#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 0.12 -4.19 1.61 2.88 -1.26 -5.00 113.62 107.78 2dbc n SER 2 Ca 0.00 0.93 -0.18 0.00 -1.33 0.00 0.00 58.87 58.29 2dbc n SER 2 Cb 0.00 -1.24 -0.12 0.00 -0.75 0.00 0.00 64.21 62.10 2dbc n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dbc s SER 3 N -0.92 1.75 0.00 -3.46 0.01 -1.26 -4.91 113.70 104.91 2dbc s SER 3 Ca 0.65 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2dbc s SER 3 Cb -0.55 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.63 2dbc s SER 3 CO 0.56 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.71 2dbc n GLY 4 N 1.00 2.88 3.59 3.44 0.00 -1.26 -5.09 105.19 109.76 2dbc n GLY 4 Ca -0.19 -0.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 3.78 -0.12 1.61 0.01 -1.26 -5.16 113.70 112.56 2dbc s SER 5 Ca 0.00 -1.31 -0.29 0.00 1.31 0.00 0.00 55.95 55.65 2dbc s SER 5 Cb 0.00 -0.37 0.07 0.00 0.21 0.00 0.00 66.02 65.93 2dbc s SER 5 CO 0.00 -0.37 0.70 -0.94 0.41 0.00 0.00 173.24 173.04 2dbc s SER 6 N -3.67 -0.67 0.43 2.44 1.04 -1.26 -5.10 113.70 106.91 2dbc s SER 6 Ca 0.34 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.68 2dbc s SER 6 Cb 0.07 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.99 2dbc s SER 6 CO 0.17 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.51 2dbc n GLY 7 N 1.41 -1.13 0.51 7.32 0.00 -1.26 -4.79 105.19 107.25 2dbc n GLY 7 Ca -0.17 -1.18 -0.02 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.52 0.04 0.00 1.61 4.76 -1.26 -4.98 118.16 117.82 2dbc n LYS 8 Ca 0.00 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2dbc n LYS 8 Cb 0.00 -0.78 0.00 0.00 -1.84 0.00 0.00 35.03 32.41 2dbc n LYS 8 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2dbc n PHE 9 N -2.84 -0.01 -2.63 2.13 3.72 -1.26 -5.07 117.46 111.51 2dbc n PHE 9 Ca -0.03 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.33 2dbc n PHE 9 Cb 0.53 0.03 0.01 0.00 -0.94 0.00 0.00 39.48 39.12 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 3.38 0.62 3.63 1.37 0.00 -1.26 -5.05 105.19 107.88 2dbc n GLY 10 Ca 0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 46.02 45.48 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 -5.08 0.24 0.05 1.61 -1.05 -1.25 -4.53 118.70 108.68 2dbc s GLU 11 Ca 0.09 0.13 -0.30 0.00 -0.15 0.00 0.00 54.97 54.74 2dbc s GLU 11 Cb -0.04 0.11 -0.04 0.00 -0.44 0.00 0.00 34.13 33.72 2dbc s GLU 11 CO 0.13 -0.06 0.95 -1.17 0.95 0.00 0.00 175.26 176.07 2dbc s LEU 12 N -0.63 4.43 0.40 1.83 2.96 -1.26 -4.84 118.68 121.57 2dbc s LEU 12 Ca 0.05 1.70 0.04 0.00 -0.22 0.00 0.00 54.13 55.70 2dbc s LEU 12 Cb -0.02 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.07 2dbc s LEU 12 CO -0.07 -0.16 0.06 -0.13 -1.32 0.00 0.00 176.35 174.73 2dbc s ARG 13 N 0.51 1.88 0.03 1.98 0.52 -1.21 -5.09 118.95 117.57 2dbc s ARG 13 Ca 0.49 -2.11 0.06 0.00 -0.52 0.00 0.00 55.73 53.65 2dbc s ARG 13 Cb -0.22 -1.07 -0.02 0.00 0.52 0.00 0.00 34.95 34.16 2dbc s ARG 13 CO 0.28 -0.27 -0.18 -2.00 0.02 0.00 0.00 175.30 173.16 2dbc s GLU 14 N -3.81 1.21 0.33 3.54 2.12 -1.26 -3.02 118.70 117.81 2dbc s GLU 14 Ca 0.27 -0.82 0.03 0.00 0.36 0.00 0.00 54.97 54.81 2dbc s GLU 14 Cb 0.06 -1.26 -0.04 0.00 0.26 0.00 0.00 34.13 33.15 2dbc s GLU 14 CO 0.13 0.32 0.14 0.96 -0.54 0.00 0.00 175.26 176.28 2dbc s ILE 15 N -0.76 0.49 0.47 -3.70 -4.36 -1.23 -4.97 121.20 107.15 2dbc s ILE 15 Ca 0.05 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.48 2dbc s ILE 15 Cb -0.08 -2.50 0.04 0.00 1.25 0.00 0.00 42.46 41.17 2dbc s ILE 15 CO 0.01 0.00 0.36 -1.20 0.24 0.00 0.00 174.94 174.35 2dbc n SER 16 N -1.01 2.50 -0.06 4.36 7.64 -1.26 -4.61 113.62 121.17 2dbc n SER 16 Ca -0.01 -2.62 -0.11 0.00 1.01 0.00 0.00 58.87 57.14 2dbc n SER 16 Cb 0.65 -0.04 -0.05 0.00 -1.01 0.00 0.00 64.21 63.76 2dbc n SER 16 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2dbc h GLY 17 N 0.55 0.35 2.00 0.23 0.00 -2.00 0.17 103.07 104.38 2dbc h GLY 17 Ca -0.30 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2dbc h GLY 17 CO 0.47 0.20 -0.12 3.43 0.00 0.00 0.00 176.54 180.52 2dbc h ASN 18 N 0.15 0.00 0.63 0.19 2.35 -2.03 -2.36 115.58 114.51 2dbc h ASN 18 Ca 0.06 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.54 2dbc h ASN 18 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2dbc h ASN 18 CO -0.00 0.12 -1.33 1.56 -1.65 0.00 0.00 177.43 176.13 2dbc h GLN 19 N 0.00 0.20 -0.90 0.81 4.20 -1.89 -3.34 115.11 114.19 2dbc h GLN 19 Ca -0.00 -0.33 0.17 0.00 0.06 0.00 0.00 58.65 58.55 2dbc h GLN 19 Cb 0.21 0.12 -0.17 0.00 0.30 0.00 0.00 27.48 27.95 2dbc h GLN 19 CO 0.02 1.10 -0.25 0.98 -0.67 0.00 0.00 178.83 180.00 2dbc n TYR 20 N -3.44 0.27 0.03 2.96 4.19 0.58 0.12 117.16 121.87 2dbc n TYR 20 Ca -0.10 1.10 -0.01 0.00 3.31 0.00 0.00 57.90 62.19 2dbc n TYR 20 Cb 1.02 -0.99 -0.01 0.00 0.49 0.00 0.00 39.34 39.85 2dbc n TYR 20 CO 0.00 0.00 0.00 0.28 0.91 0.00 0.00 176.86 178.05 2dbc h VAL 21 N 0.00 0.00 -0.15 2.97 2.07 -1.70 1.14 116.25 120.58 2dbc h VAL 21 Ca 0.41 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.93 2dbc h VAL 21 Cb 0.63 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2dbc h VAL 21 CO -0.92 0.00 0.75 0.78 0.02 0.00 0.00 177.57 178.20 2dbc h ASN 22 N -0.12 0.00 0.00 0.57 2.35 -1.52 0.36 115.58 117.22 2dbc h ASN 22 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2dbc h ASN 22 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2dbc h ASN 22 CO 0.01 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.17 2dbc n GLU 23 N -2.82 0.00 0.47 0.81 -0.58 0.31 -4.09 120.64 114.75 2dbc n GLU 23 Ca 0.03 0.02 -0.20 0.00 -0.42 0.00 0.00 57.16 56.58 2dbc n GLU 23 Cb 0.81 -0.27 -0.10 0.00 -0.57 0.00 0.00 31.44 31.32 2dbc n GLU 23 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2dbc h VAL 24 N 0.00 0.04 0.27 2.62 2.07 0.15 0.21 116.25 121.62 2dbc h VAL 24 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2dbc h VAL 24 Cb 0.00 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 2dbc h VAL 24 CO 0.00 0.00 -0.21 0.74 0.02 0.00 0.00 177.57 178.12 2dbc h THR 25 N -1.25 0.00 -0.12 2.57 2.02 -0.43 -2.55 112.91 113.15 2dbc h THR 25 Ca -0.12 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 2dbc h THR 25 Cb 0.98 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 2dbc h THR 25 CO 0.16 0.00 0.10 0.59 0.37 0.00 0.00 175.52 176.74 2dbc n ASN 26 N -3.61 4.74 -4.76 4.18 3.02 0.92 -4.30 115.26 115.45 2dbc n ASN 26 Ca -0.06 -2.44 -0.37 0.00 -0.03 0.00 0.00 54.58 51.68 2dbc n ASN 26 Cb 0.20 -0.91 0.02 0.00 -0.61 0.00 0.00 39.78 38.48 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 -0.44 2.76 0.36 5.41 0.00 0.75 -4.67 121.76 125.93 2dbc s ALA 27 Ca 0.07 1.06 -0.13 0.00 0.00 0.00 0.00 51.96 52.96 2dbc s ALA 27 Cb 0.06 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.61 2dbc s ALA 27 CO 0.00 -1.04 -0.07 -1.91 0.00 0.00 0.00 175.76 172.74 2dbc n GLU 28 N -1.09 0.00 -1.69 0.00 2.13 -1.26 -4.73 120.64 114.00 2dbc n GLU 28 Ca 0.11 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.49 2dbc n GLU 28 Cb 0.48 -0.73 -0.02 0.00 0.27 0.00 0.00 31.44 31.45 2dbc n GLU 28 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2dbc n LYS 29 N 1.08 2.14 -4.09 5.31 3.00 -1.26 -2.10 118.16 122.24 2dbc n LYS 29 Ca 0.06 0.76 -0.29 0.00 -0.00 0.00 0.00 58.31 58.84 2dbc n LYS 29 Cb 0.34 -2.39 -0.04 0.00 0.00 0.00 0.00 35.03 32.94 2dbc n LYS 29 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dbc n ASP 30 N 1.46 -0.66 -4.40 3.14 8.00 -1.26 -4.95 116.55 117.88 2dbc n ASP 30 Ca 0.08 -1.07 -0.33 0.00 0.71 0.00 0.00 54.79 54.18 2dbc n ASP 30 Cb 0.34 -2.67 -0.14 0.00 -0.02 0.00 0.00 41.12 38.63 2dbc n ASP 30 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2dbc s LEU 31 N -7.12 2.64 -0.54 0.64 2.96 -0.89 -5.08 118.68 111.30 2dbc s LEU 31 Ca 0.16 -0.29 -0.22 0.00 -0.22 0.00 0.00 54.13 53.56 2dbc s LEU 31 Cb -0.09 -1.56 0.05 0.00 0.50 0.00 0.00 46.19 45.10 2dbc s LEU 31 CO 0.92 0.25 0.80 0.26 -1.32 0.00 0.00 176.35 177.27 2dbc s TRP 32 N -0.18 2.90 -0.19 5.38 0.52 -1.26 -4.10 118.94 122.00 2dbc s TRP 32 Ca -0.01 -0.29 -0.07 0.00 0.02 0.00 0.00 56.10 55.76 2dbc s TRP 32 Cb -0.13 -3.86 -0.04 0.00 -1.15 0.00 0.00 33.47 28.29 2dbc s TRP 32 CO 0.03 -1.23 0.06 0.08 0.02 0.00 0.00 176.95 175.91 2dbc s VAL 33 N 3.37 4.69 -0.29 4.03 1.01 0.32 -0.02 120.40 133.51 2dbc s VAL 33 Ca 0.23 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.17 2dbc s VAL 33 Cb -0.16 -3.12 0.08 0.00 0.00 0.00 0.00 36.38 33.18 2dbc s VAL 33 CO 0.15 0.44 -0.01 -0.69 0.00 0.00 0.00 175.10 175.00 2dbc s VAL 34 N 0.58 1.84 -0.11 2.92 1.01 -0.59 -0.61 120.40 125.43 2dbc s VAL 34 Ca 0.03 -1.74 -0.05 0.00 0.00 0.00 0.00 61.98 60.22 2dbc s VAL 34 Cb -0.13 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 2dbc s VAL 34 CO 0.01 -0.35 0.06 -0.51 0.00 0.00 0.00 175.10 174.32 2dbc s ILE 35 N 1.19 4.82 -0.28 2.22 2.07 -0.88 -3.08 121.20 127.26 2dbc s ILE 35 Ca 0.02 -0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.22 2dbc s ILE 35 Cb -0.19 -3.08 0.08 0.00 0.13 0.00 0.00 42.46 39.40 2dbc s ILE 35 CO -0.09 0.59 0.02 -2.28 -1.91 0.00 0.00 174.94 171.26 2dbc s HIS 36 N -0.72 2.45 -0.69 3.50 5.65 -1.01 -1.62 115.29 122.85 2dbc s HIS 36 Ca 0.12 -2.01 -0.26 0.00 0.25 0.00 0.00 55.06 53.16 2dbc s HIS 36 Cb -0.12 -1.92 -0.03 0.00 -1.18 0.00 0.00 32.58 29.34 2dbc s HIS 36 CO 0.03 -0.84 1.86 -0.51 -0.65 0.00 0.00 174.74 174.63 2dbc s LEU 37 N 1.37 3.26 0.47 8.88 1.43 -0.29 -3.75 118.68 130.05 2dbc s LEU 37 Ca 0.03 0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.17 2dbc s LEU 37 Cb -0.18 -2.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 2dbc s LEU 37 CO -0.12 -2.44 0.72 -0.72 0.23 0.00 0.00 176.35 174.01 2dbc s TYR 38 N 9.19 3.25 -0.20 0.29 1.13 -0.96 -3.68 117.35 126.37 2dbc s TYR 38 Ca 0.67 0.34 -0.06 0.00 -1.41 0.00 0.00 57.07 56.60 2dbc s TYR 38 Cb -0.11 -2.38 0.09 0.00 -1.10 0.00 0.00 41.96 38.46 2dbc s TYR 38 CO 0.15 -0.43 0.40 0.50 -2.51 0.00 0.00 175.55 173.66 2dbc s ARG 39 N -4.64 0.31 0.58 -3.49 3.52 -1.26 -4.37 118.95 109.60 2dbc s ARG 39 Ca 0.49 0.93 0.32 0.00 -0.13 0.00 0.00 55.73 57.34 2dbc s ARG 39 Cb -0.10 0.18 1.34 0.00 -1.56 0.00 0.00 34.95 34.81 2dbc s ARG 39 CO 0.39 -0.31 1.65 1.03 -0.81 0.00 0.00 175.30 177.26 2dbc h SER 40 N 8.19 0.00 -0.17 -2.12 0.87 -2.01 1.25 113.55 119.56 2dbc h SER 40 Ca -0.16 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.37 2dbc h SER 40 Cb 1.12 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.06 2dbc h SER 40 CO 0.14 0.00 0.04 -1.20 -0.53 0.00 0.00 176.83 175.28 2dbc n SER 41 N -3.68 2.41 -3.67 6.23 7.64 -1.26 -4.71 113.62 116.58 2dbc n SER 41 Ca 0.20 -2.27 -0.19 0.00 1.01 0.00 0.00 58.87 57.63 2dbc n SER 41 Cb 1.20 -0.56 -0.17 0.00 -1.01 0.00 0.00 64.21 63.68 2dbc n SER 41 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2dbc s VAL 42 N -1.32 -0.17 -0.02 0.44 1.01 0.43 -5.05 120.40 115.73 2dbc s VAL 42 Ca 0.14 0.39 -0.25 0.00 0.00 0.00 0.00 61.98 62.26 2dbc s VAL 42 Cb 0.11 -0.21 -0.20 0.00 0.00 0.00 0.00 36.38 36.08 2dbc s VAL 42 CO 0.04 0.16 1.28 1.55 0.00 0.00 0.00 175.10 178.13 2dbc h PRO 43 N 8.37 0.04 -0.94 2.72 0.13 -1.84 -3.23 132.00 137.24 2dbc h PRO 43 Ca -0.14 -0.02 0.27 0.00 -0.87 0.00 0.00 66.00 65.25 2dbc h PRO 43 Cb 1.12 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.09 2dbc h PRO 43 CO 0.16 0.51 0.19 1.98 -0.23 0.00 0.00 178.00 180.61 2dbc h MET 44 N -0.44 0.09 -0.76 0.86 4.05 -1.96 0.65 114.93 117.43 2dbc h MET 44 Ca 0.00 -0.01 0.08 0.00 -0.28 0.00 0.00 59.70 59.49 2dbc h MET 44 Cb 0.51 -0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 31.22 2dbc h MET 44 CO 0.00 0.06 0.43 0.00 0.23 0.00 0.00 176.91 177.63 2dbc h LEU 46 N 0.75 -1.93 -0.66 0.00 3.38 0.23 0.37 115.31 117.45 2dbc h LEU 46 Ca 0.35 0.30 -0.06 0.00 0.09 0.00 0.00 57.88 58.56 2dbc h LEU 46 Cb 0.28 0.86 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2dbc h LEU 46 CO -0.22 -0.29 0.18 1.62 0.09 0.00 0.00 178.44 179.83 2dbc h VAL 47 N -0.11 1.25 -1.00 1.22 3.04 -1.53 -2.76 116.25 116.38 2dbc h VAL 47 Ca 0.17 -0.91 0.11 0.00 -1.01 0.00 0.00 66.70 65.06 2dbc h VAL 47 Cb 0.49 0.58 -0.08 0.00 -2.01 0.00 0.00 31.29 30.27 2dbc h VAL 47 CO -0.85 0.35 0.63 0.58 -1.01 0.00 0.00 177.57 177.27 2dbc h VAL 48 N 0.97 0.95 -0.26 1.51 2.07 -0.18 -1.97 116.25 119.35 2dbc h VAL 48 Ca 0.21 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 2dbc h VAL 48 Cb 0.33 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2dbc h VAL 48 CO -0.00 0.19 0.02 -1.13 0.02 0.00 0.00 177.57 176.66 2dbc h ASN 49 N 1.02 0.43 -1.00 0.57 -0.00 -0.13 -2.44 115.58 114.04 2dbc h ASN 49 Ca 0.48 -0.29 0.26 0.00 -0.00 0.00 0.00 56.30 56.75 2dbc h ASN 49 Cb 0.41 -0.12 -0.13 0.00 -0.00 0.00 0.00 38.32 38.49 2dbc h ASN 49 CO -0.25 0.62 0.58 1.56 -0.00 0.00 0.00 177.43 179.94 2dbc h GLN 50 N 0.24 0.51 -0.14 6.67 1.08 -1.11 0.30 115.11 122.65 2dbc h GLN 50 Ca 0.08 -0.03 -0.12 0.00 -1.45 0.00 0.00 58.65 57.13 2dbc h GLN 50 Cb 0.39 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 2dbc h GLN 50 CO 0.01 0.34 -0.37 0.45 -0.95 0.00 0.00 178.83 178.31 2dbc h HIS 51 N 0.52 0.64 -0.50 2.96 3.86 -1.33 -3.10 115.15 118.19 2dbc h HIS 51 Ca 0.66 -0.25 0.06 0.00 -1.16 0.00 0.00 60.37 59.68 2dbc h HIS 51 Cb 1.31 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 29.63 2dbc h HIS 51 CO -0.01 0.99 0.34 -0.07 0.86 0.00 0.00 177.93 180.03 2dbc h LEU 52 N 0.12 0.37 0.71 2.43 3.38 -0.10 0.49 115.31 122.72 2dbc h LEU 52 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2dbc h LEU 52 Cb 0.98 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.66 2dbc h LEU 52 CO 0.08 0.24 -0.34 -1.28 0.09 0.00 0.00 178.44 177.23 2dbc h SER 53 N 0.43 -0.82 0.90 -0.43 0.87 -0.53 -1.00 113.55 112.97 2dbc h SER 53 Ca 0.22 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.70 2dbc h SER 53 Cb 0.33 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 2dbc h SER 53 CO -0.06 -0.58 -0.50 1.62 -0.53 0.00 0.00 176.83 176.78 2dbc h VAL 54 N -0.96 1.08 0.00 2.23 3.04 -1.49 -2.93 116.25 117.23 2dbc h VAL 54 Ca -0.10 -1.93 0.00 0.00 -1.01 0.00 0.00 66.70 63.67 2dbc h VAL 54 Cb 0.73 2.13 0.00 0.00 -2.01 0.00 0.00 31.29 32.14 2dbc h VAL 54 CO 0.16 0.49 0.00 -0.07 -1.01 0.00 0.00 177.57 177.14 2dbc h LEU 55 N 0.00 0.00 -0.01 3.16 3.38 0.14 -0.71 115.31 121.27 2dbc h LEU 55 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2dbc h LEU 55 Cb 1.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.85 2dbc h LEU 55 CO 0.07 0.00 -0.55 0.00 0.09 0.00 0.00 178.44 178.04 2dbc h ALA 56 N 2.03 0.08 0.10 1.53 0.00 -0.98 -2.67 119.26 119.36 2dbc h ALA 56 Ca 0.00 -0.55 -0.26 0.00 0.00 0.00 0.00 54.91 54.10 2dbc h ALA 56 Cb 0.49 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.31 2dbc h ALA 56 CO 0.00 0.33 -1.18 0.07 0.00 0.00 0.00 179.25 178.46 2dbc h ARG 57 N -0.12 0.31 -0.37 0.00 0.11 -1.61 -3.32 114.38 109.39 2dbc h ARG 57 Ca -0.07 -0.47 -0.02 0.00 0.10 0.00 0.00 59.98 59.53 2dbc h ARG 57 Cb 1.26 0.17 -0.02 0.00 1.11 0.00 0.00 29.97 32.49 2dbc h ARG 57 CO 0.11 1.20 0.17 -0.22 0.10 0.00 0.00 179.97 181.33 2dbc h LYS 58 N 0.11 0.54 -3.49 0.08 3.64 -1.23 -3.36 116.57 112.85 2dbc h LYS 58 Ca -0.13 -0.08 -0.66 0.00 -1.27 0.00 0.00 60.65 58.51 2dbc h LYS 58 Cb 1.89 -0.09 -0.39 0.00 -0.41 0.00 0.00 32.23 33.22 2dbc h LYS 58 CO 0.20 0.49 -0.56 -0.06 -2.27 0.00 0.00 179.45 177.25 2dbc s PHE 59 N -5.67 3.27 0.19 1.91 0.40 -1.01 -4.94 117.98 112.13 2dbc s PHE 59 Ca -0.13 -3.04 -0.05 0.00 -0.60 0.00 0.00 56.93 53.11 2dbc s PHE 59 Cb 0.10 -2.93 0.11 0.00 0.51 0.00 0.00 43.02 40.81 2dbc s PHE 59 CO 0.74 -0.78 1.54 -1.00 0.70 0.00 0.00 175.22 176.43 2dbc h PRO 60 N 6.69 0.70 -0.17 0.24 0.13 -1.72 -3.23 132.00 134.63 2dbc h PRO 60 Ca -0.06 -0.37 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 2dbc h PRO 60 Cb 0.91 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 2dbc h PRO 60 CO 0.69 0.98 -0.09 0.93 -0.23 0.00 0.00 178.00 180.28 2dbc h GLU 61 N 0.57 -0.07 -6.33 0.86 5.08 -1.92 -3.37 114.58 109.42 2dbc h GLU 61 Ca 0.05 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.86 2dbc h GLU 61 Cb 0.95 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 2dbc h GLU 61 CO 0.09 -0.04 0.70 0.99 -1.00 0.00 0.00 179.01 179.74 2dbc s THR 62 N -6.18 4.21 0.37 1.13 2.01 -1.22 -4.62 115.64 111.33 2dbc s THR 62 Ca -0.14 1.54 -0.26 0.00 0.31 0.00 0.00 61.69 63.14 2dbc s THR 62 Cb 0.10 -3.99 -0.09 0.00 0.01 0.00 0.00 72.50 68.53 2dbc s THR 62 CO 0.68 0.00 1.17 -0.75 -0.69 0.00 0.00 174.62 175.03 2dbc s LYS 63 N 2.17 4.22 -0.11 4.92 2.20 0.97 -4.92 119.74 129.19 2dbc s LYS 63 Ca 0.56 1.86 -0.01 0.00 -0.36 0.00 0.00 55.97 58.03 2dbc s LYS 63 Cb -0.25 -2.83 0.03 0.00 -1.51 0.00 0.00 37.83 33.27 2dbc s LYS 63 CO 0.23 -0.18 -0.02 -0.06 -0.36 0.00 0.00 175.35 174.96 2dbc s PHE 64 N -1.34 1.07 -0.01 4.03 0.08 -1.26 -1.54 117.98 119.02 2dbc s PHE 64 Ca 0.53 -0.54 -0.05 0.00 0.12 0.00 0.00 56.93 56.99 2dbc s PHE 64 Cb -0.32 -1.02 -0.00 0.00 -0.57 0.00 0.00 43.02 41.12 2dbc s PHE 64 CO 0.40 -0.46 0.10 0.14 -0.10 0.00 0.00 175.22 175.30 2dbc s VAL 65 N 1.84 0.07 0.01 -0.44 -7.23 -1.18 -3.36 120.40 110.11 2dbc s VAL 65 Ca 0.04 -0.56 0.04 0.00 -1.81 0.00 0.00 61.98 59.68 2dbc s VAL 65 Cb -0.13 -0.33 -0.01 0.00 0.56 0.00 0.00 36.38 36.47 2dbc s VAL 65 CO -0.07 -0.31 -0.11 -1.59 -0.31 0.00 0.00 175.10 172.72 2dbc s LYS 66 N -1.02 0.83 0.29 4.82 0.00 -1.17 -2.42 119.74 121.08 2dbc s LYS 66 Ca -0.11 -0.51 -0.12 0.00 0.00 0.00 0.00 55.97 55.23 2dbc s LYS 66 Cb -0.06 -0.79 0.01 0.00 0.00 0.00 0.00 37.83 36.98 2dbc s LYS 66 CO 0.01 0.21 0.55 0.00 0.00 0.00 0.00 175.35 176.12 2dbc s ALA 67 N -0.52 -0.22 -0.21 0.59 0.00 -1.25 -3.49 121.76 116.66 2dbc s ALA 67 Ca 0.02 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 50.99 2dbc s ALA 67 Cb -0.06 1.00 -0.03 0.00 0.00 0.00 0.00 23.12 24.03 2dbc s ALA 67 CO 0.00 -0.88 0.05 0.42 0.00 0.00 0.00 175.76 175.34 2dbc s ILE 68 N -3.54 4.36 -0.25 0.00 1.01 -1.26 -2.27 121.20 119.26 2dbc s ILE 68 Ca 0.22 -0.17 -0.04 0.00 0.00 0.00 0.00 60.65 60.66 2dbc s ILE 68 Cb -0.02 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.43 2dbc s ILE 68 CO 0.12 0.40 2.87 0.55 0.00 0.00 0.00 174.94 178.88 2dbc n VAL 69 N 4.27 3.02 0.02 2.92 3.14 -1.26 -4.41 118.33 126.03 2dbc n VAL 69 Ca -0.16 -2.08 -0.18 0.00 -2.96 0.00 0.00 64.34 58.95 2dbc n VAL 69 Cb 0.52 -1.68 -0.13 0.00 -1.06 0.00 0.00 33.84 31.49 2dbc n VAL 69 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2dbc h ASN 70 N 2.59 0.38 0.02 6.55 7.08 -1.95 -3.34 115.58 126.92 2dbc h ASN 70 Ca 0.28 -0.91 -0.39 0.00 -3.08 0.00 0.00 56.30 52.20 2dbc h ASN 70 Cb 1.03 -0.12 -0.06 0.00 -2.08 0.00 0.00 38.32 37.10 2dbc h ASN 70 CO 0.57 1.26 -2.31 -0.24 -2.08 0.00 0.00 177.43 174.62 2dbc n SER 71 N -4.26 2.00 -0.38 6.14 2.88 -1.26 -4.49 113.62 114.25 2dbc n SER 71 Ca -0.12 0.07 -0.01 0.00 -1.33 0.00 0.00 58.87 57.47 2dbc n SER 71 Cb 0.71 -0.62 0.04 0.00 -0.75 0.00 0.00 64.21 63.59 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 -5.94 0.59 -0.15 0.00 1.01 -1.25 -5.06 121.20 110.39 2dbc s ILE 73 Ca -0.14 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 59.60 2dbc s ILE 73 Cb 0.20 -0.60 -0.24 0.00 0.01 0.00 0.00 42.46 41.84 2dbc s ILE 73 CO 0.71 -0.19 0.26 -1.84 0.00 0.00 0.00 174.94 173.89 2dbc n GLU 74 N 1.94 0.72 0.00 2.79 0.28 -1.26 -4.53 120.64 120.58 2dbc n GLU 74 Ca -0.19 0.30 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 2dbc n GLU 74 Cb 0.56 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.74 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 -3.62 0.00 -1.16 -1.84 8.25 -1.26 -4.43 115.22 111.15 2dbc n HIS 75 Ca -0.34 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 56.67 2dbc n HIS 75 Cb 0.98 -0.30 -0.07 0.00 1.12 0.00 0.00 29.99 31.73 2dbc n HIS 75 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2dbc n TYR 76 N -2.41 1.01 0.00 4.41 4.02 -1.26 -4.82 117.16 118.12 2dbc n TYR 76 Ca 0.00 0.78 0.00 0.00 -0.01 0.00 0.00 57.90 58.67 2dbc n TYR 76 Cb 0.00 -1.51 0.00 0.00 -0.02 0.00 0.00 39.34 37.81 2dbc n TYR 76 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 176.86 173.46 2dbc n HIS 77 N 2.31 0.00 0.07 -0.72 1.44 -1.26 -5.04 115.22 112.02 2dbc n HIS 77 Ca 0.19 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.90 2dbc n HIS 77 Cb -0.02 0.29 0.00 0.00 0.12 0.00 0.00 29.99 30.38 2dbc n HIS 77 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2dbc n ASP 78 N -2.34 0.08 -1.54 4.39 -0.08 -1.26 -4.84 116.55 110.96 2dbc n ASP 78 Ca 0.00 0.24 -0.02 0.00 -1.51 0.00 0.00 54.79 53.50 2dbc n ASP 78 Cb 0.00 0.14 0.01 0.00 2.34 0.00 0.00 41.12 43.61 2dbc n ASP 78 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2dbc n ASN 79 N -3.14 5.39 -0.16 1.67 6.94 -1.26 -3.30 115.26 121.41 2dbc n ASN 79 Ca 0.00 -2.49 0.01 0.00 -0.02 0.00 0.00 54.58 52.08 2dbc n ASN 79 Cb 0.05 -1.09 0.02 0.00 -2.36 0.00 0.00 39.78 36.40 2dbc n ASN 79 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dbc s LEU 81 N -0.47 2.32 0.00 0.00 1.43 -1.21 -4.37 118.68 116.38 2dbc s LEU 81 Ca 0.04 -0.67 -0.19 0.00 -1.03 0.00 0.00 54.13 52.28 2dbc s LEU 81 Cb 0.03 -0.05 0.27 0.00 0.03 0.00 0.00 46.19 46.48 2dbc s LEU 81 CO 0.00 -0.32 0.98 -0.81 0.23 0.00 0.00 176.35 176.44 2dbc n PRO 82 N 1.08 -2.94 -3.78 1.29 -0.04 -1.26 -3.71 135.00 125.63 2dbc n PRO 82 Ca -0.20 -1.57 -0.13 0.00 -0.04 0.00 0.00 63.50 61.56 2dbc n PRO 82 Cb 0.56 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.43 2dbc n PRO 82 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2dbc s THR 83 N -2.78 -0.01 -0.04 0.52 2.01 -1.24 -2.55 115.64 111.56 2dbc s THR 83 Ca 0.64 0.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.60 2dbc s THR 83 Cb -0.06 -0.34 0.01 0.00 0.01 0.00 0.00 72.50 72.12 2dbc s THR 83 CO 0.49 0.01 0.15 -0.63 -0.69 0.00 0.00 174.62 173.95 2dbc s ILE 84 N 0.27 0.03 -0.07 1.82 1.01 -0.55 -1.14 121.20 122.57 2dbc s ILE 84 Ca -0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.35 2dbc s ILE 84 Cb -0.03 -0.30 0.03 0.00 0.01 0.00 0.00 42.46 42.17 2dbc s ILE 84 CO -0.01 -0.14 0.17 -0.36 0.00 0.00 0.00 174.94 174.61 2dbc s PHE 85 N -0.44 -0.21 -0.14 3.97 0.08 -0.64 -1.01 117.98 119.60 2dbc s PHE 85 Ca -0.05 0.54 -0.03 0.00 0.12 0.00 0.00 56.93 57.50 2dbc s PHE 85 Cb -0.03 -0.01 -0.03 0.00 -0.57 0.00 0.00 43.02 42.38 2dbc s PHE 85 CO 0.01 -0.16 -0.04 0.08 -0.10 0.00 0.00 175.22 175.01 2dbc s VAL 86 N 0.83 3.90 -0.06 -0.44 1.01 0.72 -2.06 120.40 124.29 2dbc s VAL 86 Ca -0.06 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.59 2dbc s VAL 86 Cb -0.08 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.62 2dbc s VAL 86 CO -0.04 0.52 -0.17 -0.31 0.00 0.00 0.00 175.10 175.09 2dbc s TYR 87 N 0.12 1.79 -0.01 5.22 1.51 0.22 0.73 117.35 126.93 2dbc s TYR 87 Ca -0.01 -0.61 -0.07 0.00 -1.01 0.00 0.00 57.07 55.38 2dbc s TYR 87 Cb -0.14 -1.23 -0.02 0.00 -0.11 0.00 0.00 41.96 40.46 2dbc s TYR 87 CO 0.03 -0.25 -0.13 1.17 -1.11 0.00 0.00 175.55 175.26 2dbc n LYS 88 N 3.43 0.19 -2.32 -0.62 3.00 -1.26 -0.52 118.16 120.06 2dbc n LYS 88 Ca -0.20 0.08 -0.18 0.00 -0.00 0.00 0.00 58.31 58.01 2dbc n LYS 88 Cb 0.53 -0.84 0.02 0.00 0.00 0.00 0.00 35.03 34.74 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 -3.84 3.93 0.00 3.14 3.02 -1.26 -3.53 115.26 116.72 2dbc n ASN 89 Ca -0.05 -3.30 0.00 0.00 -0.03 0.00 0.00 54.58 51.20 2dbc n ASN 89 Cb 0.20 -0.40 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 -0.61 0.74 1.65 7.41 0.00 -1.26 -5.07 105.19 108.06 2dbc n GLY 90 Ca 0.33 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.88 0.75 -3.62 1.61 10.64 -1.26 -5.08 117.38 118.54 2dbc n GLN 91 Ca 0.00 -1.70 -0.38 0.00 -1.83 0.00 0.00 57.00 53.10 2dbc n GLN 91 Cb 0.16 0.93 -0.07 0.00 -0.86 0.00 0.00 30.24 30.40 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 -2.30 4.38 0.37 -0.39 1.01 -1.26 -3.93 121.20 119.08 2dbc s ILE 92 Ca 0.10 -3.45 0.11 0.00 0.00 0.00 0.00 60.65 57.41 2dbc s ILE 92 Cb 0.01 -3.74 0.33 0.00 0.01 0.00 0.00 42.46 39.06 2dbc s ILE 92 CO 0.07 -1.03 1.87 -0.33 0.00 0.00 0.00 174.94 175.52 2dbc h GLU 93 N 6.51 0.61 -1.51 2.79 4.39 -0.06 -3.44 114.58 123.87 2dbc h GLU 93 Ca 0.10 -0.04 0.08 0.00 0.34 0.00 0.00 59.36 59.85 2dbc h GLU 93 Cb 0.88 -0.14 -0.27 0.00 -0.10 0.00 0.00 28.75 29.12 2dbc h GLU 93 CO 0.81 0.40 0.52 0.20 -1.16 0.00 0.00 179.01 179.78 2dbc s GLY 94 N -3.71 -0.06 0.06 -3.84 0.00 -1.23 -4.92 107.32 93.61 2dbc s GLY 94 Ca -0.10 2.84 0.05 0.00 0.00 0.00 0.00 44.72 47.52 2dbc s GLY 94 CO 0.79 1.89 -0.15 -1.59 0.00 0.00 0.00 173.10 174.04 2dbc s LYS 95 N 0.26 0.95 -0.20 2.90 -2.85 -1.26 -0.20 119.74 119.34 2dbc s LYS 95 Ca 0.03 -0.88 -0.04 0.00 -1.00 0.00 0.00 55.97 54.08 2dbc s LYS 95 Cb -0.05 -1.00 0.07 0.00 -2.06 0.00 0.00 37.83 34.79 2dbc s LYS 95 CO -0.08 0.24 0.08 -0.06 0.10 0.00 0.00 175.35 175.63 2dbc s PHE 96 N -1.01 0.44 -0.17 1.78 0.40 -0.18 -4.98 117.98 114.27 2dbc s PHE 96 Ca 0.01 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.79 2dbc s PHE 96 Cb -0.09 -0.83 0.03 0.00 0.51 0.00 0.00 43.02 42.64 2dbc s PHE 96 CO 0.02 -0.59 -0.15 0.42 0.70 0.00 0.00 175.22 175.62 2dbc s ILE 97 N 2.05 1.72 0.00 0.64 1.09 -1.26 -1.48 121.20 123.97 2dbc s ILE 97 Ca 0.03 -0.80 0.00 0.00 -1.10 0.00 0.00 60.65 58.78 2dbc s ILE 97 Cb -0.16 -1.63 0.00 0.00 -1.06 0.00 0.00 42.46 39.60 2dbc s ILE 97 CO -0.13 0.42 0.00 0.61 -0.10 0.00 0.00 174.94 175.73 2dbc n GLY 98 N 4.71 3.36 0.28 6.18 0.00 -1.06 -4.52 105.19 114.15 2dbc n GLY 98 Ca -0.18 -1.22 -0.03 0.00 0.00 0.00 0.00 46.02 44.60 2dbc n GLY 98 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dbc n ILE 99 N 0.49 -0.41 0.24 -0.61 5.41 -1.24 0.23 119.36 123.46 2dbc n ILE 99 Ca 0.00 1.68 -0.15 0.00 1.00 0.00 0.00 62.75 65.27 2dbc n ILE 99 Cb 0.00 -2.17 -0.08 0.00 -0.71 0.00 0.00 39.64 36.69 2dbc n ILE 99 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2dbc h ILE 100 N 0.00 0.49 -1.21 1.39 2.04 -1.91 0.33 117.51 118.64 2dbc h ILE 100 Ca 0.20 0.00 0.35 0.00 1.00 0.00 0.00 64.86 66.41 2dbc h ILE 100 Cb 0.38 0.49 -0.09 0.00 -0.74 0.00 0.00 36.82 36.87 2dbc h ILE 100 CO -0.69 0.00 0.81 -0.33 0.00 0.00 0.00 178.15 177.94 2dbc h GLU 101 N -0.61 0.17 -0.95 2.37 5.08 -0.46 1.23 114.58 121.41 2dbc h GLU 101 Ca -0.04 -0.01 -0.26 0.00 -1.00 0.00 0.00 59.36 58.05 2dbc h GLU 101 Cb 0.50 -0.04 -0.15 0.00 0.50 0.00 0.00 28.75 29.56 2dbc h GLU 101 CO 0.04 0.11 0.33 0.00 -1.00 0.00 0.00 179.01 178.50 2dbc n GLY 103 N -0.35 2.21 0.00 0.00 0.00 0.42 -4.78 105.19 102.70 2dbc n GLY 103 Ca 0.33 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 1.71 0.20 -0.02 0.00 0.11 -4.31 105.19 102.87 2dbc n GLY 104 Ca 0.00 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 44.05 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 0.00 0.00 -0.61 -0.00 -1.91 0.37 117.51 115.36 2dbc h ILE 105 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 2dbc h ILE 105 Cb 0.00 0.53 0.00 0.00 -0.00 0.00 0.00 36.82 37.35 2dbc h ILE 105 CO 0.00 0.00 -0.68 0.59 -0.00 0.00 0.00 178.15 178.06 2dbc n ASN 106 N -2.36 0.62 -4.00 2.16 5.03 -1.26 -4.96 115.26 110.49 2dbc n ASN 106 Ca -0.02 -0.05 -0.46 0.00 0.87 0.00 0.00 54.58 54.92 2dbc n ASN 106 Cb 0.10 0.32 -0.04 0.00 -1.02 0.00 0.00 39.78 39.14 2dbc n ASN 106 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2dbc n LEU 107 N -1.91 -0.79 -4.80 3.41 7.94 0.13 -4.95 117.00 116.03 2dbc n LEU 107 Ca 0.04 1.03 -0.22 0.00 -1.11 0.00 0.00 56.01 55.74 2dbc n LEU 107 Cb 0.41 -0.85 -0.05 0.00 0.53 0.00 0.00 43.42 43.46 2dbc n LEU 107 CO 0.37 -2.40 -0.17 -0.54 -1.11 0.00 0.00 177.39 173.54 2dbc s LYS 108 N -0.63 2.72 0.29 1.96 3.01 -1.26 -5.00 119.74 120.83 2dbc s LYS 108 Ca 0.65 -1.22 0.02 0.00 -1.01 0.00 0.00 55.97 54.41 2dbc s LYS 108 Cb -0.93 -2.44 0.59 0.00 -1.01 0.00 0.00 37.83 34.04 2dbc s LYS 108 CO 0.51 0.28 1.82 1.25 0.51 0.00 0.00 175.35 179.72 2dbc h LEU 109 N 1.48 0.90 -0.11 3.17 5.85 -1.96 -1.86 115.31 122.79 2dbc h LEU 109 Ca -0.46 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.26 2dbc h LEU 109 Cb 1.25 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.16 2dbc h LEU 109 CO 0.60 0.45 -0.17 -0.33 -0.34 0.00 0.00 178.44 178.65 2dbc h GLU 110 N 0.95 0.30 -0.23 1.25 5.08 -1.99 -2.74 114.58 117.20 2dbc h GLU 110 Ca 0.52 -0.18 0.04 0.00 -1.00 0.00 0.00 59.36 58.74 2dbc h GLU 110 Cb 0.58 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.77 2dbc h GLU 110 CO -0.29 0.76 -0.50 0.93 -1.00 0.00 0.00 179.01 178.90 2dbc h GLU 111 N -0.12 -0.47 -0.75 2.33 4.39 -1.75 -1.03 114.58 117.17 2dbc h GLU 111 Ca 0.01 0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.82 2dbc h GLU 111 Cb 0.73 0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 29.42 2dbc h GLU 111 CO 0.04 -0.31 0.43 1.25 -1.16 0.00 0.00 179.01 179.25 2dbc h LEU 112 N -0.49 0.62 -1.41 1.33 5.85 -1.49 -1.10 115.31 118.63 2dbc h LEU 112 Ca 0.07 0.04 0.29 0.00 0.84 0.00 0.00 57.88 59.11 2dbc h LEU 112 Cb 0.64 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 2dbc h LEU 112 CO -0.49 0.38 0.69 -0.08 -0.34 0.00 0.00 178.44 178.61 2dbc h GLU 113 N 0.75 0.33 0.28 1.25 4.81 -0.88 -1.34 114.58 119.79 2dbc h GLU 113 Ca 0.35 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 2dbc h GLU 113 Cb 0.27 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2dbc h GLU 113 CO -0.21 0.22 -0.13 2.35 -0.73 0.00 0.00 179.01 180.50 2dbc h TRP 114 N 0.34 -0.35 -0.97 0.92 7.01 -0.70 -2.68 115.95 119.52 2dbc h TRP 114 Ca 0.61 -0.01 0.25 0.00 2.11 0.00 0.00 58.89 61.85 2dbc h TRP 114 Cb 1.64 0.11 -0.18 0.00 -2.10 0.00 0.00 29.16 28.63 2dbc h TRP 114 CO -0.00 0.00 -0.04 1.63 -2.79 0.00 0.00 178.44 177.23 2dbc n LYS 115 N -5.05 -0.08 0.13 2.65 5.02 -0.54 0.24 118.16 120.53 2dbc n LYS 115 Ca -0.08 1.47 -0.01 0.00 -2.02 0.00 0.00 58.31 57.68 2dbc n LYS 115 Cb 0.26 -2.31 0.25 0.00 -0.02 0.00 0.00 35.03 33.21 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 0.29 -0.35 3.38 -1.52 -3.06 115.31 114.17 2dbc h LEU 116 Ca 0.56 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.46 2dbc h LEU 116 Cb 1.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2dbc h LEU 116 CO -0.94 0.56 -0.14 -1.28 0.09 0.00 0.00 178.44 176.74 2dbc h SER 117 N 0.09 -0.33 -1.40 -0.43 0.87 0.34 0.07 113.55 112.76 2dbc h SER 117 Ca 0.00 0.01 0.44 0.00 -1.23 0.00 0.00 61.79 61.01 2dbc h SER 117 Cb 0.85 0.09 -0.11 0.00 -0.44 0.00 0.00 62.40 62.79 2dbc h SER 117 CO 0.06 0.09 0.94 1.05 -0.53 0.00 0.00 176.83 178.44 2dbc h GLU 118 N -1.04 0.08 -0.10 2.24 4.11 -0.22 1.49 114.58 121.13 2dbc h GLU 118 Ca -0.04 -0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.21 2dbc h GLU 118 Cb 0.30 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2dbc h GLU 118 CO 0.07 0.05 -0.68 0.28 0.07 0.00 0.00 179.01 178.80 2dbc h VAL 119 N 0.08 1.36 0.00 -1.06 2.07 -1.57 -3.44 116.25 113.70 2dbc h VAL 119 Ca 0.80 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2dbc h VAL 119 Cb 2.68 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 34.47 2dbc h VAL 119 CO -0.30 0.62 0.00 0.61 0.02 0.00 0.00 177.57 178.51 2dbc n GLY 120 N 0.46 1.11 0.08 2.17 0.00 0.51 -4.93 105.19 104.60 2dbc n GLY 120 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.08 -4.43 4.61 0.00 -1.12 -3.48 119.26 114.77 2dbc h ALA 121 Ca 0.00 -0.26 -0.35 0.00 0.00 0.00 0.00 54.91 54.30 2dbc h ALA 121 Cb 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 2dbc h ALA 121 CO 0.00 -0.27 -0.28 0.44 0.00 0.00 0.00 179.25 179.14 2dbc n ILE 122 N -4.87 0.00 -3.93 0.00 -5.35 -1.09 -4.70 119.36 99.42 2dbc n ILE 122 Ca -0.09 -1.44 -0.30 0.00 -0.27 0.00 0.00 62.75 60.65 2dbc n ILE 122 Cb 0.27 0.46 -0.14 0.00 -1.74 0.00 0.00 39.64 38.49 2dbc n ILE 122 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2dbc s GLN 123 N -2.98 1.52 0.14 6.28 1.11 -1.26 -4.14 119.66 120.33 2dbc s GLN 123 Ca 0.10 -2.02 -0.04 0.00 0.01 0.00 0.00 55.36 53.41 2dbc s GLN 123 Cb 0.00 -3.01 -0.05 0.00 -1.01 0.00 0.00 33.01 28.95 2dbc s GLN 123 CO 0.07 -1.02 0.37 0.45 0.01 0.00 0.00 175.29 175.17 2dbc s SER 124 N 0.57 6.47 0.19 5.90 0.15 -1.26 -5.01 113.70 120.71 2dbc s SER 124 Ca 0.13 0.54 -0.13 0.00 0.70 0.00 0.00 55.95 57.20 2dbc s SER 124 Cb -0.21 -2.07 0.18 0.00 -1.71 0.00 0.00 66.02 62.21 2dbc s SER 124 CO -0.07 0.05 1.74 0.44 1.20 0.00 0.00 173.24 176.59 2dbc h ASP 125 N 2.74 0.11 -1.01 5.45 3.32 -1.97 -3.41 116.42 121.65 2dbc h ASP 125 Ca -0.46 0.07 -0.66 0.00 0.02 0.00 0.00 57.03 56.00 2dbc h ASP 125 Cb 1.17 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 2dbc h ASP 125 CO 0.72 0.09 1.43 0.18 -1.72 0.00 0.00 179.24 179.94 2dbc n LEU 126 N -5.05 2.00 -3.29 1.55 4.77 -1.26 -4.78 117.00 110.94 2dbc n LEU 126 Ca 0.05 0.39 -0.39 0.00 -0.03 0.00 0.00 56.01 56.03 2dbc n LEU 126 Cb 0.22 -1.24 -0.04 0.00 -2.33 0.00 0.00 43.42 40.03 2dbc n LEU 126 CO 0.23 -0.76 0.19 -0.62 -1.33 0.00 0.00 177.39 175.10 2dbc n GLU 127 N 8.20 0.00 -3.20 3.23 1.02 -1.26 -4.89 120.64 123.73 2dbc n GLU 127 Ca 0.43 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 57.25 2dbc n GLU 127 Cb 0.22 -0.91 -0.06 0.00 -0.02 0.00 0.00 31.44 30.67 2dbc n GLU 127 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2dbc s GLU 128 N -0.40 3.93 -1.32 3.49 -1.05 -1.26 -4.13 118.70 117.96 2dbc s GLU 128 Ca 0.57 0.53 -0.07 0.00 -0.15 0.00 0.00 54.97 55.86 2dbc s GLU 128 Cb -0.81 -2.49 0.01 0.00 -0.44 0.00 0.00 34.13 30.40 2dbc s GLU 128 CO 0.42 0.19 1.13 0.09 0.95 0.00 0.00 175.26 178.04 2dbc n ASN 129 N -0.37 -5.19 -0.07 0.83 4.13 -1.26 -4.94 115.26 108.38 2dbc n ASN 129 Ca 0.03 -0.57 -0.09 0.00 1.68 0.00 0.00 54.58 55.63 2dbc n ASN 129 Cb 0.53 -5.04 -0.05 0.00 -1.54 0.00 0.00 39.78 33.68 2dbc n ASN 129 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 2dbc h SER 130 N -2.49 0.00 -3.09 6.41 0.87 -1.96 -3.46 113.55 109.83 2dbc h SER 130 Ca -0.58 -0.24 -0.53 0.00 -1.23 0.00 0.00 61.79 59.21 2dbc h SER 130 Cb 1.36 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 63.40 2dbc h SER 130 CO 0.55 0.91 0.94 -0.83 -0.53 0.00 0.00 176.83 177.86 2dbc s GLY 131 N -4.23 1.78 0.00 5.77 0.00 -1.26 -4.86 107.32 104.52 2dbc s GLY 131 Ca -0.15 1.60 0.15 0.00 0.00 0.00 0.00 44.72 46.31 2dbc s GLY 131 CO 0.32 2.69 1.41 -1.55 0.00 0.00 0.00 173.10 175.96 2dbc n PRO 132 N 2.80 0.18 -3.20 2.90 -0.04 -1.26 -4.64 135.00 131.75 2dbc n PRO 132 Ca 0.11 0.16 -0.40 0.00 -0.04 0.00 0.00 63.50 63.33 2dbc n PRO 132 Cb 0.36 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 2dbc n PRO 132 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dbc s SER 133 N -2.63 6.44 -0.43 3.54 1.04 -1.26 -4.99 113.70 115.42 2dbc s SER 133 Ca 0.13 0.44 -0.31 0.00 0.48 0.00 0.00 55.95 56.69 2dbc s SER 133 Cb 0.10 -2.29 -0.10 0.00 0.10 0.00 0.00 66.02 63.82 2dbc s SER 133 CO 0.23 -0.36 2.32 -0.24 0.98 0.00 0.00 173.24 176.16 2dbc n SER 134 N 5.66 2.21 0.00 7.02 2.88 -1.26 -5.08 113.62 125.04 2dbc n SER 134 Ca -0.03 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2dbc n SER 134 Cb 0.49 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 2dbc n SER 134 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42