#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbc n SER 2 N 0.00 1.93 -4.36 1.61 2.88 -1.26 -1.62 113.62 112.80 2dbc n SER 2 Ca 0.00 0.30 -0.38 0.00 -1.33 0.00 0.00 58.87 57.47 2dbc n SER 2 Cb 0.00 -1.25 -0.08 0.00 -0.75 0.00 0.00 64.21 62.13 2dbc n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dbc n SER 3 N 10.45 -0.99 -4.51 -3.46 3.41 -1.26 -4.78 113.62 112.48 2dbc n SER 3 Ca 0.44 -1.20 -0.40 0.00 -0.26 0.00 0.00 58.87 57.45 2dbc n SER 3 Cb 0.23 -1.52 0.02 0.00 -0.26 0.00 0.00 64.21 62.68 2dbc n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dbc n GLY 4 N -1.46 -1.10 3.76 5.00 0.00 -0.64 -4.93 105.19 105.83 2dbc n GLY 4 Ca -0.01 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2dbc n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dbc s SER 5 N -1.02 7.52 0.05 1.61 1.04 -1.26 -4.92 113.70 116.71 2dbc s SER 5 Ca 0.67 1.85 0.04 0.00 0.48 0.00 0.00 55.95 58.99 2dbc s SER 5 Cb -0.51 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.01 2dbc s SER 5 CO 0.55 0.13 -0.12 -0.44 0.98 0.00 0.00 173.24 174.33 2dbc s SER 6 N -1.27 1.46 0.76 7.02 0.01 -1.26 -5.07 113.70 115.34 2dbc s SER 6 Ca 0.42 -0.54 -0.11 0.00 1.31 0.00 0.00 55.95 57.03 2dbc s SER 6 Cb -0.24 -0.05 0.05 0.00 0.21 0.00 0.00 66.02 65.99 2dbc s SER 6 CO 0.29 -0.07 1.08 -0.83 0.41 0.00 0.00 173.24 174.12 2dbc s GLY 7 N -1.47 1.66 -0.15 3.44 0.00 -1.26 -5.00 107.32 104.53 2dbc s GLY 7 Ca -0.02 0.10 0.01 0.00 0.00 0.00 0.00 44.72 44.81 2dbc s GLY 7 CO 0.02 0.46 -0.13 0.28 0.00 0.00 0.00 173.10 173.72 2dbc n LYS 8 N -3.39 0.39 -2.91 2.90 5.02 -1.25 -5.03 118.16 113.89 2dbc n LYS 8 Ca 0.08 0.08 -0.15 0.00 -2.02 0.00 0.00 58.31 56.30 2dbc n LYS 8 Cb 0.54 -1.30 -0.00 0.00 -0.02 0.00 0.00 35.03 34.25 2dbc n LYS 8 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2dbc n PHE 9 N -2.93 -0.78 0.00 2.13 3.72 -1.19 -5.08 117.46 113.34 2dbc n PHE 9 Ca -0.26 -1.34 0.00 0.00 -0.05 0.00 0.00 57.45 55.80 2dbc n PHE 9 Cb 0.78 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 2dbc n PHE 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dbc n GLY 10 N 1.26 0.00 3.95 1.37 0.00 -1.26 -4.48 105.19 106.03 2dbc n GLY 10 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2dbc n GLY 10 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dbc s GLU 11 N 0.00 0.78 -0.09 1.61 4.04 -1.25 -4.36 118.70 119.43 2dbc s GLU 11 Ca 0.00 -0.51 -0.00 0.00 0.04 0.00 0.00 54.97 54.50 2dbc s GLU 11 Cb 0.00 0.22 -0.03 0.00 0.02 0.00 0.00 34.13 34.34 2dbc s GLU 11 CO 0.00 -0.37 -0.08 -1.17 -1.84 0.00 0.00 175.26 171.81 2dbc s LEU 12 N -3.66 3.08 0.00 1.83 2.96 -1.26 -4.69 118.68 116.94 2dbc s LEU 12 Ca 0.27 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 2dbc s LEU 12 Cb -0.02 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 2dbc s LEU 12 CO 0.02 0.29 0.11 0.54 -1.32 0.00 0.00 176.35 175.98 2dbc n ARG 13 N 2.71 0.68 -4.42 1.98 5.12 -1.24 -5.07 116.66 116.41 2dbc n ARG 13 Ca -0.18 -2.41 -0.19 0.00 -1.93 0.00 0.00 57.85 53.14 2dbc n ARG 13 Cb 0.53 1.33 -0.14 0.00 -1.16 0.00 0.00 32.46 33.02 2dbc n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2dbc s GLU 14 N -3.08 0.86 0.22 5.56 2.12 -1.26 -2.59 118.70 120.52 2dbc s GLU 14 Ca 0.15 -0.47 0.05 0.00 0.36 0.00 0.00 54.97 55.06 2dbc s GLU 14 Cb 0.01 -0.83 -0.05 0.00 0.26 0.00 0.00 34.13 33.52 2dbc s GLU 14 CO 0.11 0.22 -0.05 0.96 -0.54 0.00 0.00 175.26 175.96 2dbc s ILE 15 N -0.42 1.23 0.72 -3.70 -4.36 -0.92 -4.92 121.20 108.83 2dbc s ILE 15 Ca 0.03 -2.07 -0.02 0.00 -0.26 0.00 0.00 60.65 58.33 2dbc s ILE 15 Cb -0.05 -2.21 0.12 0.00 1.25 0.00 0.00 42.46 41.57 2dbc s ILE 15 CO -0.00 -0.45 0.99 -0.44 0.24 0.00 0.00 174.94 175.28 2dbc s SER 16 N -3.30 4.39 0.02 4.36 0.01 -1.26 -4.46 113.70 113.46 2dbc s SER 16 Ca 0.25 -0.25 -0.16 0.00 1.31 0.00 0.00 55.95 57.10 2dbc s SER 16 Cb 0.04 -0.18 -0.09 0.00 0.21 0.00 0.00 66.02 66.00 2dbc s SER 16 CO 0.07 -1.83 1.17 1.23 0.41 0.00 0.00 173.24 174.29 2dbc h GLY 17 N -0.54 -0.62 0.15 3.44 0.00 -1.93 0.82 103.07 104.39 2dbc h GLY 17 Ca -0.38 0.23 0.19 0.00 0.00 0.00 0.00 47.33 47.37 2dbc h GLY 17 CO 0.42 -0.22 0.74 3.43 0.00 0.00 0.00 176.54 180.91 2dbc h ASN 18 N -0.62 0.00 0.33 0.19 4.21 -1.96 0.55 115.58 118.27 2dbc h ASN 18 Ca -0.06 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.12 2dbc h ASN 18 Cb 0.45 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.67 2dbc h ASN 18 CO 0.10 0.00 -1.53 1.56 -1.29 0.00 0.00 177.43 176.27 2dbc h GLN 19 N 0.00 0.42 -0.89 0.81 1.08 -1.87 -3.33 115.11 111.32 2dbc h GLN 19 Ca 0.31 -0.71 0.35 0.00 -1.45 0.00 0.00 58.65 57.15 2dbc h GLN 19 Cb 1.79 0.27 -0.14 0.00 -0.05 0.00 0.00 27.48 29.35 2dbc h GLN 19 CO -0.00 1.33 0.51 0.98 -0.95 0.00 0.00 178.83 180.69 2dbc n TYR 20 N -3.61 0.85 0.00 2.96 4.19 0.19 0.50 117.16 122.23 2dbc n TYR 20 Ca -0.18 0.86 0.00 0.00 3.31 0.00 0.00 57.90 61.89 2dbc n TYR 20 Cb 1.08 -1.27 0.00 0.00 0.49 0.00 0.00 39.34 39.63 2dbc n TYR 20 CO 0.00 0.00 0.00 0.28 0.91 0.00 0.00 176.86 178.05 2dbc n VAL 21 N -4.70 0.00 0.11 2.97 0.31 -1.24 -0.37 118.33 115.41 2dbc n VAL 21 Ca 0.31 0.55 0.15 0.00 -0.01 0.00 0.00 64.34 65.34 2dbc n VAL 21 Cb 1.10 -1.44 0.38 0.00 -0.91 0.00 0.00 33.84 32.97 2dbc n VAL 21 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2dbc h ASN 22 N 0.00 0.00 0.00 4.52 -1.24 -1.41 0.35 115.58 117.80 2dbc h ASN 22 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2dbc h ASN 22 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2dbc h ASN 22 CO 0.00 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.52 2dbc n GLU 23 N -2.98 0.00 0.00 6.67 -0.58 0.18 -4.34 120.64 119.59 2dbc n GLU 23 Ca 0.09 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2dbc n GLU 23 Cb 1.04 -0.54 0.00 0.00 -0.57 0.00 0.00 31.44 31.37 2dbc n GLU 23 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2dbc n VAL 24 N -2.13 0.00 -0.14 2.62 0.31 0.50 -1.37 118.33 118.11 2dbc n VAL 24 Ca 0.00 0.96 -0.04 0.00 -0.01 0.00 0.00 64.34 65.25 2dbc n VAL 24 Cb 0.00 -1.90 -0.04 0.00 -0.91 0.00 0.00 33.84 30.99 2dbc n VAL 24 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2dbc h THR 25 N 0.00 0.00 -0.24 2.52 2.02 -0.92 0.55 112.91 116.83 2dbc h THR 25 Ca 0.00 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 2dbc h THR 25 Cb 0.00 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.34 2dbc h THR 25 CO 0.00 0.00 0.17 0.59 0.37 0.00 0.00 175.52 176.65 2dbc n ASN 26 N -3.82 3.99 -4.59 4.18 5.03 0.11 -4.22 115.26 115.94 2dbc n ASN 26 Ca 0.00 -2.49 -0.30 0.00 0.87 0.00 0.00 54.58 52.66 2dbc n ASN 26 Cb 0.10 -0.73 0.21 0.00 -1.02 0.00 0.00 39.78 38.33 2dbc n ASN 26 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2dbc s ALA 27 N -0.83 0.59 1.03 5.41 0.00 0.19 -4.71 121.76 123.44 2dbc s ALA 27 Ca 0.14 0.32 -0.21 0.00 0.00 0.00 0.00 51.96 52.21 2dbc s ALA 27 Cb 0.12 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 2dbc s ALA 27 CO 0.02 -3.28 -0.64 -1.91 0.00 0.00 0.00 175.76 169.95 2dbc n GLU 28 N -4.57 -0.93 -2.01 0.00 2.13 -1.26 -4.83 120.64 109.18 2dbc n GLU 28 Ca 0.08 -0.27 -0.41 0.00 0.66 0.00 0.00 57.16 57.22 2dbc n GLU 28 Cb 0.53 -1.34 -0.02 0.00 0.27 0.00 0.00 31.44 30.87 2dbc n GLU 28 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2dbc s LYS 29 N -2.76 4.27 -1.20 5.31 2.20 -1.26 -3.05 119.74 123.25 2dbc s LYS 29 Ca 0.43 2.32 -0.06 0.00 -0.36 0.00 0.00 55.97 58.30 2dbc s LYS 29 Cb -0.01 -3.09 0.06 0.00 -1.51 0.00 0.00 37.83 33.28 2dbc s LYS 29 CO 0.60 -0.39 0.14 -0.40 -0.36 0.00 0.00 175.35 174.93 2dbc n ASP 30 N 1.85 0.05 -4.48 1.43 5.68 -1.26 -4.87 116.55 114.94 2dbc n ASP 30 Ca 0.05 -0.92 -0.34 0.00 -0.50 0.00 0.00 54.79 53.08 2dbc n ASP 30 Cb 0.40 -1.15 -0.12 0.00 -1.14 0.00 0.00 41.12 39.11 2dbc n ASP 30 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2dbc s LEU 31 N -5.96 3.21 0.11 -2.12 2.96 -1.14 -5.00 118.68 110.75 2dbc s LEU 31 Ca 0.19 -0.16 -0.30 0.00 -0.22 0.00 0.00 54.13 53.65 2dbc s LEU 31 Cb -0.11 -1.78 -0.06 0.00 0.50 0.00 0.00 46.19 44.74 2dbc s LEU 31 CO 0.73 0.15 0.96 0.26 -1.32 0.00 0.00 176.35 177.13 2dbc s TRP 32 N 0.47 3.81 -0.14 5.38 0.52 -1.26 -4.27 118.94 123.45 2dbc s TRP 32 Ca -0.04 1.80 -0.03 0.00 0.02 0.00 0.00 56.10 57.85 2dbc s TRP 32 Cb -0.14 -3.06 0.05 0.00 -1.15 0.00 0.00 33.47 29.17 2dbc s TRP 32 CO 0.03 0.20 0.05 0.08 0.02 0.00 0.00 176.95 177.33 2dbc s VAL 33 N -0.01 0.18 -0.40 4.03 1.01 0.82 -0.68 120.40 125.35 2dbc s VAL 33 Ca 0.47 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 62.17 2dbc s VAL 33 Cb -0.23 -0.66 0.05 0.00 0.00 0.00 0.00 36.38 35.53 2dbc s VAL 33 CO 0.30 -0.11 0.25 -0.69 0.00 0.00 0.00 175.10 174.85 2dbc s VAL 34 N 2.02 4.61 0.07 2.92 1.01 0.34 -1.19 120.40 130.18 2dbc s VAL 34 Ca 0.02 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.97 2dbc s VAL 34 Cb -0.15 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2dbc s VAL 34 CO -0.07 -0.35 0.26 -0.51 0.00 0.00 0.00 175.10 174.42 2dbc s ILE 35 N 1.54 5.33 -0.05 2.22 2.07 -0.82 -2.61 121.20 128.88 2dbc s ILE 35 Ca 0.03 -0.19 -0.02 0.00 -1.41 0.00 0.00 60.65 59.05 2dbc s ILE 35 Cb -0.21 -3.61 0.03 0.00 0.13 0.00 0.00 42.46 38.80 2dbc s ILE 35 CO 0.06 0.16 0.04 -2.28 -1.91 0.00 0.00 174.94 171.01 2dbc s HIS 36 N -1.50 0.26 -0.53 3.50 5.65 -0.14 -2.15 115.29 120.37 2dbc s HIS 36 Ca 0.35 0.12 -0.20 0.00 0.25 0.00 0.00 55.06 55.57 2dbc s HIS 36 Cb -0.13 -0.58 0.06 0.00 -1.18 0.00 0.00 32.58 30.75 2dbc s HIS 36 CO 0.25 -0.23 0.72 -0.51 -0.65 0.00 0.00 174.74 174.32 2dbc s LEU 37 N 2.09 4.78 0.46 8.88 1.43 -0.87 -2.83 118.68 132.62 2dbc s LEU 37 Ca 0.05 -0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 52.29 2dbc s LEU 37 Cb -0.12 -2.51 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 2dbc s LEU 37 CO -0.04 -1.02 0.71 -0.72 0.23 0.00 0.00 176.35 175.51 2dbc s TYR 38 N 3.02 3.30 -0.18 0.29 1.13 -1.24 -4.09 117.35 119.58 2dbc s TYR 38 Ca 0.19 0.38 -0.11 0.00 -1.41 0.00 0.00 57.07 56.12 2dbc s TYR 38 Cb -0.18 -2.33 0.06 0.00 -1.10 0.00 0.00 41.96 38.41 2dbc s TYR 38 CO 0.13 -0.37 0.45 1.03 -2.51 0.00 0.00 175.55 174.28 2dbc s ARG 39 N -4.62 0.45 0.52 -3.49 0.52 -1.26 -4.37 118.95 106.70 2dbc s ARG 39 Ca 0.48 0.80 0.19 0.00 -0.52 0.00 0.00 55.73 56.68 2dbc s ARG 39 Cb -0.10 0.05 1.29 0.00 0.52 0.00 0.00 34.95 36.71 2dbc s ARG 39 CO 0.40 -0.14 2.09 0.66 0.02 0.00 0.00 175.30 178.33 2dbc h SER 40 N 6.74 0.03 0.28 0.23 4.64 -2.01 -0.73 113.55 122.73 2dbc h SER 40 Ca -0.34 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.82 2dbc h SER 40 Cb 1.19 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2dbc h SER 40 CO 0.27 0.02 -0.62 -1.28 -0.87 0.00 0.00 176.83 174.34 2dbc h SER 41 N 0.03 0.38 -3.41 4.97 0.87 -2.05 -3.42 113.55 110.93 2dbc h SER 41 Ca 0.10 -0.22 -0.60 0.00 -1.23 0.00 0.00 61.79 59.83 2dbc h SER 41 Cb 0.35 -0.11 -0.10 0.00 -0.44 0.00 0.00 62.40 62.10 2dbc h SER 41 CO -0.00 0.90 0.28 -0.69 -0.53 0.00 0.00 176.83 176.79 2dbc s VAL 42 N -3.77 4.92 0.03 2.23 1.01 -0.28 -4.96 120.40 119.57 2dbc s VAL 42 Ca -0.05 1.27 -0.21 0.00 0.00 0.00 0.00 61.98 62.98 2dbc s VAL 42 Cb 0.11 -4.02 -0.15 0.00 0.00 0.00 0.00 36.38 32.33 2dbc s VAL 42 CO 0.81 -0.04 1.34 1.55 0.00 0.00 0.00 175.10 178.76 2dbc h PRO 43 N 7.86 0.30 -0.29 2.72 0.13 -1.82 -3.28 132.00 137.62 2dbc h PRO 43 Ca -0.25 -0.16 0.07 0.00 -0.87 0.00 0.00 66.00 64.79 2dbc h PRO 43 Cb 1.11 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.17 2dbc h PRO 43 CO 0.82 0.70 -0.19 1.98 -0.23 0.00 0.00 178.00 181.07 2dbc h MET 44 N -0.09 -0.16 -0.77 0.86 4.05 -1.93 -2.43 114.93 114.47 2dbc h MET 44 Ca 0.02 0.01 0.10 0.00 -0.28 0.00 0.00 59.70 59.55 2dbc h MET 44 Cb 0.64 0.04 -0.11 0.00 -0.80 0.00 0.00 31.60 31.37 2dbc h MET 44 CO 0.03 -0.11 -0.36 0.00 0.23 0.00 0.00 176.91 176.71 2dbc h LEU 46 N 0.00 -0.47 -0.12 0.00 3.38 -1.56 0.15 115.31 116.69 2dbc h LEU 46 Ca 0.21 0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.42 2dbc h LEU 46 Cb 0.40 0.42 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2dbc h LEU 46 CO -0.75 -0.24 0.04 0.58 0.09 0.00 0.00 178.44 178.16 2dbc h VAL 47 N 0.06 0.97 -0.91 1.22 2.07 0.96 -2.08 116.25 118.53 2dbc h VAL 47 Ca 0.46 -0.03 0.12 0.00 0.82 0.00 0.00 66.70 68.06 2dbc h VAL 47 Cb 0.83 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 31.38 2dbc h VAL 47 CO -0.77 0.02 0.54 0.58 0.02 0.00 0.00 177.57 177.96 2dbc h VAL 48 N 0.10 0.88 -0.66 2.57 2.07 -0.18 -0.81 116.25 120.21 2dbc h VAL 48 Ca 0.05 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2dbc h VAL 48 Cb 0.03 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.72 2dbc h VAL 48 CO -0.05 0.16 0.20 0.78 0.02 0.00 0.00 177.57 178.68 2dbc h ASN 49 N 0.85 0.95 -0.25 0.57 2.35 -0.73 -1.14 115.58 118.18 2dbc h ASN 49 Ca 0.46 -0.17 0.05 0.00 -0.55 0.00 0.00 56.30 56.10 2dbc h ASN 49 Cb 0.49 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.56 2dbc h ASN 49 CO -0.28 0.89 -0.10 1.56 -1.65 0.00 0.00 177.43 177.84 2dbc h GLN 50 N 0.98 -0.06 -0.06 0.81 4.20 -0.48 -1.76 115.11 118.73 2dbc h GLN 50 Ca 0.22 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 2dbc h GLN 50 Cb 0.28 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 2dbc h GLN 50 CO -0.01 -0.04 -0.02 0.45 -0.67 0.00 0.00 178.83 178.54 2dbc h HIS 51 N -0.07 0.14 -1.37 2.96 3.86 -1.35 -2.94 115.15 116.38 2dbc h HIS 51 Ca 0.13 -0.03 0.43 0.00 -1.16 0.00 0.00 60.37 59.74 2dbc h HIS 51 Cb 0.26 -0.03 -0.11 0.00 1.06 0.00 0.00 27.41 28.58 2dbc h HIS 51 CO -0.29 0.46 0.90 -0.07 0.86 0.00 0.00 177.93 179.80 2dbc h LEU 52 N -0.22 0.21 -0.28 2.43 3.38 -0.80 0.81 115.31 120.85 2dbc h LEU 52 Ca 0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2dbc h LEU 52 Cb 0.42 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2dbc h LEU 52 CO 0.01 -0.13 0.04 0.28 0.09 0.00 0.00 178.44 178.73 2dbc h SER 53 N 0.09 0.45 -0.02 -0.43 0.02 -1.14 0.12 113.55 112.64 2dbc h SER 53 Ca 0.80 -0.27 -0.20 0.00 -0.84 0.00 0.00 61.79 61.28 2dbc h SER 53 Cb 2.61 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 65.04 2dbc h SER 53 CO -0.34 0.60 -0.72 0.58 -1.14 0.00 0.00 176.83 175.82 2dbc h VAL 54 N 0.28 1.31 0.00 2.27 2.07 0.40 -3.07 116.25 119.51 2dbc h VAL 54 Ca 0.08 -1.98 -0.06 0.00 0.82 0.00 0.00 66.70 65.57 2dbc h VAL 54 Cb 0.35 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 2dbc h VAL 54 CO 0.01 0.62 -0.27 -0.07 0.02 0.00 0.00 177.57 177.87 2dbc h LEU 55 N 0.46 0.00 -0.27 2.57 3.38 -0.53 -1.21 115.31 119.70 2dbc h LEU 55 Ca -0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2dbc h LEU 55 Cb 1.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2dbc h LEU 55 CO 0.14 0.27 -0.13 0.00 0.09 0.00 0.00 178.44 178.81 2dbc h ALA 56 N 1.73 0.39 0.00 1.53 0.00 -0.88 -1.81 119.26 120.22 2dbc h ALA 56 Ca -0.00 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 2dbc h ALA 56 Cb 0.66 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2dbc h ALA 56 CO 0.04 0.26 -0.47 0.07 0.00 0.00 0.00 179.25 179.14 2dbc h ARG 57 N 0.31 0.00 -0.25 0.00 0.11 -1.49 -3.27 114.38 109.79 2dbc h ARG 57 Ca 0.06 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.95 2dbc h ARG 57 Cb 0.65 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.73 2dbc h ARG 57 CO 0.04 0.47 -0.61 -0.22 0.10 0.00 0.00 179.97 179.76 2dbc h LYS 58 N 0.00 0.84 -3.23 0.08 3.64 -1.15 -3.38 116.57 113.37 2dbc h LYS 58 Ca -0.00 -0.57 -0.63 0.00 -1.27 0.00 0.00 60.65 58.18 2dbc h LYS 58 Cb 1.33 0.08 -0.41 0.00 -0.41 0.00 0.00 32.23 32.82 2dbc h LYS 58 CO 0.06 1.20 -0.64 -0.06 -2.27 0.00 0.00 179.45 177.74 2dbc s PHE 59 N -4.02 3.06 -0.02 1.91 0.08 -0.69 -4.93 117.98 113.37 2dbc s PHE 59 Ca -0.10 -3.10 0.32 0.00 0.12 0.00 0.00 56.93 54.17 2dbc s PHE 59 Cb 0.10 -2.62 1.31 0.00 -0.57 0.00 0.00 43.02 41.24 2dbc s PHE 59 CO 0.89 -0.70 1.93 -1.00 -0.10 0.00 0.00 175.22 176.24 2dbc h PRO 60 N 6.24 0.00 -0.28 0.24 0.13 -1.76 -3.00 132.00 133.57 2dbc h PRO 60 Ca -0.01 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.94 2dbc h PRO 60 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2dbc h PRO 60 CO 0.66 0.00 -0.53 0.93 -0.23 0.00 0.00 178.00 178.83 2dbc h GLU 61 N 0.00 0.86 -6.15 0.86 5.08 -1.90 -3.14 114.58 110.18 2dbc h GLU 61 Ca 0.00 -0.55 -0.56 0.00 -1.00 0.00 0.00 59.36 57.25 2dbc h GLU 61 Cb 0.45 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 2dbc h GLU 61 CO 0.00 1.18 0.05 0.99 -1.00 0.00 0.00 179.01 180.23 2dbc s THR 62 N -4.12 4.86 0.28 1.13 2.01 -1.14 -4.69 115.64 113.98 2dbc s THR 62 Ca -0.11 1.39 -0.25 0.00 0.31 0.00 0.00 61.69 63.04 2dbc s THR 62 Cb 0.10 -4.00 -0.09 0.00 0.01 0.00 0.00 72.50 68.51 2dbc s THR 62 CO 0.89 0.38 0.88 -0.75 -0.69 0.00 0.00 174.62 175.33 2dbc s LYS 63 N -0.05 4.52 -0.04 4.92 2.20 0.14 -4.93 119.74 126.50 2dbc s LYS 63 Ca 0.34 1.22 0.01 0.00 -0.36 0.00 0.00 55.97 57.18 2dbc s LYS 63 Cb -0.19 -2.88 0.02 0.00 -1.51 0.00 0.00 37.83 33.27 2dbc s LYS 63 CO 0.19 0.34 -0.05 -0.06 -0.36 0.00 0.00 175.35 175.42 2dbc s PHE 64 N -1.54 0.76 0.22 4.03 0.08 -1.26 -0.51 117.98 119.77 2dbc s PHE 64 Ca 0.47 -0.21 -0.09 0.00 0.12 0.00 0.00 56.93 57.22 2dbc s PHE 64 Cb -0.19 -0.67 -0.01 0.00 -0.57 0.00 0.00 43.02 41.58 2dbc s PHE 64 CO 0.24 -0.19 0.35 0.14 -0.10 0.00 0.00 175.22 175.66 2dbc s VAL 65 N 0.90 0.01 -0.01 -0.44 -7.23 -1.07 -3.70 120.40 108.85 2dbc s VAL 65 Ca -0.11 -1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 58.42 2dbc s VAL 65 Cb -0.14 -2.23 0.00 0.00 0.56 0.00 0.00 36.38 34.57 2dbc s VAL 65 CO 0.00 -0.05 0.14 -1.59 -0.31 0.00 0.00 175.10 173.30 2dbc s LYS 66 N -4.05 0.41 -0.03 4.82 -2.85 -1.07 -0.96 119.74 116.01 2dbc s LYS 66 Ca 0.26 -0.25 -0.07 0.00 -1.00 0.00 0.00 55.97 54.90 2dbc s LYS 66 Cb 0.02 0.18 0.01 0.00 -2.06 0.00 0.00 37.83 35.98 2dbc s LYS 66 CO 0.08 -0.09 0.18 0.00 0.10 0.00 0.00 175.35 175.62 2dbc s ALA 67 N -1.03 -0.43 0.40 0.59 0.00 -1.13 -2.17 121.76 117.99 2dbc s ALA 67 Ca -0.11 0.22 -0.24 0.00 0.00 0.00 0.00 51.96 51.83 2dbc s ALA 67 Cb -0.06 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 22.87 2dbc s ALA 67 CO 0.01 -0.15 1.04 0.42 0.00 0.00 0.00 175.76 177.08 2dbc s ILE 68 N -0.66 3.76 0.15 0.00 -1.09 -1.26 -3.69 121.20 118.41 2dbc s ILE 68 Ca -0.07 1.34 -0.13 0.00 -2.23 0.00 0.00 60.65 59.55 2dbc s ILE 68 Cb -0.04 -3.68 0.03 0.00 -1.58 0.00 0.00 42.46 37.18 2dbc s ILE 68 CO 0.01 -0.01 1.66 0.58 -1.23 0.00 0.00 174.94 175.95 2dbc h VAL 69 N 2.18 1.24 -0.28 2.92 2.07 -1.92 -3.43 116.25 119.02 2dbc h VAL 69 Ca -0.48 -0.82 -0.62 0.00 0.82 0.00 0.00 66.70 65.60 2dbc h VAL 69 Cb 1.21 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 2dbc h VAL 69 CO 0.62 0.30 0.83 -3.20 0.02 0.00 0.00 177.57 176.14 2dbc n ASN 70 N -4.48 0.70 -2.69 0.57 2.85 -1.26 0.91 115.26 111.87 2dbc n ASN 70 Ca 0.01 0.66 -0.13 0.00 -0.11 0.00 0.00 54.58 55.02 2dbc n ASN 70 Cb 0.21 -0.68 0.06 0.00 1.24 0.00 0.00 39.78 40.61 2dbc n ASN 70 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2dbc n SER 71 N 4.73 -2.69 0.10 1.20 2.88 -1.26 -4.94 113.62 113.63 2dbc n SER 71 Ca 0.35 -0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2dbc n SER 71 Cb -0.04 -3.71 0.00 0.00 -0.75 0.00 0.00 64.21 59.71 2dbc n SER 71 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dbc s ILE 73 N -1.95 0.64 -2.02 0.00 1.01 -1.25 -5.01 121.20 112.60 2dbc s ILE 73 Ca 0.00 -0.27 0.24 0.00 0.00 0.00 0.00 60.65 60.62 2dbc s ILE 73 Cb 0.00 -0.58 0.15 0.00 0.01 0.00 0.00 42.46 42.03 2dbc s ILE 73 CO 0.00 0.21 1.32 -1.84 0.00 0.00 0.00 174.94 174.63 2dbc n GLU 74 N 3.37 1.17 -1.15 2.79 0.28 -1.26 -4.19 120.64 121.65 2dbc n GLU 74 Ca -0.19 -0.87 -0.26 0.00 -0.16 0.00 0.00 57.16 55.68 2dbc n GLU 74 Cb 0.54 -1.48 0.10 0.00 1.43 0.00 0.00 31.44 32.03 2dbc n GLU 74 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2dbc n HIS 75 N -0.16 2.72 -3.82 -1.84 8.25 -1.26 -4.78 115.22 114.33 2dbc n HIS 75 Ca 0.11 -2.33 -0.30 0.00 -0.26 0.00 0.00 57.72 54.94 2dbc n HIS 75 Cb 0.42 -1.14 -0.14 0.00 1.12 0.00 0.00 29.99 30.25 2dbc n HIS 75 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2dbc s TYR 76 N -3.10 2.45 -0.22 4.41 1.51 -1.26 -4.95 117.35 116.18 2dbc s TYR 76 Ca 0.53 -2.40 -0.15 0.00 -1.01 0.00 0.00 57.07 54.03 2dbc s TYR 76 Cb 0.43 -2.19 -0.18 0.00 -0.11 0.00 0.00 41.96 39.91 2dbc s TYR 76 CO 0.03 -0.85 0.02 -2.39 -1.11 0.00 0.00 175.55 171.24 2dbc n HIS 77 N 4.14 0.65 -3.64 2.71 1.44 -1.26 -5.08 115.22 114.18 2dbc n HIS 77 Ca 0.03 0.24 -0.00 0.00 -2.01 0.00 0.00 57.72 55.98 2dbc n HIS 77 Cb 0.39 -1.07 -0.01 0.00 0.12 0.00 0.00 29.99 29.42 2dbc n HIS 77 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2dbc s ASP 78 N -7.06 -0.10 -1.38 4.39 2.15 -1.26 -5.01 116.67 108.41 2dbc s ASP 78 Ca -0.32 -0.17 -0.04 0.00 0.43 0.00 0.00 52.55 52.45 2dbc s ASP 78 Cb 0.09 0.23 0.00 0.00 -0.30 0.00 0.00 42.92 42.94 2dbc s ASP 78 CO 0.58 -0.42 0.45 0.59 -0.17 0.00 0.00 175.17 176.20 2dbc n ASN 79 N -0.44 -0.93 0.00 -0.34 3.02 -1.26 -4.84 115.26 110.46 2dbc n ASN 79 Ca -0.07 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.45 2dbc n ASN 79 Cb 0.62 -2.97 0.00 0.00 -0.61 0.00 0.00 39.78 36.82 2dbc n ASN 79 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dbc s LEU 81 N -3.03 4.22 0.94 0.00 1.43 -1.26 -2.39 118.68 118.59 2dbc s LEU 81 Ca 0.00 0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 53.53 2dbc s LEU 81 Cb 0.00 -3.30 0.16 0.00 0.03 0.00 0.00 46.19 43.07 2dbc s LEU 81 CO 0.00 -0.02 1.09 -2.16 0.23 0.00 0.00 176.35 175.49 2dbc s PRO 82 N -3.04 0.87 -0.04 1.29 0.04 -1.26 -3.80 135.00 129.06 2dbc s PRO 82 Ca 0.41 0.68 -0.00 0.00 0.04 0.00 0.00 61.00 62.12 2dbc s PRO 82 Cb -0.11 -1.77 0.03 0.00 0.04 0.00 0.00 34.50 32.68 2dbc s PRO 82 CO 0.27 -2.47 -0.00 0.99 0.04 0.00 0.00 177.00 175.83 2dbc s THR 83 N -2.95 0.24 -0.04 1.26 2.01 -1.25 -2.82 115.64 112.08 2dbc s THR 83 Ca 0.64 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.78 2dbc s THR 83 Cb -0.18 -0.35 -0.00 0.00 0.01 0.00 0.00 72.50 71.98 2dbc s THR 83 CO 0.57 0.18 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.89 2dbc s ILE 84 N 1.28 1.34 -0.11 1.82 1.01 -0.93 -2.05 121.20 123.57 2dbc s ILE 84 Ca -0.06 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.93 2dbc s ILE 84 Cb -0.13 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.20 2dbc s ILE 84 CO -0.02 0.39 -0.10 -0.36 0.00 0.00 0.00 174.94 174.84 2dbc s PHE 85 N 0.10 1.62 -0.22 3.97 0.08 -0.92 -1.34 117.98 121.27 2dbc s PHE 85 Ca -0.05 -0.78 -0.09 0.00 0.12 0.00 0.00 56.93 56.14 2dbc s PHE 85 Cb -0.11 -1.26 -0.04 0.00 -0.57 0.00 0.00 43.02 41.03 2dbc s PHE 85 CO 0.02 -0.48 0.12 0.08 -0.10 0.00 0.00 175.22 174.86 2dbc s VAL 86 N 1.35 5.04 -0.07 -0.44 1.01 -0.64 -1.95 120.40 124.70 2dbc s VAL 86 Ca -0.01 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.08 2dbc s VAL 86 Cb -0.14 -3.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.92 2dbc s VAL 86 CO -0.05 0.39 -0.22 -0.31 0.00 0.00 0.00 175.10 174.91 2dbc s TYR 87 N 0.87 2.26 -0.03 5.22 1.51 -0.33 0.28 117.35 127.13 2dbc s TYR 87 Ca 0.06 -0.78 -0.06 0.00 -1.01 0.00 0.00 57.07 55.28 2dbc s TYR 87 Cb -0.13 -1.51 -0.02 0.00 -0.11 0.00 0.00 41.96 40.19 2dbc s TYR 87 CO 0.03 -0.28 -0.12 1.17 -1.11 0.00 0.00 175.55 175.24 2dbc n LYS 88 N 3.26 0.18 -2.16 -0.62 0.00 -1.25 -0.12 118.16 117.44 2dbc n LYS 88 Ca -0.19 0.07 -0.19 0.00 0.00 0.00 0.00 58.31 58.01 2dbc n LYS 88 Cb 0.52 -0.73 0.03 0.00 0.00 0.00 0.00 35.03 34.86 2dbc n LYS 88 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2dbc n ASN 89 N -3.46 4.18 0.00 3.14 3.02 -1.26 -2.88 115.26 117.99 2dbc n ASN 89 Ca -0.05 -3.39 0.00 0.00 -0.03 0.00 0.00 54.58 51.11 2dbc n ASN 89 Cb 0.17 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 2dbc n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dbc n GLY 90 N -0.69 0.86 2.75 7.41 0.00 -1.26 -5.05 105.19 109.21 2dbc n GLY 90 Ca 0.36 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 2dbc n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbc n GLN 91 N -2.08 0.71 -3.53 1.61 10.64 -1.26 -5.04 117.38 118.43 2dbc n GLN 91 Ca 0.00 -2.82 -0.40 0.00 -1.83 0.00 0.00 57.00 51.95 2dbc n GLN 91 Cb 0.06 1.40 -0.05 0.00 -0.86 0.00 0.00 30.24 30.79 2dbc n GLN 91 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2dbc s ILE 92 N -2.73 4.84 0.28 -0.39 1.01 -1.26 -3.91 121.20 119.05 2dbc s ILE 92 Ca 0.14 -3.40 0.02 0.00 0.00 0.00 0.00 60.65 57.41 2dbc s ILE 92 Cb 0.01 -3.99 0.27 0.00 0.01 0.00 0.00 42.46 38.75 2dbc s ILE 92 CO 0.10 -1.07 1.76 -0.33 0.00 0.00 0.00 174.94 175.40 2dbc h GLU 93 N 6.60 0.62 -1.67 2.79 4.39 -0.54 -3.43 114.58 123.33 2dbc h GLU 93 Ca 0.13 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.85 2dbc h GLU 93 Cb 0.88 -0.14 -0.25 0.00 -0.10 0.00 0.00 28.75 29.14 2dbc h GLU 93 CO 0.85 0.41 0.35 0.20 -1.16 0.00 0.00 179.01 179.66 2dbc s GLY 94 N -3.63 -0.21 0.05 -3.84 0.00 -1.24 -4.94 107.32 93.51 2dbc s GLY 94 Ca -0.12 2.70 0.09 0.00 0.00 0.00 0.00 44.72 47.39 2dbc s GLY 94 CO 0.79 2.09 -0.24 -1.59 0.00 0.00 0.00 173.10 174.15 2dbc s LYS 95 N 0.70 1.83 -0.33 2.90 -2.85 -1.26 -1.62 119.74 119.12 2dbc s LYS 95 Ca -0.02 -1.10 -0.01 0.00 -1.00 0.00 0.00 55.97 53.84 2dbc s LYS 95 Cb -0.05 -2.03 0.11 0.00 -2.06 0.00 0.00 37.83 33.80 2dbc s LYS 95 CO -0.09 0.51 0.12 -0.06 0.10 0.00 0.00 175.35 175.93 2dbc s PHE 96 N -0.86 1.64 -0.25 1.78 0.40 -0.45 -4.98 117.98 115.25 2dbc s PHE 96 Ca 0.13 -1.78 -0.02 0.00 -0.60 0.00 0.00 56.93 54.66 2dbc s PHE 96 Cb -0.10 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.78 2dbc s PHE 96 CO 0.03 -0.86 -0.04 0.42 0.70 0.00 0.00 175.22 175.47 2dbc s ILE 97 N 1.47 3.03 0.00 0.64 1.09 -1.26 -2.19 121.20 123.98 2dbc s ILE 97 Ca 0.11 -0.98 0.00 0.00 -1.10 0.00 0.00 60.65 58.68 2dbc s ILE 97 Cb -0.18 -2.54 0.00 0.00 -1.06 0.00 0.00 42.46 38.68 2dbc s ILE 97 CO -0.22 0.18 0.00 0.61 -0.10 0.00 0.00 174.94 175.41 2dbc n GLY 98 N 4.70 3.69 0.40 6.18 0.00 -1.01 -4.59 105.19 114.56 2dbc n GLY 98 Ca -0.16 -1.61 -0.14 0.00 0.00 0.00 0.00 46.02 44.11 2dbc n GLY 98 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dbc h ILE 99 N 0.92 0.20 -0.67 -0.61 1.08 -1.85 -1.55 117.51 115.03 2dbc h ILE 99 Ca 0.00 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 2dbc h ILE 99 Cb 0.00 0.20 -0.03 0.00 -3.07 0.00 0.00 36.82 33.93 2dbc h ILE 99 CO 0.00 0.00 0.18 0.40 -0.69 0.00 0.00 178.15 178.04 2dbc h ILE 100 N -0.66 1.26 -0.26 -0.67 5.03 -1.92 0.15 117.51 120.43 2dbc h ILE 100 Ca 0.01 -0.93 0.08 0.00 -0.12 0.00 0.00 64.86 63.90 2dbc h ILE 100 Cb 0.67 0.57 -0.01 0.00 -3.03 0.00 0.00 36.82 35.02 2dbc h ILE 100 CO -0.19 0.35 0.30 -0.33 -0.68 0.00 0.00 178.15 177.60 2dbc h GLU 101 N 1.00 0.00 -0.74 2.37 5.08 -1.71 0.29 114.58 120.86 2dbc h GLU 101 Ca 0.21 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.27 2dbc h GLU 101 Cb 0.35 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.41 2dbc h GLU 101 CO -0.00 0.00 0.34 0.00 -1.00 0.00 0.00 179.01 178.35 2dbc n GLY 103 N -0.67 2.65 0.00 0.00 0.00 0.10 -4.78 105.19 102.49 2dbc n GLY 103 Ca 0.45 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2dbc n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbc n GLY 104 N 0.00 1.68 0.05 -0.02 0.00 0.46 -4.28 105.19 103.08 2dbc n GLY 104 Ca 0.00 -2.05 0.04 0.00 0.00 0.00 0.00 46.02 44.00 2dbc n GLY 104 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2dbc n ILE 105 N 0.98 1.69 -0.58 -0.61 -6.64 -1.26 -0.15 119.36 112.79 2dbc n ILE 105 Ca 0.00 0.57 0.08 0.00 -1.77 0.00 0.00 62.75 61.63 2dbc n ILE 105 Cb 0.00 -1.57 0.28 0.00 -1.44 0.00 0.00 39.64 36.91 2dbc n ILE 105 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 2dbc n ASN 106 N -1.74 4.04 -4.57 7.28 0.23 -1.26 -4.98 115.26 114.25 2dbc n ASN 106 Ca -0.00 -2.44 -0.47 0.00 -0.53 0.00 0.00 54.58 51.14 2dbc n ASN 106 Cb 0.01 -0.47 -0.05 0.00 -2.08 0.00 0.00 39.78 37.20 2dbc n ASN 106 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2dbc n LEU 107 N 0.60 3.00 -4.80 -4.53 7.94 0.79 -4.94 117.00 115.06 2dbc n LEU 107 Ca 0.21 0.47 -0.29 0.00 -1.11 0.00 0.00 56.01 55.28 2dbc n LEU 107 Cb 0.76 -1.42 0.12 0.00 0.53 0.00 0.00 43.42 43.40 2dbc n LEU 107 CO 0.17 -0.52 0.72 -0.54 -1.11 0.00 0.00 177.39 176.11 2dbc s LYS 108 N 5.74 1.48 0.37 1.96 1.02 -1.26 -4.91 119.74 124.14 2dbc s LYS 108 Ca 1.01 0.40 0.11 0.00 0.02 0.00 0.00 55.97 57.52 2dbc s LYS 108 Cb -0.58 -1.87 0.72 0.00 -0.52 0.00 0.00 37.83 35.59 2dbc s LYS 108 CO 0.43 -1.99 1.84 1.25 -0.92 0.00 0.00 175.35 175.97 2dbc h LEU 109 N -1.35 0.07 0.07 3.17 5.85 -1.99 -2.82 115.31 118.32 2dbc h LEU 109 Ca -0.49 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.10 2dbc h LEU 109 Cb 1.31 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.33 2dbc h LEU 109 CO 0.61 0.39 -0.50 -0.33 -0.34 0.00 0.00 178.44 178.27 2dbc h GLU 110 N 0.06 0.15 -0.67 1.25 4.39 -2.00 -3.19 114.58 114.58 2dbc h GLU 110 Ca 0.01 -0.26 0.14 0.00 0.34 0.00 0.00 59.36 59.59 2dbc h GLU 110 Cb 0.60 0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 29.24 2dbc h GLU 110 CO 0.04 1.12 0.05 0.93 -1.16 0.00 0.00 179.01 180.00 2dbc h GLU 111 N -0.67 0.15 -0.61 2.33 4.39 -1.92 0.15 114.58 118.40 2dbc h GLU 111 Ca -0.10 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.56 2dbc h GLU 111 Cb 1.35 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.94 2dbc h GLU 111 CO 0.07 0.10 0.25 1.25 -1.16 0.00 0.00 179.01 179.52 2dbc h LEU 112 N 0.16 0.80 -1.02 1.33 5.85 -1.63 -2.44 115.31 118.36 2dbc h LEU 112 Ca 0.36 -0.10 0.14 0.00 0.84 0.00 0.00 57.88 59.11 2dbc h LEU 112 Cb 0.60 -0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.33 2dbc h LEU 112 CO -0.54 0.71 0.63 -0.08 -0.34 0.00 0.00 178.44 178.82 2dbc h GLU 113 N 0.87 0.91 0.23 1.25 4.81 -0.69 -2.47 114.58 119.49 2dbc h GLU 113 Ca 0.21 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2dbc h GLU 113 Cb 0.16 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.33 2dbc h GLU 113 CO -0.02 0.60 -0.11 2.35 -0.73 0.00 0.00 179.01 181.10 2dbc h TRP 114 N 0.94 -0.28 -0.95 0.92 7.01 -1.13 -2.65 115.95 119.81 2dbc h TRP 114 Ca 0.51 -0.01 0.20 0.00 2.11 0.00 0.00 58.89 61.70 2dbc h TRP 114 Cb 0.58 0.09 -0.18 0.00 -2.10 0.00 0.00 29.16 27.56 2dbc h TRP 114 CO -0.00 0.09 -0.21 1.63 -2.79 0.00 0.00 178.44 177.16 2dbc n LYS 115 N -5.04 -0.08 0.15 2.65 5.02 -0.96 0.23 118.16 120.13 2dbc n LYS 115 Ca -0.09 1.47 0.00 0.00 -2.02 0.00 0.00 58.31 57.67 2dbc n LYS 115 Cb 0.26 -2.21 0.28 0.00 -0.02 0.00 0.00 35.03 33.34 2dbc n LYS 115 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2dbc h LEU 116 N 0.00 0.08 0.38 -0.35 3.38 -1.52 -3.20 115.31 114.08 2dbc h LEU 116 Ca 0.47 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.39 2dbc h LEU 116 Cb 0.75 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2dbc h LEU 116 CO -0.96 0.50 -0.18 -1.28 0.09 0.00 0.00 178.44 176.61 2dbc h SER 117 N 0.06 -0.43 -0.92 -0.43 0.87 0.33 -1.30 113.55 111.73 2dbc h SER 117 Ca 0.00 0.01 0.27 0.00 -1.23 0.00 0.00 61.79 60.85 2dbc h SER 117 Cb 0.79 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.83 2dbc h SER 117 CO 0.06 -0.02 1.11 1.05 -0.53 0.00 0.00 176.83 178.49 2dbc h GLU 118 N -1.08 0.00 0.14 2.24 4.11 -0.26 1.81 114.58 121.54 2dbc h GLU 118 Ca -0.05 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.07 2dbc h GLU 118 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2dbc h GLU 118 CO 0.09 0.00 -1.50 0.28 0.07 0.00 0.00 179.01 177.94 2dbc h VAL 119 N 0.00 1.20 0.00 -1.06 2.07 -1.54 -3.40 116.25 113.52 2dbc h VAL 119 Ca 0.44 -2.80 0.00 0.00 0.82 0.00 0.00 66.70 65.16 2dbc h VAL 119 Cb 2.64 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 35.23 2dbc h VAL 119 CO -0.00 0.83 0.00 0.61 0.02 0.00 0.00 177.57 179.03 2dbc n GLY 120 N 1.67 0.93 0.28 2.17 0.00 0.62 -4.57 105.19 106.29 2dbc n GLY 120 Ca -0.16 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 2dbc n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dbc h ALA 121 N 0.00 1.00 -2.93 4.61 0.00 -1.39 -3.47 119.26 117.09 2dbc h ALA 121 Ca 0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 54.91 54.27 2dbc h ALA 121 Cb 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 17.79 17.51 2dbc h ALA 121 CO 0.00 0.60 -0.28 0.96 0.00 0.00 0.00 179.25 180.53 2dbc s ILE 122 N -4.89 0.00 -0.34 0.00 -4.36 -1.21 -4.82 121.20 105.58 2dbc s ILE 122 Ca -0.10 -1.72 0.04 0.00 -0.26 0.00 0.00 60.65 58.61 2dbc s ILE 122 Cb 0.14 -2.61 0.10 0.00 1.25 0.00 0.00 42.46 41.33 2dbc s ILE 122 CO 0.82 0.00 0.04 -1.10 0.24 0.00 0.00 174.94 174.95 2dbc s GLN 123 N -3.13 1.58 0.27 0.37 -1.52 -1.26 -4.20 119.66 111.77 2dbc s GLN 123 Ca 0.34 -1.83 -0.00 0.00 -1.95 0.00 0.00 55.36 51.92 2dbc s GLN 123 Cb 0.00 -3.20 -0.04 0.00 -0.22 0.00 0.00 33.01 29.55 2dbc s GLN 123 CO 0.23 -0.91 0.47 -1.54 -0.25 0.00 0.00 175.29 173.28 2dbc s SER 124 N 0.97 6.35 -0.01 5.90 1.04 -1.26 -5.03 113.70 121.67 2dbc s SER 124 Ca 0.09 0.42 -0.20 0.00 0.48 0.00 0.00 55.95 56.75 2dbc s SER 124 Cb -0.19 -2.02 -0.28 0.00 0.10 0.00 0.00 66.02 63.63 2dbc s SER 124 CO -0.07 -0.16 1.01 0.44 0.98 0.00 0.00 173.24 175.44 2dbc h ASP 125 N 1.42 0.59 -1.00 7.02 5.19 -1.99 -3.46 116.42 124.19 2dbc h ASP 125 Ca -0.49 -0.86 -0.80 0.00 -0.62 0.00 0.00 57.03 54.26 2dbc h ASP 125 Cb 1.21 -0.19 0.04 0.00 0.18 0.00 0.00 39.33 40.57 2dbc h ASP 125 CO 0.65 1.39 0.14 0.18 -3.12 0.00 0.00 179.24 178.48 2dbc n LEU 126 N -4.07 0.15 -3.79 1.55 4.77 -1.26 -4.72 117.00 109.63 2dbc n LEU 126 Ca -0.13 1.16 -0.40 0.00 -0.03 0.00 0.00 56.01 56.61 2dbc n LEU 126 Cb 0.82 -0.91 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 2dbc n LEU 126 CO 0.50 -1.77 -0.11 -1.84 -1.33 0.00 0.00 177.39 172.85 2dbc n GLU 127 N 1.82 0.00 -3.87 3.23 -0.00 -1.26 -4.92 120.64 115.64 2dbc n GLU 127 Ca 0.21 0.00 -0.36 0.00 -0.00 0.00 0.00 57.16 57.02 2dbc n GLU 127 Cb 0.06 -0.87 -0.13 0.00 -0.00 0.00 0.00 31.44 30.50 2dbc n GLU 127 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2dbc s GLU 128 N -0.87 2.79 -0.06 3.44 2.02 -1.26 -5.00 118.70 119.76 2dbc s GLU 128 Ca 0.54 -1.03 -0.12 0.00 0.02 0.00 0.00 54.97 54.39 2dbc s GLU 128 Cb -0.74 -3.19 -0.08 0.00 0.10 0.00 0.00 34.13 30.23 2dbc s GLU 128 CO 0.50 -0.49 0.47 -0.97 0.02 0.00 0.00 175.26 174.79 2dbc h ASN 129 N 8.09 -0.25 0.33 -0.19 -1.24 -2.00 -3.29 115.58 117.03 2dbc h ASN 129 Ca -0.29 -0.09 -0.02 0.00 0.71 0.00 0.00 56.30 56.61 2dbc h ASN 129 Cb 1.10 0.06 -0.00 0.00 0.73 0.00 0.00 38.32 40.21 2dbc h ASN 129 CO 0.58 0.25 -0.11 0.77 -1.29 0.00 0.00 177.43 177.62 2dbc h SER 130 N -1.05 0.00 -3.72 1.15 4.64 -1.94 -3.48 113.55 109.15 2dbc h SER 130 Ca -0.03 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.35 2dbc h SER 130 Cb 0.32 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2dbc h SER 130 CO 0.05 0.11 -0.08 0.61 -0.87 0.00 0.00 176.83 176.65 2dbc n GLY 131 N -0.76 -2.10 3.68 -0.77 0.00 -1.24 -4.80 105.19 99.19 2dbc n GLY 131 Ca -0.02 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 2dbc n GLY 131 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dbc s PRO 132 N -0.94 4.25 -0.05 1.61 0.04 -1.26 -4.81 135.00 133.84 2dbc s PRO 132 Ca 0.00 2.02 -0.07 0.00 0.04 0.00 0.00 61.00 62.99 2dbc s PRO 132 Cb 0.00 -3.67 -0.04 0.00 0.04 0.00 0.00 34.50 30.84 2dbc s PRO 132 CO 0.00 -0.65 0.33 1.03 0.04 0.00 0.00 177.00 177.75 2dbc h SER 133 N 8.22 -0.20 -2.62 6.66 0.87 -1.80 -3.43 113.55 121.24 2dbc h SER 133 Ca -0.38 0.01 -0.55 0.00 -1.23 0.00 0.00 61.79 59.64 2dbc h SER 133 Cb 1.17 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.17 2dbc h SER 133 CO 0.92 0.14 1.12 -0.94 -0.53 0.00 0.00 176.83 177.55 2dbc s SER 134 N -4.57 6.51 0.00 6.23 1.04 -1.26 -5.15 113.70 116.50 2dbc s SER 134 Ca -0.03 2.04 0.00 0.00 0.48 0.00 0.00 55.95 58.43 2dbc s SER 134 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 2dbc s SER 134 CO 0.10 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.85