.17 -4.63 118.94 112.64 2cre s TRP 46 Ca -0.02 -0.47 -0.21 0.00 -2.12 0.00 0.00 56.10 53.28 2cre s TRP 46 Cb -0.10 -1.07 0.08 0.00 -0.81 0.00 0.00 33.47 31.58 2cre s TRP 46 CO 0.02 -0.19 0.91 0.21 -0.51 0.00 0.00 176.95 177.40 2cre s LYS 47 N 0.22 3.13 0.47 4.98 2.20 -1.25 0.02 119.74 129.51 2cre s LYS 47 Ca -0.07 -1.03 0.07 0.00 -0.36 0.00 0.00 55.97 54.59 2cre s LYS 47 Cb -0.12 -4.29 -0.00 0.00 -1.51 0.00 0.00 37.83 31.91 2cre s LYS 47 CO 0.02 -1.75 0.36 0.00 -0.36 0.00 0.00 175.35 173.63 2cre s LEU 49 N -4.15 1.59 -0.14 0.00 1.98 -0.52 -2.82 118.68 114.62 2cre s LEU 49 Ca 0.42 -0.35 -0.09 0.00 -2.89 0.00 0.00 54.13 51.21 2cre s LEU 49 Cb -0.01 -0.93 0.05 0.00 0.66 0.00 0.00 46.19 45.95 2cre s LEU 49 CO 0.24 -0.00 0.36 -0.22 -1.89 0.00 0.00 176.35 174.84 2cre s LEU 50 N 0.98 0.25 -1.86 -0.68 2.96 -1.26 -3.60 118.68 115.47 2cre s LEU 50 Ca -0.08 0.75 -0.23 0.00 -0.22 0.00 0.00 54.13 54.36 2cre s LEU 50 Cb -0.15 1.17 0.23 0.00 0.50 0.00 0.00 46.19 47.94 2cre s LEU 50 CO -0.00 -0.16 0.57 1.41 -1.32 0.00 0.00 176.35 176.84 2cre n HIS 51 N 3.82 -1.15 -3.12 5.38 8.25 -1.26 0.21 115.22 127.35 2cre n HIS 51 Ca -0.21 0.68 -0.13 0.00 -0.26 0.00 0.00 57.72 57.80 2cre n HIS 51 Cb 0.55 -1.88 0.07 0.00 1.12 0.00 0.00 29.99 29.85 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 -1.12 -0.28 0.14 -1.41 0.00 -1.26 -4.98 105.19 96.28 2cre n GLY 52 Ca 0.10 0.05 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.43 0.43 -3.15 1.61 5.12 0.13 -5.04 116.66 112.33 2cre n ARG 53 Ca -0.21 0.17 -0.14 0.00 -1.93 0.00 0.00 57.85 55.74 2cre n ARG 53 Cb 0.63 -1.24 0.07 0.00 -1.16 0.00 0.00 32.46 30.76 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 -4.13 -4.84 -4.72 5.56 6.02 -1.24 -4.95 117.38 109.08 2cre n GLN 54 Ca -0.11 0.71 -0.32 0.00 -0.01 0.00 0.00 57.00 57.27 2cre n GLN 54 Cb 0.42 -5.27 -0.07 0.00 1.02 0.00 0.00 30.24 26.34 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 -3.98 3.01 0.61 1.08 0.00 -1.13 -4.94 107.32 101.97 2cre s GLY 55 Ca 0.07 -0.35 -0.04 0.00 0.00 0.00 0.00 44.72 44.40 2cre s GLY 55 CO 0.61 -2.13 0.89 1.08 0.00 0.00 0.00 173.10 173.55 2cre s LEU 56 N -3.84 3.15 -0.14 0.66 1.43 0.96 -1.93 118.68 118.98 2cre s LEU 56 Ca 0.06 0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 53.46 2cre s LEU 56 Cb 0.01 -3.26 0.04 0.00 0.03 0.00 0.00 46.19 43.01 2cre s LEU 56 CO 0.04 -1.21 0.47 0.00 0.23 0.00 0.00 176.35 175.88 2cre s ALA 57 N -2.99 -1.18 -0.41 4.21 0.00 0.10 0.85 121.76 122.35 2cre s ALA 57 Ca 0.56 1.16 -0.28 0.00 0.00 0.00 0.00 51.96 53.40 2cre s ALA 57 Cb -0.11 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 2cre s ALA 57 CO 0.43 -0.25 1.74 -1.25 0.00 0.00 0.00 175.76 176.43 2cre s PRO 58 N -0.20 3.23 0.23 0.00 0.04 -1.26 0.43 135.00 137.46 2cre s PRO 58 Ca -0.04 1.15 0.12 0.00 0.04 0.00 0.00 61.00 62.28 2cre s PRO 58 Cb -0.03 -4.21 0.68 0.00 0.04 0.00 0.00 34.50 30.98 2cre s PRO 58 CO 0.02 -1.99 1.32 0.00 0.04 0.00 0.00 177.00 176.39 2cre n ALA 59 N 10.54 0.84 0.19 8.56 0.00 -0.98 -0.06 120.51 139.60 2cre n ALA 59 Ca 0.21 0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.84 2cre n ALA 59 Cb 0.48 -1.00 0.22 0.00 0.00 0.00 0.00 19.45 19.15 2cre n ALA 59 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2cre h ASN 60 N 0.00 0.00 -0.26 0.00 4.21 -1.88 -3.12 115.58 114.52 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 0.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.45 2cre h ASN 60 CO 0.00 0.27 0.00 0.54 -1.29 0.00 0.00 177.43 176.95 2cre n ARG 61 N -3.23 2.05 -4.03 0.81 1.74 0.91 -4.98 116.66 109.93 2cre n ARG 61 Ca 0.02 -1.85 -0.31 0.00 -0.77 0.00 0.00 57.85 54.94 2cre n ARG 61 Cb 0.57 -1.32 -0.06 0.00 -1.02 0.00 0.00 32.46 30.64 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 -1.09 3.98 -0.34 0.55 2.01 -1.08 -2.46 118.68 120.25 2cre s LEU 62 Ca 0.25 0.12 0.03 0.00 0.01 0.00 0.00 54.13 54.53 2cre s LEU 62 Cb 0.14 -2.54 0.10 0.00 0.01 0.00 0.00 46.19 43.90 2cre s LEU 62 CO 0.20 0.20 0.06 -1.58 1.01 0.00 0.00 176.35 176.24 2cre s GLN 63 N -2.21 1.61 -0.02 1.70 0.74 -0.36 -4.92 119.66 116.19 2cre s GLN 63 Ca 0.29 -1.83 -0.30 0.00 0.05 0.00 0.00 55.36 53.57 2cre s GLN 63 Cb -0.12 -3.25 -0.06 0.00 1.10 0.00 0.00 33.01 30.68 2cre s GLN 63 CO 0.21 -0.93 1.58 0.42 -0.55 0.00 0.00 175.29 176.02 2cre s ILE 64 N 0.95 3.53 -0.14 -2.34 -1.09 -1.26 -1.50 121.20 119.35 2cre s ILE 64 Ca 0.09 0.78 -0.08 0.00 -2.23 0.00 0.00 60.65 59.22 2cre s ILE 64 Cb -0.20 -3.50 -0.04 0.00 -1.58 0.00 0.00 42.46 37.14 2cre s ILE 64 CO -0.07 -0.04 0.13 -0.76 -1.23 0.00 0.00 174.94 172.97 2cre s LEU 65 N 3.41 4.31 0.06 2.97 1.43 -1.20 -5.00 118.68 124.66 2cre s LEU 65 Ca 0.71 0.40 -0.25 0.00 -1.03 0.00 0.00 54.13 53.96 2cre s LEU 65 Cb -0.34 -2.07 0.06 0.00 0.03 0.00 0.00 46.19 43.88 2cre s LEU 65 CO 0.29 0.35 0.58 -0.55 0.23 0.00 0.00 176.35 177.25 2cre s SER 66 N -0.68 -0.53 0.00 2.29 0.15 -1.26 -4.82 113.70 108.85 2cre s SER 66 Ca 0.13 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.04 2cre s SER 66 Cb -0.12 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2cre s SER 66 CO 0.02 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.31 2cre n GLY 67 N 0.30 -1.59 0.11 9.45 0.00 -1.26 -4.88 105.19 107.32 2cre n GLY 67 Ca -0.18 -1.43 0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 0.00 0.16 -1.33 1.61 -0.04 -1.26 -4.80 135.00 129.33 2cre n PRO 68 Ca 0.00 0.40 -0.55 0.00 -0.04 0.00 0.00 63.50 63.31 2cre n PRO 68 Cb 0.00 -1.81 -0.11 0.00 -0.04 0.00 0.00 33.50 31.54 2cre n PRO 68 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2cre n SER 69 N -2.10 0.98 -4.75 3.54 3.41 -1.26 -4.84 113.62 108.60 2cre n SER 69 Ca 0.02 0.53 -0.41 0.00 -0.26 0.00 0.00 58.87 58.75 2cre n SER 69 Cb 0.21 -0.99 -0.03 0.00 -0.26 0.00 0.00 64.21 63.15 2cre n SER 69 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2cre s SER 70 N 6.85 6.92 0.00 4.04 0.15 -1.26 -5.11 113.70 125.28 2cre s SER 70 Ca 1.20 2.44 0.00 0.00 0.70 0.00 0.00 55.95 60.29 2cre s SER 70 Cb -1.31 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 60.38 2cre s SER 70 CO 0.59 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 175.16