#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 0.23 -0.11 1.61 7.64 -1.26 -4.85 113.62 116.87 2dbc n SER 2 Ca 0.00 0.12 -0.05 0.00 1.01 0.00 0.00 58.87 59.95 2dbc n SER 2 Cb 0.00 -0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 2dbc n SER 2 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dbc h SER 3 N 0.00 -0.33 -2.83 6.43 0.87 -2.10 -3.43 113.55 112.15 2dbc h SER 3 Ca 0.00 0.11 -0.27 0.00 -1.23 0.00 0.00 61.79 60.40 2dbc h SER 3 Cb 0.33 0.23 0.13 0.00 -0.44 0.00 0.00 62.40 62.65 2dbc h SER 3 CO 0.00 -0.12 0.11 0.61 -0.53 0.00 0.00 176.83 176.90 2dbc n GLY 4 N -1.29 -2.51 3.79 5.77 0.00 -1.26 -5.02 105.19 104.67 2dbc n GLY 4 Ca 0.02 -1.51 -0.38 0.00 0.00 0.00 0.00 46.02 44.15 2dbc n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dbc s SER 5 N -3.62 6.71 -0.10 1.61 0.01 -1.26 -5.05 113.70 112.00 2dbc s SER 5 Ca 0.49 0.84 0.03 0.00 1.31 0.00 0.00 55.95 58.62 2dbc s SER 5 Cb -0.04 -2.25 -0.01 0.00 0.21 0.00 0.00 66.02 63.93 2dbc s SER 5 CO 0.37 0.20 -0.21 -0.44 0.41 0.00 0.00 173.24 173.57 2dbc s SER 6 N -0.36 3.37 1.10 2.44 0.01 -1.26 -5.07 113.70 113.92 2dbc s SER 6 Ca 0.23 -0.48 -0.17 0.00 1.31 0.00 0.00 55.95 56.84 2dbc s SER 6 Cb -0.16 -1.36 0.14 0.00 0.21 0.00 0.00 66.02 64.86 2dbc s SER 6 CO 0.11 0.18 0.14 0.61 0.41 0.00 0.00 173.24 174.69 2dbc n GLY 7 N 3.39 -2.60 0.88 3.44 0.00 -1.26 -4.89 105.19 104.15 2dbc n GLY 7 Ca -0.18 -0.84 -0.03 0.00 0.00 0.00 0.00 46.02 44.97 2dbc n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dbc n LYS 8 N -2.07 0.09 0.00 1.61 5.02 -1.24 -4.95 118.16 116.62 2dbc n LYS 8 Ca 0.03 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2dbc n LYS 8 Cb 0.51 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 34.87 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 -3.48 0.00 -2.00 2.13 3.72 -1.26 -5.07 117.46 111.50 2dbc n PHE 9 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2dbc n PHE 9 Cb 0.27 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 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 2.76 0.79 3.63 1.37 0.00 -1.26 -5.07 105.19 107.41 2dbc n GLY 10 Ca 0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.94 0.23 -0.19 1.61 -1.05 -1.24 -4.64 118.70 109.48 2dbc s GLU 11 Ca 0.00 0.18 -0.29 0.00 -0.15 0.00 0.00 54.97 54.71 2dbc s GLU 11 Cb 0.00 0.11 0.00 0.00 -0.44 0.00 0.00 34.13 33.80 2dbc s GLU 11 CO 0.00 -0.05 1.03 -1.17 0.95 0.00 0.00 175.26 176.02 2dbc s LEU 12 N -0.34 4.15 0.00 1.83 2.96 -1.26 -4.80 118.68 121.21 2dbc s LEU 12 Ca 0.06 1.43 0.03 0.00 -0.22 0.00 0.00 54.13 55.42 2dbc s LEU 12 Cb -0.03 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.14 2dbc s LEU 12 CO -0.09 -0.60 0.26 0.54 -1.32 0.00 0.00 176.35 175.13 2dbc n ARG 13 N 5.91 0.96 -3.62 1.98 1.74 -1.23 -5.02 116.66 117.37 2dbc n ARG 13 Ca 0.11 -2.34 -0.20 0.00 -0.77 0.00 0.00 57.85 54.66 2dbc n ARG 13 Cb 0.47 0.28 -0.16 0.00 -1.02 0.00 0.00 32.46 32.03 2dbc n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2dbc s GLU 14 N -3.50 0.05 0.36 5.56 2.12 -1.26 -1.93 118.70 120.09 2dbc s GLU 14 Ca 0.20 0.32 0.08 0.00 0.36 0.00 0.00 54.97 55.92 2dbc s GLU 14 Cb -0.02 -0.85 -0.03 0.00 0.26 0.00 0.00 34.13 33.49 2dbc s GLU 14 CO 0.12 -0.46 0.25 0.96 -0.54 0.00 0.00 175.26 175.59 2dbc s ILE 15 N 2.24 3.04 0.37 -3.70 -4.36 -1.20 -4.96 121.20 112.63 2dbc s ILE 15 Ca 0.04 -1.51 0.04 0.00 -0.26 0.00 0.00 60.65 58.96 2dbc s ILE 15 Cb -0.14 -3.05 -0.01 0.00 1.25 0.00 0.00 42.46 40.51 2dbc s ILE 15 CO -0.07 -0.12 0.53 -0.44 0.24 0.00 0.00 174.94 175.07 2dbc s SER 16 N -3.96 5.95 0.50 4.36 0.01 -1.26 -4.51 113.70 114.79 2dbc s SER 16 Ca 0.41 -0.01 0.17 0.00 1.31 0.00 0.00 55.95 57.83 2dbc s SER 16 Cb -0.03 -1.38 1.22 0.00 0.21 0.00 0.00 66.02 66.05 2dbc s SER 16 CO 0.25 -0.49 2.10 1.23 0.41 0.00 0.00 173.24 176.73 2dbc h GLY 17 N 0.75 0.12 1.06 3.44 0.00 -1.91 0.48 103.07 107.00 2dbc h GLY 17 Ca -0.46 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 2dbc h GLY 17 CO 0.55 0.03 -0.00 3.43 0.00 0.00 0.00 176.54 180.55 2dbc h ASN 18 N 0.10 0.99 0.07 0.19 4.21 -1.96 -2.62 115.58 116.57 2dbc h ASN 18 Ca 0.09 -0.31 0.00 0.00 1.21 0.00 0.00 56.30 57.29 2dbc h ASN 18 Cb 0.23 -0.27 0.00 0.00 -1.12 0.00 0.00 38.32 37.16 2dbc h ASN 18 CO -0.01 1.06 -0.08 0.00 -1.29 0.00 0.00 177.43 177.10 2dbc n GLN 19 N -4.23 1.39 0.12 0.81 10.64 -0.70 -4.26 117.38 121.14 2dbc n GLN 19 Ca 0.02 -0.80 -0.13 0.00 -1.83 0.00 0.00 57.00 54.27 2dbc n GLN 19 Cb 0.34 -1.48 -0.06 0.00 -0.86 0.00 0.00 30.24 28.18 2dbc n GLN 19 CO 0.00 0.00 0.00 -0.92 -1.83 0.00 0.00 177.06 174.31 2dbc h TYR 20 N 1.95 -0.71 0.71 2.61 5.03 -0.53 -0.43 116.97 125.60 2dbc h TYR 20 Ca 0.00 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.29 2dbc h TYR 20 Cb 0.50 0.30 0.01 0.00 1.55 0.00 0.00 36.73 39.08 2dbc h TYR 20 CO 0.00 -0.37 -0.34 0.28 -1.32 0.00 0.00 178.16 176.41 2dbc h VAL 21 N -0.48 0.03 -0.26 1.81 2.07 -1.74 0.80 116.25 118.48 2dbc h VAL 21 Ca 0.03 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.33 2dbc h VAL 21 Cb 0.50 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2dbc h VAL 21 CO -0.15 0.00 0.70 0.78 0.02 0.00 0.00 177.57 178.93 2dbc h ASN 22 N -1.24 0.00 0.00 0.57 2.35 -1.76 0.25 115.58 115.76 2dbc h ASN 22 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2dbc h ASN 22 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2dbc h ASN 22 CO 0.16 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.32 2dbc n GLU 23 N -3.00 0.00 0.00 0.81 -0.58 -0.17 -4.43 120.64 113.26 2dbc n GLU 23 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 2dbc n GLU 23 Cb 0.80 -0.23 0.00 0.00 -0.57 0.00 0.00 31.44 31.45 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 -1.97 0.00 -0.09 2.62 0.31 0.28 -0.32 118.33 119.15 2dbc n VAL 24 Ca 0.00 1.39 -0.02 0.00 -0.01 0.00 0.00 64.34 65.69 2dbc n VAL 24 Cb 0.00 -2.39 -0.02 0.00 -0.91 0.00 0.00 33.84 30.52 2dbc n VAL 24 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2dbc n THR 25 N -1.69 -0.15 0.14 2.52 -1.04 -0.61 0.78 114.28 114.23 2dbc n THR 25 Ca 0.00 1.66 -0.05 0.00 -2.04 0.00 0.00 64.05 63.62 2dbc n THR 25 Cb 0.00 -2.16 0.02 0.00 -1.82 0.00 0.00 70.33 66.37 2dbc n THR 25 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2dbc n ASN 26 N -3.47 4.12 -4.75 8.00 3.02 0.79 -3.84 115.26 119.13 2dbc n ASN 26 Ca 0.00 -2.42 -0.35 0.00 -0.03 0.00 0.00 54.58 51.78 2dbc n ASN 26 Cb 0.06 -0.76 0.05 0.00 -0.61 0.00 0.00 39.78 38.51 2dbc n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dbc s ALA 27 N -0.60 2.46 0.96 5.41 0.00 0.23 -4.75 121.76 125.48 2dbc s ALA 27 Ca 0.10 0.95 -0.16 0.00 0.00 0.00 0.00 51.96 52.85 2dbc s ALA 27 Cb 0.08 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.64 2dbc s ALA 27 CO 0.01 -1.30 -0.58 -1.91 0.00 0.00 0.00 175.76 171.98 2dbc n GLU 28 N -1.86 -0.03 0.00 0.00 4.07 -1.26 -4.75 120.64 116.81 2dbc n GLU 28 Ca 0.13 -0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 2dbc n GLU 28 Cb 0.50 -1.13 0.00 0.00 -0.06 0.00 0.00 31.44 30.75 2dbc n GLU 28 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2dbc n LYS 29 N 1.82 0.00 -0.93 5.31 4.81 -1.26 -3.48 118.16 124.43 2dbc n LYS 29 Ca -0.00 0.22 -0.10 0.00 -0.87 0.00 0.00 58.31 57.55 2dbc n LYS 29 Cb 0.55 -1.13 -0.15 0.00 0.02 0.00 0.00 35.03 34.32 2dbc n LYS 29 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2dbc n ASP 30 N -1.16 5.16 -4.06 3.14 5.75 -1.26 -4.31 116.55 119.81 2dbc n ASP 30 Ca 0.00 -2.45 -0.22 0.00 -0.01 0.00 0.00 54.79 52.11 2dbc n ASP 30 Cb 0.00 -1.36 -0.15 0.00 -1.03 0.00 0.00 41.12 38.57 2dbc n ASP 30 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2dbc s LEU 31 N 0.00 1.89 -0.41 -2.12 2.96 -1.23 -5.10 118.68 114.67 2dbc s LEU 31 Ca 0.58 -0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 54.14 2dbc s LEU 31 Cb 0.28 -0.68 0.05 0.00 0.50 0.00 0.00 46.19 46.33 2dbc s LEU 31 CO 0.00 0.11 0.27 0.26 -1.32 0.00 0.00 176.35 175.67 2dbc s TRP 32 N 0.01 3.27 -0.46 5.38 0.52 -1.26 -4.27 118.94 122.14 2dbc s TRP 32 Ca -0.01 -1.05 -0.13 0.00 0.02 0.00 0.00 56.10 54.93 2dbc s TRP 32 Cb -0.08 -2.71 0.08 0.00 -1.15 0.00 0.00 33.47 29.60 2dbc s TRP 32 CO 0.01 -0.72 0.35 0.08 0.02 0.00 0.00 176.95 176.69 2dbc s VAL 33 N 1.56 4.85 -0.48 4.03 1.01 0.12 0.12 120.40 131.61 2dbc s VAL 33 Ca 0.03 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 60.66 2dbc s VAL 33 Cb -0.21 -3.94 0.10 0.00 0.00 0.00 0.00 36.38 32.34 2dbc s VAL 33 CO 0.06 -0.57 0.37 -0.69 0.00 0.00 0.00 175.10 174.27 2dbc s VAL 34 N 1.55 4.65 0.22 2.92 1.01 -0.94 -0.60 120.40 129.22 2dbc s VAL 34 Ca 0.04 -1.50 -0.05 0.00 0.00 0.00 0.00 61.98 60.47 2dbc s VAL 34 Cb -0.24 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 2dbc s VAL 34 CO 0.05 -0.70 0.47 -0.51 0.00 0.00 0.00 175.10 174.40 2dbc s ILE 35 N 1.49 5.09 -0.14 2.22 2.07 -0.12 -3.49 121.20 128.32 2dbc s ILE 35 Ca 0.04 0.01 -0.04 0.00 -1.41 0.00 0.00 60.65 59.25 2dbc s ILE 35 Cb -0.26 -3.69 0.05 0.00 0.13 0.00 0.00 42.46 38.70 2dbc s ILE 35 CO 0.02 -0.15 0.09 -2.28 -1.91 0.00 0.00 174.94 170.70 2dbc s HIS 36 N -1.88 0.15 -1.12 3.50 5.65 -1.18 -1.20 115.29 119.21 2dbc s HIS 36 Ca 0.42 -0.17 -0.21 0.00 0.25 0.00 0.00 55.06 55.35 2dbc s HIS 36 Cb -0.11 -0.64 0.05 0.00 -1.18 0.00 0.00 32.58 30.70 2dbc s HIS 36 CO 0.27 -0.44 1.57 -0.51 -0.65 0.00 0.00 174.74 174.98 2dbc s LEU 37 N 2.15 3.61 0.44 8.88 1.43 -0.29 -3.45 118.68 131.45 2dbc s LEU 37 Ca 0.03 -1.79 -0.20 0.00 -1.03 0.00 0.00 54.13 51.14 2dbc s LEU 37 Cb -0.15 -2.57 -0.10 0.00 0.03 0.00 0.00 46.19 43.39 2dbc s LEU 37 CO -0.08 -1.44 0.96 -0.72 0.23 0.00 0.00 176.35 175.31 2dbc s TYR 38 N 4.91 3.30 -0.12 0.29 -0.85 -1.26 -4.19 117.35 119.43 2dbc s TYR 38 Ca 0.50 1.59 -0.04 0.00 -0.52 0.00 0.00 57.07 58.59 2dbc s TYR 38 Cb 0.01 -2.86 0.06 0.00 0.38 0.00 0.00 41.96 39.55 2dbc s TYR 38 CO -0.03 -0.20 0.24 0.50 -1.52 0.00 0.00 175.55 174.53 2dbc s ARG 39 N -3.29 0.13 0.65 -3.49 3.52 -1.26 -4.20 118.95 111.01 2dbc s ARG 39 Ca 0.62 0.68 0.23 0.00 -0.13 0.00 0.00 55.73 57.14 2dbc s ARG 39 Cb -0.10 -0.09 1.22 0.00 -1.56 0.00 0.00 34.95 34.42 2dbc s ARG 39 CO 0.16 -0.27 1.68 0.66 -0.81 0.00 0.00 175.30 176.72 2dbc h SER 40 N 8.16 0.00 0.00 -2.12 4.64 -2.01 0.87 113.55 123.09 2dbc h SER 40 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2dbc h SER 40 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2dbc h SER 40 CO 0.17 0.00 0.00 -0.24 -0.87 0.00 0.00 176.83 175.89 2dbc n SER 41 N -2.98 0.00 -3.84 4.97 2.88 -1.26 -4.64 113.62 108.74 2dbc n SER 41 Ca 0.02 -1.86 -0.24 0.00 -1.33 0.00 0.00 58.87 55.46 2dbc n SER 41 Cb 0.64 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.92 2dbc n SER 41 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2dbc s VAL 42 N -2.00 0.65 0.32 2.46 1.01 0.30 -5.02 120.40 118.11 2dbc s VAL 42 Ca 0.00 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.02 2dbc s VAL 42 Cb 0.00 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.68 2dbc s VAL 42 CO 0.00 0.30 1.71 1.55 0.00 0.00 0.00 175.10 178.66 2dbc h PRO 43 N 8.08 0.05 0.09 2.72 0.13 -1.83 -3.22 132.00 138.02 2dbc h PRO 43 Ca -0.26 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2dbc h PRO 43 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2dbc h PRO 43 CO 0.34 0.52 -0.04 1.98 -0.23 0.00 0.00 178.00 180.57 2dbc h MET 44 N 0.04 -0.12 -1.30 0.86 4.05 -1.95 -2.87 114.93 113.63 2dbc h MET 44 Ca -0.00 0.01 0.42 0.00 -0.28 0.00 0.00 59.70 59.85 2dbc h MET 44 Cb 0.87 0.03 -0.13 0.00 -0.80 0.00 0.00 31.60 31.57 2dbc h MET 44 CO 0.06 0.13 0.84 0.00 0.23 0.00 0.00 176.91 178.17 2dbc h LEU 46 N 0.10 -0.95 -1.38 0.00 3.38 -1.62 0.12 115.31 114.96 2dbc h LEU 46 Ca 0.80 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.91 2dbc h LEU 46 Cb 2.51 0.36 -0.04 0.00 0.09 0.00 0.00 40.66 43.58 2dbc h LEU 46 CO -0.41 -0.29 0.44 1.62 0.09 0.00 0.00 178.44 179.89 2dbc h VAL 47 N -0.37 1.12 -0.42 1.22 3.04 -1.27 -2.32 116.25 117.24 2dbc h VAL 47 Ca 0.01 -0.28 0.04 0.00 -1.01 0.00 0.00 66.70 65.45 2dbc h VAL 47 Cb 0.40 0.22 -0.04 0.00 -2.01 0.00 0.00 31.29 29.87 2dbc h VAL 47 CO -0.21 0.15 0.20 0.58 -1.01 0.00 0.00 177.57 177.28 2dbc h VAL 48 N 0.82 0.95 -0.51 1.51 2.07 -0.75 -2.09 116.25 118.25 2dbc h VAL 48 Ca 0.26 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2dbc h VAL 48 Cb 0.02 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2dbc h VAL 48 CO -0.07 0.07 0.23 -1.13 0.02 0.00 0.00 177.57 176.70 2dbc h ASN 49 N 0.41 0.69 -0.18 0.57 -0.73 -0.27 -1.29 115.58 114.78 2dbc h ASN 49 Ca 0.18 -0.15 0.05 0.00 1.87 0.00 0.00 56.30 58.26 2dbc h ASN 49 Cb 0.10 -0.18 -0.06 0.00 0.27 0.00 0.00 38.32 38.46 2dbc h ASN 49 CO -0.14 0.65 -0.17 1.56 -0.37 0.00 0.00 177.43 178.96 2dbc h GLN 50 N 0.69 -0.18 -0.43 6.67 1.08 -1.07 -1.44 115.11 120.42 2dbc h GLN 50 Ca 0.17 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 2dbc h GLN 50 Cb 0.15 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 2dbc h GLN 50 CO -0.02 -0.12 0.24 0.45 -0.95 0.00 0.00 178.83 178.43 2dbc h HIS 51 N -0.19 0.59 -0.96 2.96 3.86 -1.27 -2.45 115.15 117.69 2dbc h HIS 51 Ca 0.11 -0.01 0.24 0.00 -1.16 0.00 0.00 60.37 59.56 2dbc h HIS 51 Cb 0.36 -0.19 -0.13 0.00 1.06 0.00 0.00 27.41 28.51 2dbc h HIS 51 CO -0.31 0.44 0.50 -0.07 0.86 0.00 0.00 177.93 179.35 2dbc h LEU 52 N 0.56 0.50 0.31 2.43 3.38 -0.43 0.71 115.31 122.78 2dbc h LEU 52 Ca 0.15 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2dbc h LEU 52 Cb 0.04 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2dbc h LEU 52 CO -0.03 0.03 -0.41 -1.28 0.09 0.00 0.00 178.44 176.84 2dbc h SER 53 N 0.47 -1.15 -0.67 -0.43 0.87 -0.79 0.18 113.55 112.03 2dbc h SER 53 Ca 0.62 0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 61.27 2dbc h SER 53 Cb 1.21 0.40 -0.03 0.00 -0.44 0.00 0.00 62.40 63.55 2dbc h SER 53 CO -0.52 -0.53 0.36 0.58 -0.53 0.00 0.00 176.83 176.19 2dbc h VAL 54 N -0.77 1.21 0.00 2.23 2.07 -1.25 -1.44 116.25 118.30 2dbc h VAL 54 Ca -0.02 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2dbc h VAL 54 Cb 0.72 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2dbc h VAL 54 CO -0.13 0.23 0.00 -0.07 0.02 0.00 0.00 177.57 177.63 2dbc h LEU 55 N 0.92 0.00 0.06 2.57 3.38 -0.57 0.44 115.31 122.11 2dbc h LEU 55 Ca 0.24 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.95 2dbc h LEU 55 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2dbc h LEU 55 CO -0.04 0.00 -1.16 0.00 0.09 0.00 0.00 178.44 177.33 2dbc h ALA 56 N 2.04 0.17 0.00 1.53 0.00 0.47 -2.56 119.26 120.91 2dbc h ALA 56 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2dbc h ALA 56 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2dbc h ALA 56 CO 0.00 0.99 -1.00 2.89 0.00 0.00 0.00 179.25 182.13 2dbc n ARG 57 N -3.53 0.44 -0.00 0.00 1.85 -0.78 -3.70 116.66 110.93 2dbc n ARG 57 Ca -0.07 0.05 -0.19 0.00 -1.00 0.00 0.00 57.85 56.64 2dbc n ARG 57 Cb 0.98 -1.70 -0.14 0.00 -1.05 0.00 0.00 32.46 30.56 2dbc n ARG 57 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 177.63 177.40 2dbc h LYS 58 N 0.00 0.19 -3.38 2.89 3.64 -1.01 -3.42 116.57 115.49 2dbc h LYS 58 Ca 0.00 -0.32 -0.65 0.00 -1.27 0.00 0.00 60.65 58.40 2dbc h LYS 58 Cb 0.86 0.12 -0.40 0.00 -0.41 0.00 0.00 32.23 32.40 2dbc h LYS 58 CO 0.00 1.16 -0.54 -0.06 -2.27 0.00 0.00 179.45 177.74 2dbc s PHE 59 N -2.39 3.31 0.22 1.91 0.08 -0.97 -4.92 117.98 115.22 2dbc s PHE 59 Ca -0.18 -3.09 0.24 0.00 0.12 0.00 0.00 56.93 54.01 2dbc s PHE 59 Cb 0.02 -2.91 1.01 0.00 -0.57 0.00 0.00 43.02 40.57 2dbc s PHE 59 CO 0.76 -0.74 1.87 -1.00 -0.10 0.00 0.00 175.22 176.01 2dbc h PRO 60 N 6.44 0.00 0.00 0.24 0.13 -1.82 -2.91 132.00 134.09 2dbc h PRO 60 Ca -0.03 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2dbc h PRO 60 Cb 0.88 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 2dbc h PRO 60 CO 0.71 0.23 -0.02 0.93 -0.23 0.00 0.00 178.00 179.61 2dbc h GLU 61 N 0.00 0.00 -5.70 0.86 5.08 -1.91 -3.28 114.58 109.63 2dbc h GLU 61 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2dbc h GLU 61 Cb 0.66 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.83 2dbc h GLU 61 CO 0.03 0.02 -0.18 0.99 -1.00 0.00 0.00 179.01 178.87 2dbc s THR 62 N -4.88 5.20 -0.61 1.13 2.01 -1.10 -4.18 115.64 113.21 2dbc s THR 62 Ca -0.05 0.87 -0.21 0.00 0.31 0.00 0.00 61.69 62.61 2dbc s THR 62 Cb 0.16 -3.78 0.08 0.00 0.01 0.00 0.00 72.50 68.97 2dbc s THR 62 CO 0.64 0.35 0.85 -0.75 -0.69 0.00 0.00 174.62 175.01 2dbc s LYS 63 N 0.51 3.12 -0.08 4.92 2.20 0.12 -4.90 119.74 125.62 2dbc s LYS 63 Ca 0.24 -0.92 -0.16 0.00 -0.36 0.00 0.00 55.97 54.78 2dbc s LYS 63 Cb -0.15 -4.20 -0.05 0.00 -1.51 0.00 0.00 37.83 31.92 2dbc s LYS 63 CO 0.09 -1.63 0.41 -0.06 -0.36 0.00 0.00 175.35 173.80 2dbc s PHE 64 N 3.48 3.59 -0.11 4.03 0.08 -1.26 -2.21 117.98 125.59 2dbc s PHE 64 Ca 0.19 0.87 -0.05 0.00 0.12 0.00 0.00 56.93 58.05 2dbc s PHE 64 Cb -0.19 -2.39 0.05 0.00 -0.57 0.00 0.00 43.02 39.92 2dbc s PHE 64 CO 0.10 0.39 0.25 0.14 -0.10 0.00 0.00 175.22 176.00 2dbc s VAL 65 N -0.13 -0.04 -0.20 -0.44 -7.23 -1.23 -3.56 120.40 107.57 2dbc s VAL 65 Ca 0.23 0.15 -0.11 0.00 -1.81 0.00 0.00 61.98 60.43 2dbc s VAL 65 Cb -0.15 -0.39 -0.05 0.00 0.56 0.00 0.00 36.38 36.35 2dbc s VAL 65 CO 0.10 0.06 0.19 -1.59 -0.31 0.00 0.00 175.10 173.55 2dbc s LYS 66 N 1.28 4.18 -0.06 4.82 -2.85 -0.81 -3.09 119.74 123.21 2dbc s LYS 66 Ca -0.09 -0.14 -0.02 0.00 -1.00 0.00 0.00 55.97 54.72 2dbc s LYS 66 Cb -0.10 -3.45 0.04 0.00 -2.06 0.00 0.00 37.83 32.25 2dbc s LYS 66 CO -0.09 0.22 0.10 0.00 0.10 0.00 0.00 175.35 175.69 2dbc s ALA 67 N 0.57 0.01 0.57 0.59 0.00 -1.22 -3.26 121.76 119.01 2dbc s ALA 67 Ca 0.10 0.40 -0.20 0.00 0.00 0.00 0.00 51.96 52.27 2dbc s ALA 67 Cb -0.12 -0.64 -0.06 0.00 0.00 0.00 0.00 23.12 22.31 2dbc s ALA 67 CO 0.01 -0.44 1.02 -0.89 0.00 0.00 0.00 175.76 175.46 2dbc n ILE 68 N 5.07 3.55 -0.74 0.00 5.41 -1.26 -4.10 119.36 127.28 2dbc n ILE 68 Ca -0.09 -0.50 -0.06 0.00 1.00 0.00 0.00 62.75 63.10 2dbc n ILE 68 Cb 0.50 -1.21 -0.08 0.00 -0.71 0.00 0.00 39.64 38.14 2dbc n ILE 68 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 2dbc n VAL 69 N -1.49 2.48 -3.57 1.39 3.14 -1.26 -4.81 118.33 114.22 2dbc n VAL 69 Ca 0.13 -0.98 -0.39 0.00 -2.96 0.00 0.00 64.34 60.14 2dbc n VAL 69 Cb 0.46 -1.74 -0.11 0.00 -1.06 0.00 0.00 33.84 31.39 2dbc n VAL 69 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2dbc s ASN 70 N 2.00 6.03 -1.70 6.55 2.47 -1.26 -4.32 114.94 124.70 2dbc s ASN 70 Ca 0.32 -0.19 -0.01 0.00 0.42 0.00 0.00 52.86 53.40 2dbc s ASN 70 Cb 0.15 -2.13 0.00 0.00 -1.45 0.00 0.00 41.25 37.83 2dbc s ASN 70 CO -0.00 -0.13 0.12 -1.20 -3.72 0.00 0.00 177.10 172.17 2dbc n SER 71 N 5.08 -5.83 -0.02 -4.21 7.64 -1.26 -4.85 113.62 110.16 2dbc n SER 71 Ca -0.13 -0.06 -0.06 0.00 1.01 0.00 0.00 58.87 59.63 2dbc n SER 71 Cb 0.51 -4.83 -0.02 0.00 -1.01 0.00 0.00 64.21 58.86 2dbc n SER 71 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dbc s ILE 73 N -2.20 2.08 -0.18 0.00 -5.25 -1.26 -5.02 121.20 109.37 2dbc s ILE 73 Ca -0.10 0.02 -0.22 0.00 -0.99 0.00 0.00 60.65 59.37 2dbc s ILE 73 Cb 0.03 -2.71 -0.22 0.00 2.95 0.00 0.00 42.46 42.51 2dbc s ILE 73 CO 0.13 -0.03 0.38 -0.08 -1.79 0.00 0.00 174.94 173.55 2dbc h GLU 74 N -1.58 0.04 -1.05 0.37 4.81 -1.98 -3.47 114.58 111.71 2dbc h GLU 74 Ca -0.51 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 58.70 2dbc h GLU 74 Cb 1.33 0.03 -0.22 0.00 0.63 0.00 0.00 28.75 30.52 2dbc h GLU 74 CO 0.61 1.03 -0.32 -3.38 -0.73 0.00 0.00 179.01 176.21 2dbc s HIS 75 N -2.35 -1.66 -0.05 0.92 -3.43 -1.26 -5.16 115.29 102.31 2dbc s HIS 75 Ca -0.25 1.42 0.04 0.00 -0.80 0.00 0.00 55.06 55.47 2dbc s HIS 75 Cb 0.04 0.44 -0.02 0.00 -1.43 0.00 0.00 32.58 31.60 2dbc s HIS 75 CO 0.64 -0.95 -0.17 0.71 -2.00 0.00 0.00 174.74 172.97 2dbc s TYR 76 N 2.83 2.63 0.00 0.38 1.51 -1.26 -5.00 117.35 118.44 2dbc s TYR 76 Ca 0.16 -0.23 0.00 0.00 -1.01 0.00 0.00 57.07 55.99 2dbc s TYR 76 Cb -0.13 -1.61 0.00 0.00 -0.11 0.00 0.00 41.96 40.11 2dbc s TYR 76 CO -0.23 0.13 0.00 -2.39 -1.11 0.00 0.00 175.55 171.95 2dbc n HIS 77 N 2.37 0.00 -3.79 2.71 1.44 -1.26 -5.16 115.22 111.53 2dbc n HIS 77 Ca -0.17 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.53 2dbc n HIS 77 Cb 0.52 0.36 0.00 0.00 0.12 0.00 0.00 29.99 30.99 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 -4.95 -0.07 -1.56 4.39 2.15 -1.26 -4.99 116.67 110.39 2dbc s ASP 78 Ca 0.00 -0.41 -0.13 0.00 0.43 0.00 0.00 52.55 52.45 2dbc s ASP 78 Cb 0.00 0.37 0.09 0.00 -0.30 0.00 0.00 42.92 43.09 2dbc s ASP 78 CO 0.00 -0.72 0.83 0.59 -0.17 0.00 0.00 175.17 175.70 2dbc n ASN 79 N -0.79 -3.49 0.05 -0.34 3.02 -1.26 -4.84 115.26 107.60 2dbc n ASN 79 Ca -0.05 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 2dbc n ASN 79 Cb 0.61 -3.44 0.00 0.00 -0.61 0.00 0.00 39.78 36.34 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 -6.69 4.04 0.77 0.00 1.43 -1.26 -2.61 118.68 114.35 2dbc s LEU 81 Ca 0.00 1.68 -0.11 0.00 -1.03 0.00 0.00 54.13 54.68 2dbc s LEU 81 Cb 0.00 -4.38 0.06 0.00 0.03 0.00 0.00 46.19 41.89 2dbc s LEU 81 CO 0.00 -0.28 1.09 -2.16 0.23 0.00 0.00 176.35 175.23 2dbc s PRO 82 N -2.92 2.26 -0.08 1.29 0.04 -1.26 -4.19 135.00 130.14 2dbc s PRO 82 Ca 0.59 1.17 -0.02 0.00 0.04 0.00 0.00 61.00 62.78 2dbc s PRO 82 Cb -0.11 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.56 2dbc s PRO 82 CO 0.16 -1.64 0.02 0.99 0.04 0.00 0.00 177.00 176.56 2dbc s THR 83 N -2.89 0.29 -0.04 1.26 2.01 -1.25 -2.74 115.64 112.27 2dbc s THR 83 Ca 0.61 0.09 0.05 0.00 0.31 0.00 0.00 61.69 62.75 2dbc s THR 83 Cb -0.17 -0.52 -0.01 0.00 0.01 0.00 0.00 72.50 71.81 2dbc s THR 83 CO 0.56 0.17 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.84 2dbc s ILE 84 N 2.00 1.58 -0.03 1.82 1.01 -0.89 -1.13 121.20 125.56 2dbc s ILE 84 Ca 0.04 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.91 2dbc s ILE 84 Cb -0.13 -1.35 0.00 0.00 0.01 0.00 0.00 42.46 40.99 2dbc s ILE 84 CO -0.05 0.45 -0.12 -0.36 0.00 0.00 0.00 174.94 174.86 2dbc s PHE 85 N -0.09 1.26 -0.24 3.97 0.08 -0.34 -1.02 117.98 121.59 2dbc s PHE 85 Ca -0.02 -0.34 -0.04 0.00 0.12 0.00 0.00 56.93 56.64 2dbc s PHE 85 Cb -0.11 -0.88 -0.00 0.00 -0.57 0.00 0.00 43.02 41.46 2dbc s PHE 85 CO 0.02 -0.13 -0.01 0.08 -0.10 0.00 0.00 175.22 175.07 2dbc s VAL 86 N 0.17 3.49 -0.16 -0.44 1.01 0.52 -0.94 120.40 124.05 2dbc s VAL 86 Ca -0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2dbc s VAL 86 Cb -0.10 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 2dbc s VAL 86 CO 0.01 0.31 -0.12 -0.31 0.00 0.00 0.00 175.10 175.00 2dbc s TYR 87 N 1.47 2.85 -0.04 5.22 1.51 0.23 0.26 117.35 128.85 2dbc s TYR 87 Ca 0.04 -0.84 -0.04 0.00 -1.01 0.00 0.00 57.07 55.23 2dbc s TYR 87 Cb -0.15 -1.92 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 2dbc s TYR 87 CO -0.02 -0.37 -0.08 1.17 -1.11 0.00 0.00 175.55 175.15 2dbc n LYS 88 N 3.99 0.11 -0.72 -0.62 3.00 -1.21 -0.70 118.16 122.02 2dbc n LYS 88 Ca -0.18 0.05 0.03 0.00 -0.00 0.00 0.00 58.31 58.20 2dbc n LYS 88 Cb 0.52 -0.66 0.20 0.00 0.00 0.00 0.00 35.03 35.08 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 -2.95 2.01 0.00 3.14 3.02 -1.26 -4.35 115.26 114.88 2dbc n ASN 89 Ca -0.03 -3.89 0.00 0.00 -0.03 0.00 0.00 54.58 50.63 2dbc n ASN 89 Cb 0.11 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 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 -1.09 1.00 3.20 7.41 0.00 -1.25 -5.00 105.19 109.45 2dbc n GLY 90 Ca 0.22 -0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.06 2dbc n GLY 90 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dbc s GLN 91 N -0.31 0.90 -1.01 1.61 0.74 -1.26 -5.03 119.66 115.30 2dbc s GLN 91 Ca 0.00 -1.07 -0.23 0.00 0.05 0.00 0.00 55.36 54.11 2dbc s GLN 91 Cb 0.00 -0.86 0.01 0.00 1.10 0.00 0.00 33.01 33.26 2dbc s GLN 91 CO 0.00 0.18 1.68 0.42 -0.55 0.00 0.00 175.29 177.02 2dbc s ILE 92 N -1.63 3.74 0.36 -2.34 1.01 -1.26 -3.35 121.20 117.73 2dbc s ILE 92 Ca 0.02 -0.72 0.07 0.00 0.00 0.00 0.00 60.65 60.03 2dbc s ILE 92 Cb -0.08 -4.66 0.15 0.00 0.01 0.00 0.00 42.46 37.88 2dbc s ILE 92 CO 0.02 -1.53 1.88 -0.33 0.00 0.00 0.00 174.94 174.99 2dbc h GLU 93 N 10.16 0.34 -1.80 2.79 4.39 -0.58 -3.45 114.58 126.44 2dbc h GLU 93 Ca 0.18 -0.08 0.02 0.00 0.34 0.00 0.00 59.36 59.82 2dbc h GLU 93 Cb 0.99 -0.04 -0.24 0.00 -0.10 0.00 0.00 28.75 29.36 2dbc h GLU 93 CO 1.34 0.46 0.27 0.20 -1.16 0.00 0.00 179.01 180.12 2dbc s GLY 94 N -3.99 -0.35 0.03 -3.84 0.00 -1.21 -4.92 107.32 93.03 2dbc s GLY 94 Ca -0.06 2.43 0.04 0.00 0.00 0.00 0.00 44.72 47.12 2dbc s GLY 94 CO 0.75 1.93 -0.11 -1.59 0.00 0.00 0.00 173.10 174.07 2dbc s LYS 95 N 0.54 0.78 -0.27 2.90 -2.85 -1.26 -0.36 119.74 119.22 2dbc s LYS 95 Ca -0.01 -0.63 -0.02 0.00 -1.00 0.00 0.00 55.97 54.31 2dbc s LYS 95 Cb -0.05 -0.74 0.09 0.00 -2.06 0.00 0.00 37.83 35.07 2dbc s LYS 95 CO -0.06 0.18 0.09 -0.06 0.10 0.00 0.00 175.35 175.60 2dbc s PHE 96 N -0.78 1.21 -0.21 1.78 0.40 -0.19 -4.98 117.98 115.21 2dbc s PHE 96 Ca -0.00 -1.29 0.01 0.00 -0.60 0.00 0.00 56.93 55.04 2dbc s PHE 96 Cb -0.07 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.15 2dbc s PHE 96 CO 0.01 -0.79 -0.15 0.42 0.70 0.00 0.00 175.22 175.41 2dbc s ILE 97 N 1.79 2.31 0.00 0.64 1.09 -1.26 -2.10 121.20 123.67 2dbc s ILE 97 Ca 0.06 -1.04 0.00 0.00 -1.10 0.00 0.00 60.65 58.58 2dbc s ILE 97 Cb -0.17 -2.08 0.00 0.00 -1.06 0.00 0.00 42.46 39.15 2dbc s ILE 97 CO -0.23 0.38 0.00 0.61 -0.10 0.00 0.00 174.94 175.60 2dbc n GLY 98 N 4.61 3.52 0.26 6.18 0.00 -1.07 -4.49 105.19 114.20 2dbc n GLY 98 Ca -0.19 -1.59 -0.05 0.00 0.00 0.00 0.00 46.02 44.19 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 0.04 0.39 -0.38 -0.61 1.08 -1.86 0.19 117.51 116.35 2dbc h ILE 99 Ca 0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.33 2dbc h ILE 99 Cb 0.00 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.13 2dbc h ILE 99 CO 0.00 0.00 -0.31 0.40 -0.69 0.00 0.00 178.15 177.55 2dbc h ILE 100 N -0.13 1.28 -0.28 -0.67 2.04 -1.91 0.92 117.51 118.76 2dbc h ILE 100 Ca 0.20 -1.48 0.04 0.00 1.00 0.00 0.00 64.86 64.63 2dbc h ILE 100 Cb 0.45 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 2dbc h ILE 100 CO -0.50 0.49 0.19 -0.33 0.00 0.00 0.00 178.15 178.00 2dbc h GLU 101 N 0.70 0.18 -0.07 2.37 5.08 -1.53 0.19 114.58 121.49 2dbc h GLU 101 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2dbc h GLU 101 Cb 0.89 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2dbc h GLU 101 CO 0.08 0.12 0.00 0.00 -1.00 0.00 0.00 179.01 178.21 2dbc n GLY 103 N 1.16 1.99 0.00 0.00 0.00 0.65 -4.90 105.19 104.10 2dbc n GLY 103 Ca 0.18 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 2.66 0.40 -0.02 0.00 0.32 -4.42 105.19 104.13 2dbc n GLY 104 Ca 0.00 -1.85 0.19 0.00 0.00 0.00 0.00 46.02 44.36 2dbc n GLY 104 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2dbc h ILE 105 N 0.00 0.18 -0.69 -0.61 -0.00 -1.96 1.06 117.51 115.49 2dbc h ILE 105 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 64.86 64.62 2dbc h ILE 105 Cb 0.00 0.46 -0.14 0.00 -0.00 0.00 0.00 36.82 37.14 2dbc h ILE 105 CO 0.00 0.00 0.31 -0.46 -0.00 0.00 0.00 178.15 178.00 2dbc n ASN 106 N -3.34 4.31 -4.68 2.16 0.23 -1.26 -4.95 115.26 107.73 2dbc n ASN 106 Ca 0.08 -3.11 -0.42 0.00 -0.53 0.00 0.00 54.58 50.59 2dbc n ASN 106 Cb 0.79 -0.73 -0.03 0.00 -2.08 0.00 0.00 39.78 37.74 2dbc n ASN 106 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2dbc s LEU 107 N -2.62 4.29 0.91 -4.53 2.96 0.37 -5.01 118.68 115.04 2dbc s LEU 107 Ca 0.48 2.05 -0.14 0.00 -0.22 0.00 0.00 54.13 56.31 2dbc s LEU 107 Cb 0.39 -3.55 0.17 0.00 0.50 0.00 0.00 46.19 43.70 2dbc s LEU 107 CO 0.11 -0.77 1.26 -0.54 -1.32 0.00 0.00 176.35 175.10 2dbc s LYS 108 N 2.96 0.97 0.24 1.98 1.02 -1.26 -4.95 119.74 120.71 2dbc s LYS 108 Ca 0.64 -0.39 0.12 0.00 0.02 0.00 0.00 55.97 56.36 2dbc s LYS 108 Cb -0.30 -1.91 0.16 0.00 -0.52 0.00 0.00 37.83 35.26 2dbc s LYS 108 CO 0.25 -2.18 1.48 1.25 -0.92 0.00 0.00 175.35 175.24 2dbc h LEU 109 N -1.43 0.00 0.01 3.17 5.85 -1.98 -3.11 115.31 117.82 2dbc h LEU 109 Ca -0.44 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.22 2dbc h LEU 109 Cb 1.25 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2dbc h LEU 109 CO 0.43 0.68 -0.31 1.05 -0.34 0.00 0.00 178.44 179.95 2dbc h GLU 110 N 0.00 0.02 -0.40 1.25 4.11 -2.00 -3.16 114.58 114.41 2dbc h GLU 110 Ca -0.01 -0.04 0.08 0.00 0.07 0.00 0.00 59.36 59.47 2dbc h GLU 110 Cb 1.35 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.53 2dbc h GLU 110 CO 0.09 1.02 -0.24 0.93 0.07 0.00 0.00 179.01 180.88 2dbc h GLU 111 N -0.95 -0.16 -1.00 1.06 4.39 -1.96 -0.27 114.58 115.69 2dbc h GLU 111 Ca -0.08 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.68 2dbc h GLU 111 Cb 1.11 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.73 2dbc h GLU 111 CO -0.03 -0.11 0.65 1.25 -1.16 0.00 0.00 179.01 179.61 2dbc h LEU 112 N -0.17 1.06 -1.02 1.33 5.85 -1.70 -1.82 115.31 118.85 2dbc h LEU 112 Ca 0.19 -0.00 0.19 0.00 0.84 0.00 0.00 57.88 59.10 2dbc h LEU 112 Cb 0.47 -0.23 -0.11 0.00 0.37 0.00 0.00 40.66 41.16 2dbc h LEU 112 CO -0.50 0.71 0.61 -0.08 -0.34 0.00 0.00 178.44 178.84 2dbc h GLU 113 N 1.22 0.73 0.65 1.25 4.81 -1.01 -1.92 114.58 120.31 2dbc h GLU 113 Ca 0.41 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.57 2dbc h GLU 113 Cb 0.07 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 29.29 2dbc h GLU 113 CO -0.15 0.48 -0.31 2.35 -0.73 0.00 0.00 179.01 180.66 2dbc h TRP 114 N 0.75 -0.81 -0.99 0.92 7.01 -0.99 -2.16 115.95 119.69 2dbc h TRP 114 Ca 0.58 -0.02 0.24 0.00 2.11 0.00 0.00 58.89 61.81 2dbc h TRP 114 Cb 0.92 0.27 -0.19 0.00 -2.10 0.00 0.00 29.16 28.06 2dbc h TRP 114 CO -0.00 -0.50 -0.08 1.63 -2.79 0.00 0.00 178.44 176.70 2dbc n LYS 115 N -5.46 -0.08 0.14 2.65 5.02 -0.73 0.23 118.16 119.92 2dbc n LYS 115 Ca -0.13 1.50 0.01 0.00 -2.02 0.00 0.00 58.31 57.67 2dbc n LYS 115 Cb 0.36 -2.33 0.31 0.00 -0.02 0.00 0.00 35.03 33.35 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 0.12 0.15 -0.35 3.38 -1.38 -3.03 115.31 114.20 2dbc h LEU 116 Ca 0.55 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.47 2dbc h LEU 116 Cb 1.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2dbc h LEU 116 CO -0.96 0.47 -0.07 -1.28 0.09 0.00 0.00 178.44 176.69 2dbc h SER 117 N 0.11 -0.17 -1.89 -0.43 0.87 0.36 0.25 113.55 112.65 2dbc h SER 117 Ca 0.01 0.01 0.55 0.00 -1.23 0.00 0.00 61.79 61.13 2dbc h SER 117 Cb 0.67 0.04 -0.08 0.00 -0.44 0.00 0.00 62.40 62.59 2dbc h SER 117 CO 0.05 0.19 1.35 1.05 -0.53 0.00 0.00 176.83 178.94 2dbc h GLU 118 N -0.83 0.00 0.18 2.24 4.11 -0.12 1.79 114.58 121.95 2dbc h GLU 118 Ca -0.02 -0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.11 2dbc h GLU 118 Cb 0.16 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.42 2dbc h GLU 118 CO 0.03 0.00 -1.36 0.28 0.07 0.00 0.00 179.01 178.04 2dbc h VAL 119 N 0.00 1.39 0.00 -1.06 2.07 -1.59 -3.48 116.25 113.58 2dbc h VAL 119 Ca 0.91 -2.91 0.00 0.00 0.82 0.00 0.00 66.70 65.52 2dbc h VAL 119 Cb 3.62 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 36.36 2dbc h VAL 119 CO -0.03 0.86 0.00 0.61 0.02 0.00 0.00 177.57 179.02 2dbc n GLY 120 N 1.61 0.92 0.31 2.17 0.00 0.61 -4.90 105.19 105.92 2dbc n GLY 120 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.91 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 1.48 -2.87 4.61 0.00 -0.67 -3.46 119.26 118.35 2dbc h ALA 121 Ca 0.00 -0.10 -0.27 0.00 0.00 0.00 0.00 54.91 54.53 2dbc h ALA 121 Cb 0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 17.48 2dbc h ALA 121 CO 0.00 0.42 -0.27 0.96 0.00 0.00 0.00 179.25 180.36 2dbc s ILE 122 N -5.43 0.00 -0.50 0.00 -4.36 -1.07 -4.62 121.20 105.21 2dbc s ILE 122 Ca -0.09 -1.68 0.03 0.00 -0.26 0.00 0.00 60.65 58.65 2dbc s ILE 122 Cb 0.17 -2.55 0.13 0.00 1.25 0.00 0.00 42.46 41.45 2dbc s ILE 122 CO 0.76 0.00 0.25 0.00 0.24 0.00 0.00 174.94 176.19 2dbc s GLN 123 N -3.35 1.96 0.58 0.37 0.00 -1.26 -4.18 119.66 113.80 2dbc s GLN 123 Ca 0.32 -2.51 0.05 0.00 -0.00 0.00 0.00 55.36 53.21 2dbc s GLN 123 Cb 0.01 -3.34 0.07 0.00 0.00 0.00 0.00 33.01 29.75 2dbc s GLN 123 CO 0.19 -1.09 0.81 -1.54 0.00 0.00 0.00 175.29 173.66 2dbc s SER 124 N -0.03 5.01 -0.27 12.60 1.04 -1.26 -5.03 113.70 125.76 2dbc s SER 124 Ca 0.16 -0.46 0.09 0.00 0.48 0.00 0.00 55.95 56.23 2dbc s SER 124 Cb -0.25 -0.21 0.48 0.00 0.10 0.00 0.00 66.02 66.15 2dbc s SER 124 CO -0.01 -1.35 1.40 0.47 0.98 0.00 0.00 173.24 174.73 2dbc n ASP 125 N -2.37 2.26 -4.38 7.02 8.00 -1.26 -4.97 116.55 120.85 2dbc n ASP 125 Ca 0.13 -3.83 -0.39 0.00 0.71 0.00 0.00 54.79 51.41 2dbc n ASP 125 Cb 0.60 -0.61 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 2dbc n ASP 125 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dbc s LEU 126 N -3.26 4.19 -0.00 0.64 1.43 -1.26 -5.06 118.68 115.35 2dbc s LEU 126 Ca 0.43 -0.75 -0.23 0.00 -1.03 0.00 0.00 54.13 52.55 2dbc s LEU 126 Cb 0.40 -1.96 0.05 0.00 0.03 0.00 0.00 46.19 44.71 2dbc s LEU 126 CO -0.02 -0.25 0.52 -1.61 0.23 0.00 0.00 176.35 175.21 2dbc s GLU 127 N 1.54 0.94 -0.47 1.70 2.02 -1.26 -4.93 118.70 118.24 2dbc s GLU 127 Ca 0.03 -0.06 -0.04 0.00 0.02 0.00 0.00 54.97 54.92 2dbc s GLU 127 Cb -0.18 0.43 0.12 0.00 0.10 0.00 0.00 34.13 34.61 2dbc s GLU 127 CO 0.05 -0.31 0.29 -1.21 0.02 0.00 0.00 175.26 174.10 2dbc s GLU 128 N -1.73 2.24 -1.20 1.61 2.02 -1.26 -5.01 118.70 115.36 2dbc s GLU 128 Ca -0.09 -1.97 -0.19 0.00 0.02 0.00 0.00 54.97 52.74 2dbc s GLU 128 Cb -0.02 -3.69 -0.02 0.00 0.10 0.00 0.00 34.13 30.50 2dbc s GLU 128 CO 0.04 -1.12 1.95 0.27 0.02 0.00 0.00 175.26 176.42 2dbc n ASN 129 N 4.41 3.71 -3.60 -0.19 6.94 -1.26 -4.77 115.26 120.51 2dbc n ASN 129 Ca -0.01 -2.80 -0.00 0.00 -0.02 0.00 0.00 54.58 51.75 2dbc n ASN 129 Cb 0.41 -1.58 -0.06 0.00 -2.36 0.00 0.00 39.78 36.18 2dbc n ASN 129 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2dbc s SER 130 N 4.61 -0.35 0.11 0.53 0.15 -1.26 -5.16 113.70 112.33 2dbc s SER 130 Ca 0.56 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2dbc s SER 130 Cb 0.08 1.19 0.00 0.00 -1.71 0.00 0.00 66.02 65.58 2dbc s SER 130 CO 0.06 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2dbc n GLY 131 N 3.69 -2.08 3.68 9.45 0.00 -1.26 -4.81 105.19 113.87 2dbc n GLY 131 Ca -0.17 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.78 4.26 -0.65 1.61 0.04 -1.26 -4.98 135.00 133.24 2dbc s PRO 132 Ca 0.00 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 62.88 2dbc s PRO 132 Cb 0.00 -3.62 0.12 0.00 0.04 0.00 0.00 34.50 31.04 2dbc s PRO 132 CO 0.00 -0.63 0.75 0.45 0.04 0.00 0.00 177.00 177.61 2dbc s SER 133 N 2.09 6.29 -0.39 6.66 0.15 -1.26 -5.02 113.70 122.22 2dbc s SER 133 Ca 0.66 -1.65 -0.22 0.00 0.70 0.00 0.00 55.95 55.44 2dbc s SER 133 Cb -0.32 -2.30 0.01 0.00 -1.71 0.00 0.00 66.02 61.70 2dbc s SER 133 CO 0.27 -1.05 0.71 -0.94 1.20 0.00 0.00 173.24 173.44 2dbc s SER 134 N 3.47 6.44 0.00 5.45 1.04 -1.26 -5.24 113.70 123.61 2dbc s SER 134 Ca 0.14 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.65 2dbc s SER 134 Cb -0.21 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2dbc s SER 134 CO 0.03 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.12