#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgq s SER 32 N 0.00 -0.33 0.24 1.61 0.15 -1.26 -5.13 113.70 108.97 2dgq s SER 32 Ca 0.00 0.62 -0.30 0.00 0.70 0.00 0.00 55.95 56.97 2dgq s SER 32 Cb 0.00 0.53 -0.15 0.00 -1.71 0.00 0.00 66.02 64.70 2dgq s SER 32 CO 0.00 -0.16 1.04 -1.54 1.20 0.00 0.00 173.24 173.79 2dgq n SER 33 N 3.91 1.17 0.00 5.45 3.41 -1.26 -4.89 113.62 121.42 2dgq n SER 33 Ca -0.22 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 2dgq n SER 33 Cb 0.55 -1.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 2dgq n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dgq n GLY 34 N 1.61 -0.90 3.21 5.00 0.00 -1.26 -5.15 105.19 107.70 2dgq n GLY 34 Ca 0.12 0.45 -0.42 0.00 0.00 0.00 0.00 46.02 46.17 2dgq n GLY 34 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dgq n SER 35 N 0.00 -2.44 -4.04 1.61 2.88 -1.26 -4.98 113.62 105.39 2dgq n SER 35 Ca 0.00 0.85 -0.09 0.00 -1.33 0.00 0.00 58.87 58.31 2dgq n SER 35 Cb 0.00 -0.87 -0.11 0.00 -0.75 0.00 0.00 64.21 62.49 2dgq n SER 35 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dgq s SER 36 N -0.97 0.45 0.00 -3.46 0.01 -1.26 -5.16 113.70 103.30 2dgq s SER 36 Ca 0.58 -0.71 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2dgq s SER 36 Cb -0.68 0.13 0.00 0.00 0.21 0.00 0.00 66.02 65.68 2dgq s SER 36 CO 0.59 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 174.45 2dgq n GLY 37 N 0.96 1.14 3.28 3.44 0.00 -1.26 -4.96 105.19 107.78 2dgq n GLY 37 Ca -0.20 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.01 2dgq n GLY 37 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dgq n VAL 38 N 0.00 1.11 -2.25 1.61 0.24 -1.26 -4.86 118.33 112.91 2dgq n VAL 38 Ca 0.00 -0.49 -0.39 0.00 -2.04 0.00 0.00 64.34 61.42 2dgq n VAL 38 Cb 0.00 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 2dgq n VAL 38 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2dgq s PRO 39 N -0.98 4.06 -0.03 7.34 0.04 -1.26 -5.05 135.00 139.12 2dgq s PRO 39 Ca 0.60 1.90 0.06 0.00 0.04 0.00 0.00 61.00 63.60 2dgq s PRO 39 Cb -0.73 -2.72 -0.01 0.00 0.04 0.00 0.00 34.50 31.08 2dgq s PRO 39 CO 0.59 -0.33 -0.22 -1.64 0.04 0.00 0.00 177.00 175.45 2dgq s MET 40 N -2.25 1.94 0.26 4.56 -1.94 -1.26 -5.13 119.30 115.48 2dgq s MET 40 Ca 0.56 -0.79 0.01 0.00 -1.71 0.00 0.00 55.69 53.76 2dgq s MET 40 Cb -0.32 -1.80 0.01 0.00 2.01 0.00 0.00 34.83 34.72 2dgq s MET 40 CO 0.41 0.43 0.05 0.36 -0.01 0.00 0.00 175.02 176.26 2dgq n LYS 41 N 2.69 1.31 -4.25 2.03 0.00 -1.26 -4.57 118.16 114.11 2dgq n LYS 41 Ca -0.16 -1.81 -0.31 0.00 -0.00 0.00 0.00 58.31 56.02 2dgq n LYS 41 Cb 0.52 0.42 -0.09 0.00 -0.00 0.00 0.00 35.03 35.88 2dgq n LYS 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2dgq s ASP 42 N -2.45 4.98 0.27 -5.58 1.11 -0.43 -4.96 116.67 109.61 2dgq s ASP 42 Ca 0.04 -0.10 -0.01 0.00 0.18 0.00 0.00 52.55 52.65 2dgq s ASP 42 Cb -0.00 -1.23 0.49 0.00 1.07 0.00 0.00 42.92 43.25 2dgq s ASP 42 CO 0.02 0.24 1.84 1.12 1.18 0.00 0.00 175.17 179.57 2dgq h HIS 43 N 4.00 1.08 -0.91 4.23 2.07 -2.01 -1.51 115.15 122.10 2dgq h HIS 43 Ca -0.48 0.03 -0.62 0.00 -2.85 0.00 0.00 60.37 56.44 2dgq h HIS 43 Cb 1.17 -0.34 -0.33 0.00 2.57 0.00 0.00 27.41 30.48 2dgq h HIS 43 CO 0.60 0.45 0.35 -3.47 -3.07 0.00 0.00 177.93 172.80 2dgq n ASP 44 N -4.63 6.66 -3.72 3.10 2.03 -1.26 -5.02 116.55 113.71 2dgq n ASP 44 Ca 0.17 -3.77 -0.30 0.00 0.52 0.00 0.00 54.79 51.40 2dgq n ASP 44 Cb 0.31 -0.78 0.25 0.00 -0.72 0.00 0.00 41.12 40.18 2dgq n ASP 44 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dgq s ALA 45 N -3.73 0.37 0.03 -1.67 0.00 -0.57 -4.78 121.76 111.40 2dgq s ALA 45 Ca 0.60 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.62 2dgq s ALA 45 Cb 0.48 -2.89 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 2dgq s ALA 45 CO 0.01 -3.79 -0.05 0.42 0.00 0.00 0.00 175.76 172.35 2dgq s ILE 46 N -2.89 0.31 -0.30 0.00 1.01 -1.26 -4.99 121.20 113.08 2dgq s ILE 46 Ca 0.71 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 2dgq s ILE 46 Cb -0.10 -0.40 0.01 0.00 0.01 0.00 0.00 42.46 41.98 2dgq s ILE 46 CO 0.56 -0.34 0.10 -0.75 0.00 0.00 0.00 174.94 174.51 2dgq s LYS 47 N -1.25 3.10 -0.25 2.79 2.20 -1.26 -4.00 119.74 121.08 2dgq s LYS 47 Ca -0.10 -0.86 -0.20 0.00 -0.36 0.00 0.00 55.97 54.45 2dgq s LYS 47 Cb -0.08 -3.44 -0.02 0.00 -1.51 0.00 0.00 37.83 32.78 2dgq s LYS 47 CO -0.00 -0.46 0.62 -0.51 -0.36 0.00 0.00 175.35 174.63 2dgq s LEU 48 N 1.52 4.07 -0.18 5.43 1.43 -0.10 -0.02 118.68 130.83 2dgq s LEU 48 Ca 0.03 0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 53.75 2dgq s LEU 48 Cb -0.17 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 2dgq s LEU 48 CO 0.03 -0.35 0.09 0.12 0.23 0.00 0.00 176.35 176.47 2dgq s PHE 49 N 2.41 3.34 -0.11 0.29 5.36 0.64 -0.89 117.98 129.01 2dgq s PHE 49 Ca 0.26 0.21 -0.03 0.00 -0.96 0.00 0.00 56.93 56.41 2dgq s PHE 49 Cb -0.16 -2.07 -0.03 0.00 -0.34 0.00 0.00 43.02 40.42 2dgq s PHE 49 CO 0.09 0.28 0.02 0.08 -1.46 0.00 0.00 175.22 174.23 2dgq s VAL 50 N 0.14 4.44 -0.11 3.12 1.01 -0.60 -2.02 120.40 126.38 2dgq s VAL 50 Ca 0.07 -0.19 0.16 0.00 0.00 0.00 0.00 61.98 62.02 2dgq s VAL 50 Cb -0.12 -2.90 0.38 0.00 0.00 0.00 0.00 36.38 33.73 2dgq s VAL 50 CO -0.00 0.57 1.18 0.61 0.00 0.00 0.00 175.10 177.45 2dgq n GLY 51 N 2.54 3.21 2.57 4.51 0.00 -0.92 -1.90 105.19 115.20 2dgq n GLY 51 Ca -0.18 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 2dgq n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dgq n GLN 52 N -0.46 2.28 -3.53 1.61 1.13 -1.25 -4.85 117.38 112.31 2dgq n GLN 52 Ca 0.12 -3.72 -0.40 0.00 -1.94 0.00 0.00 57.00 51.06 2dgq n GLN 52 Cb 0.86 -1.79 -0.11 0.00 0.11 0.00 0.00 30.24 29.31 2dgq n GLN 52 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2dgq s ILE 53 N -4.05 5.29 0.16 5.09 1.01 -1.24 -4.81 121.20 122.65 2dgq s ILE 53 Ca 0.35 -0.17 -0.03 0.00 0.00 0.00 0.00 60.65 60.80 2dgq s ILE 53 Cb 0.37 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 39.18 2dgq s ILE 53 CO -0.02 0.01 0.14 -0.81 0.00 0.00 0.00 174.94 174.27 2dgq n PRO 54 N 5.11 -1.30 -3.66 2.79 -0.04 -1.26 -4.49 135.00 132.14 2dgq n PRO 54 Ca -0.13 -0.23 -0.38 0.00 -0.04 0.00 0.00 63.50 62.73 2dgq n PRO 54 Cb 0.50 -0.22 -0.12 0.00 -0.04 0.00 0.00 33.50 33.63 2dgq n PRO 54 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dgq s ARG 55 N -3.33 3.71 0.00 0.54 1.81 -1.26 -4.43 118.95 116.00 2dgq s ARG 55 Ca 0.09 -0.46 0.00 0.00 -1.72 0.00 0.00 55.73 53.64 2dgq s ARG 55 Cb -0.01 -3.52 0.00 0.00 -0.45 0.00 0.00 34.95 30.98 2dgq s ARG 55 CO 0.07 -0.23 0.00 0.41 -0.68 0.00 0.00 175.30 174.87 2dgq n GLY 56 N 4.99 1.41 3.94 -3.53 0.00 -1.26 -5.13 105.19 105.62 2dgq n GLY 56 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 2dgq n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dgq s LEU 57 N 0.00 4.30 0.00 0.99 1.43 -1.26 -5.10 118.68 119.04 2dgq s LEU 57 Ca 0.00 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 2dgq s LEU 57 Cb 0.00 -2.86 -0.01 0.00 0.03 0.00 0.00 46.19 43.35 2dgq s LEU 57 CO 0.00 0.01 0.10 0.47 0.23 0.00 0.00 176.35 177.16 2dgq n ASP 58 N -0.83 0.55 0.32 2.29 8.00 -1.26 -4.98 116.55 120.65 2dgq n ASP 58 Ca -0.08 -2.14 0.19 0.00 0.71 0.00 0.00 54.79 53.48 2dgq n ASP 58 Cb 0.55 0.66 1.03 0.00 -0.02 0.00 0.00 41.12 43.35 2dgq n ASP 58 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2dgq h GLU 59 N 0.00 0.00 0.00 -1.24 5.08 -1.98 0.40 114.58 116.84 2dgq h GLU 59 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2dgq h GLU 59 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2dgq h GLU 59 CO 0.23 0.00 -0.06 1.96 -1.00 0.00 0.00 179.01 180.14 2dgq h GLN 60 N 0.00 0.00 0.00 2.33 4.20 -2.00 -2.14 115.11 117.50 2dgq h GLN 60 Ca 0.01 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 2dgq h GLN 60 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 2dgq h GLN 60 CO -0.00 0.00 -1.84 -0.25 -0.67 0.00 0.00 178.83 176.07 2dgq n ASP 61 N -2.44 0.82 -0.00 1.46 8.00 0.13 -4.47 116.55 120.04 2dgq n ASP 61 Ca 0.05 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.40 2dgq n ASP 61 Cb 0.45 1.82 -0.14 0.00 -0.02 0.00 0.00 41.12 43.24 2dgq n ASP 61 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2dgq h LEU 62 N 0.00 0.23 -0.73 0.64 3.38 -1.27 -3.37 115.31 114.20 2dgq h LEU 62 Ca -0.01 -0.50 0.16 0.00 0.09 0.00 0.00 57.88 57.62 2dgq h LEU 62 Cb 0.86 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 2dgq h LEU 62 CO 0.00 1.45 0.10 0.50 0.09 0.00 0.00 178.44 180.58 2dgq h LYS 63 N 0.04 0.18 -0.69 1.13 3.64 -1.60 -0.93 116.57 118.34 2dgq h LYS 63 Ca -0.35 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.17 2dgq h LYS 63 Cb 2.02 -0.04 -0.12 0.00 -0.41 0.00 0.00 32.23 33.69 2dgq h LYS 63 CO 0.09 0.12 0.02 -1.35 -2.27 0.00 0.00 179.45 176.06 2dgq h PRO 64 N 0.19 0.12 0.66 1.90 0.11 -1.80 0.69 132.00 133.87 2dgq h PRO 64 Ca 0.40 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.48 2dgq h PRO 64 Cb 0.70 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.79 2dgq h PRO 64 CO -0.57 0.08 -0.32 -0.07 -0.21 0.00 0.00 178.00 176.92 2dgq h LEU 65 N 0.13 -0.75 -2.21 2.35 3.38 -1.40 -2.95 115.31 113.86 2dgq h LEU 65 Ca 0.37 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.40 2dgq h LEU 65 Cb 0.64 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2dgq h LEU 65 CO -0.59 -0.38 0.22 -0.26 0.09 0.00 0.00 178.44 177.52 2dgq h PHE 66 N -1.18 0.00 0.00 1.13 0.04 -1.04 0.42 116.94 116.31 2dgq h PHE 66 Ca -0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.68 2dgq h PHE 66 Cb 0.71 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.86 2dgq h PHE 66 CO 0.00 0.00 0.00 0.39 -0.60 0.00 0.00 178.31 178.10 2dgq n GLU 67 N -3.78 0.87 0.13 1.51 1.02 0.24 -2.81 120.64 117.81 2dgq n GLU 67 Ca 0.02 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.27 2dgq n GLU 67 Cb 0.35 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.31 2dgq n GLU 67 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dgq h GLU 68 N 0.00 0.00 0.00 3.49 5.08 -0.10 -3.39 114.58 119.66 2dgq h GLU 68 Ca 0.00 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.96 2dgq h GLU 68 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 2dgq h GLU 68 CO 0.00 0.03 -2.31 1.19 -1.00 0.00 0.00 179.01 176.93 2dgq n PHE 69 N -2.82 0.00 -3.83 4.33 3.01 -1.12 -5.09 117.46 111.93 2dgq n PHE 69 Ca 0.01 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.39 2dgq n PHE 69 Cb 0.57 -0.86 -0.02 0.00 -0.01 0.00 0.00 39.48 39.16 2dgq n PHE 69 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2dgq s GLY 70 N -5.42 -0.13 0.02 1.37 0.00 -1.14 -4.96 107.32 97.06 2dgq s GLY 70 Ca -0.34 -0.24 -0.30 0.00 0.00 0.00 0.00 44.72 43.83 2dgq s GLY 70 CO 0.43 -0.07 1.33 -1.60 0.00 0.00 0.00 173.10 173.19 2dgq s ARG 71 N -3.89 4.33 0.77 2.90 3.52 -1.26 -4.13 118.95 121.19 2dgq s ARG 71 Ca 0.10 1.90 -0.11 0.00 -0.13 0.00 0.00 55.73 57.49 2dgq s ARG 71 Cb -0.06 -3.47 0.06 0.00 -1.56 0.00 0.00 34.95 29.92 2dgq s ARG 71 CO 0.06 -0.47 1.08 0.42 -0.81 0.00 0.00 175.30 175.58 2dgq s ILE 72 N 1.90 3.39 -0.07 4.11 1.01 -1.26 -3.18 121.20 127.10 2dgq s ILE 72 Ca 0.62 0.45 -0.00 0.00 0.00 0.00 0.00 60.65 61.72 2dgq s ILE 72 Cb -0.31 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.09 2dgq s ILE 72 CO 0.27 -0.59 -0.06 0.00 0.00 0.00 0.00 174.94 174.55 2dgq n TYR 73 N -3.46 0.00 -3.47 3.97 4.19 0.11 -4.66 117.16 113.84 2dgq n TYR 73 Ca 0.08 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.30 2dgq n TYR 73 Cb 0.54 -0.25 -0.03 0.00 0.49 0.00 0.00 39.34 40.08 2dgq n TYR 73 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 2dgq s GLU 74 N -2.13 0.48 -0.07 2.98 2.12 -1.11 -4.94 118.70 116.02 2dgq s GLU 74 Ca -0.09 1.13 0.03 0.00 0.36 0.00 0.00 54.97 56.40 2dgq s GLU 74 Cb 0.02 0.67 -0.02 0.00 0.26 0.00 0.00 34.13 35.07 2dgq s GLU 74 CO 0.15 -0.25 -0.16 -1.17 -0.54 0.00 0.00 175.26 173.29 2dgq s LEU 75 N 2.78 2.59 -0.14 2.70 2.96 -1.26 -1.29 118.68 127.03 2dgq s LEU 75 Ca -0.00 -0.30 -0.11 0.00 -0.22 0.00 0.00 54.13 53.50 2dgq s LEU 75 Cb -0.11 -1.53 0.04 0.00 0.50 0.00 0.00 46.19 45.09 2dgq s LEU 75 CO -0.18 0.28 0.35 -0.89 -1.32 0.00 0.00 176.35 174.58 2dgq s THR 76 N -0.32 -0.01 -0.13 3.68 2.01 -0.76 -5.02 115.64 115.10 2dgq s THR 76 Ca 0.02 0.03 -0.07 0.00 0.31 0.00 0.00 61.69 61.98 2dgq s THR 76 Cb -0.13 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 2dgq s THR 76 CO 0.02 0.01 0.13 -0.69 -0.69 0.00 0.00 174.62 173.41 2dgq s VAL 77 N 0.51 5.41 0.04 3.82 1.01 -1.26 0.42 120.40 130.35 2dgq s VAL 77 Ca -0.03 0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 2dgq s VAL 77 Cb -0.04 -3.36 -0.06 0.00 0.00 0.00 0.00 36.38 32.91 2dgq s VAL 77 CO -0.03 0.60 0.45 -0.76 0.00 0.00 0.00 175.10 175.35 2dgq s LEU 78 N -0.85 4.44 0.07 3.92 1.43 -0.70 -4.95 118.68 122.04 2dgq s LEU 78 Ca 0.14 0.98 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2dgq s LEU 78 Cb -0.12 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 2dgq s LEU 78 CO 0.03 0.26 -0.04 -0.54 0.23 0.00 0.00 176.35 176.29 2dgq s LYS 79 N -1.36 0.70 1.40 1.70 1.02 -1.26 -3.27 119.74 118.67 2dgq s LYS 79 Ca 0.28 -1.27 -0.22 0.00 0.02 0.00 0.00 55.97 54.78 2dgq s LYS 79 Cb -0.16 0.04 0.35 0.00 -0.52 0.00 0.00 37.83 37.54 2dgq s LYS 79 CO 0.16 -0.07 0.80 -0.25 -0.92 0.00 0.00 175.35 175.07 2dgq n ASP 80 N 0.05 -3.93 -0.01 2.83 8.00 -1.11 -4.85 116.55 117.53 2dgq n ASP 80 Ca -0.13 -0.77 -0.05 0.00 0.71 0.00 0.00 54.79 54.55 2dgq n ASP 80 Cb 0.61 -0.98 -0.02 0.00 -0.02 0.00 0.00 41.12 40.72 2dgq n ASP 80 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dgq n ARG 81 N -5.16 0.13 -0.30 -1.24 1.74 -1.26 -3.65 116.66 106.92 2dgq n ARG 81 Ca 0.12 0.05 -0.05 0.00 -0.77 0.00 0.00 57.85 57.21 2dgq n ARG 81 Cb 0.56 -0.72 0.07 0.00 -1.02 0.00 0.00 32.46 31.34 2dgq n ARG 81 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2dgq h LEU 82 N -0.23 1.06 0.00 0.55 3.38 -2.01 -3.33 115.31 114.73 2dgq h LEU 82 Ca -0.08 -0.13 -0.33 0.00 0.09 0.00 0.00 57.88 57.42 2dgq h LEU 82 Cb 0.70 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 2dgq h LEU 82 CO -0.05 0.89 -2.21 0.35 0.09 0.00 0.00 178.44 177.51 2dgq n THR 83 N -4.35 1.21 -1.63 0.22 -2.24 -1.26 -5.03 114.28 101.20 2dgq n THR 83 Ca 0.08 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2dgq n THR 83 Cb 0.13 -1.41 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 2dgq n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dgq n GLY 84 N 2.22 0.56 3.78 3.38 0.00 -1.24 -4.99 105.19 108.91 2dgq n GLY 84 Ca -0.39 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.47 2dgq n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dgq s LEU 85 N 0.00 4.28 -0.42 0.99 1.43 -1.26 -4.57 118.68 119.13 2dgq s LEU 85 Ca 0.00 0.37 -0.34 0.00 -1.03 0.00 0.00 54.13 53.13 2dgq s LEU 85 Cb 0.00 -2.14 -0.15 0.00 0.03 0.00 0.00 46.19 43.93 2dgq s LEU 85 CO 0.00 0.25 1.71 1.57 0.23 0.00 0.00 176.35 180.11 2dgq n HIS 86 N 2.97 0.88 -0.17 0.29 -0.00 -1.26 -2.76 115.22 115.16 2dgq n HIS 86 Ca -0.17 0.59 -0.07 0.00 -0.00 0.00 0.00 57.72 58.07 2dgq n HIS 86 Cb 0.53 -1.81 0.09 0.00 -0.00 0.00 0.00 29.99 28.80 2dgq n HIS 86 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 2dgq h LYS 87 N 7.23 0.96 0.00 1.57 1.57 -1.88 -3.47 116.57 122.56 2dgq h LYS 87 Ca -0.08 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2dgq h LYS 87 Cb 1.11 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2dgq h LYS 87 CO 0.87 0.93 0.00 0.41 -0.57 0.00 0.00 179.45 181.10 2dgq n GLY 88 N -0.55 1.23 3.50 3.86 0.00 -1.26 -5.06 105.19 106.91 2dgq n GLY 88 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 2dgq n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dgq s ALA 90 N -3.83 -1.71 -0.37 0.00 0.00 -0.80 -1.72 121.76 113.34 2dgq s ALA 90 Ca 0.06 1.53 -0.16 0.00 0.00 0.00 0.00 51.96 53.39 2dgq s ALA 90 Cb -0.01 -0.45 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 2dgq s ALA 90 CO -0.06 -0.35 0.40 -0.06 0.00 0.00 0.00 175.76 175.69 2dgq s PHE 91 N -0.57 3.19 -0.19 0.00 0.08 0.17 -1.56 117.98 119.10 2dgq s PHE 91 Ca -0.07 -0.11 -0.06 0.00 0.12 0.00 0.00 56.93 56.81 2dgq s PHE 91 Cb -0.02 -2.77 -0.03 0.00 -0.57 0.00 0.00 43.02 39.63 2dgq s PHE 91 CO 0.06 -0.53 0.03 -1.17 -0.10 0.00 0.00 175.22 173.51 2dgq s LEU 92 N 2.10 3.52 -0.14 -0.37 2.96 -0.07 -1.83 118.68 124.85 2dgq s LEU 92 Ca 0.13 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 2dgq s LEU 92 Cb -0.17 -1.89 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2dgq s LEU 92 CO 0.12 0.13 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.25 2dgq s THR 93 N 0.64 2.87 0.08 3.68 2.01 -0.41 -0.93 115.64 123.59 2dgq s THR 93 Ca 0.01 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.31 2dgq s THR 93 Cb -0.14 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 2dgq s THR 93 CO 0.02 0.52 0.20 -0.31 -0.69 0.00 0.00 174.62 174.35 2dgq s TYR 94 N 0.57 3.44 0.07 4.92 2.02 -1.26 0.10 117.35 127.22 2dgq s TYR 94 Ca -0.09 0.19 -0.20 0.00 -0.37 0.00 0.00 57.07 56.60 2dgq s TYR 94 Cb -0.16 -1.71 -0.10 0.00 -0.40 0.00 0.00 41.96 39.59 2dgq s TYR 94 CO 0.03 0.56 1.54 0.00 -1.57 0.00 0.00 175.55 176.12 2dgq s ALA 96 N -5.18 3.52 0.10 0.00 0.00 -1.26 -1.32 121.76 117.62 2dgq s ALA 96 Ca -0.14 -1.50 -0.13 0.00 0.00 0.00 0.00 51.96 50.19 2dgq s ALA 96 Cb 0.07 -1.17 -0.16 0.00 0.00 0.00 0.00 23.12 21.85 2dgq s ALA 96 CO 0.72 0.22 1.29 0.07 0.00 0.00 0.00 175.76 178.07 2dgq h ARG 97 N 1.55 0.79 0.72 0.00 0.11 -1.86 -3.29 114.38 112.39 2dgq h ARG 97 Ca -0.47 -0.66 -0.03 0.00 0.10 0.00 0.00 59.98 58.91 2dgq h ARG 97 Cb 1.24 0.14 0.00 0.00 1.11 0.00 0.00 29.97 32.47 2dgq h ARG 97 CO 0.60 1.26 -0.36 0.38 0.10 0.00 0.00 179.97 181.96 2dgq h ASP 98 N 0.53 -0.87 -1.04 0.08 3.04 -1.96 -2.39 116.42 113.81 2dgq h ASP 98 Ca -0.06 0.04 0.41 0.00 -3.24 0.00 0.00 57.03 54.18 2dgq h ASP 98 Cb 1.43 0.23 -0.17 0.00 -1.04 0.00 0.00 39.33 39.79 2dgq h ASP 98 CO 0.16 -0.60 0.58 0.28 -2.04 0.00 0.00 179.24 177.62 2dgq h SER 99 N -0.99 0.34 0.02 4.15 0.02 -1.94 0.49 113.55 115.65 2dgq h SER 99 Ca -0.10 0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2dgq h SER 99 Cb 0.77 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2dgq h SER 99 CO 0.15 -0.37 -0.01 0.00 -1.14 0.00 0.00 176.83 175.46 2dgq h ALA 100 N 1.93 -0.03 -0.71 3.77 0.00 -1.53 -2.60 119.26 120.10 2dgq h ALA 100 Ca 0.83 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 55.65 2dgq h ALA 100 Cb 2.22 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.94 2dgq h ALA 100 CO -0.71 -0.31 0.31 -0.07 0.00 0.00 0.00 179.25 178.47 2dgq h LEU 101 N -0.45 0.35 0.00 0.00 3.38 0.40 0.33 115.31 119.33 2dgq h LEU 101 Ca -0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2dgq h LEU 101 Cb 0.43 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2dgq h LEU 101 CO 0.00 0.18 0.00 0.29 0.09 0.00 0.00 178.44 179.00 2dgq n LYS 102 N -4.94 0.00 -0.31 1.13 5.02 -0.35 -1.06 118.16 117.64 2dgq n LYS 102 Ca 0.12 0.47 0.13 0.00 -2.02 0.00 0.00 58.31 57.01 2dgq n LYS 102 Cb 0.33 -1.46 0.31 0.00 -0.02 0.00 0.00 35.03 34.19 2dgq n LYS 102 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dgq h ALA 103 N -2.00 1.48 0.44 7.82 0.00 -1.38 1.06 119.26 126.68 2dgq h ALA 103 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2dgq h ALA 103 Cb 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2dgq h ALA 103 CO 0.00 -0.31 -0.38 0.37 0.00 0.00 0.00 179.25 178.93 2dgq h GLN 104 N 0.45 -0.79 0.00 0.00 4.15 -0.28 1.80 115.11 120.44 2dgq h GLN 104 Ca 0.57 0.05 0.00 0.00 0.77 0.00 0.00 58.65 60.04 2dgq h GLN 104 Cb 1.05 0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.92 2dgq h GLN 104 CO -0.51 -0.53 0.00 0.43 -1.93 0.00 0.00 178.83 176.30 2dgq n SER 105 N -5.49 0.00 -0.01 -0.69 7.64 -0.23 0.02 113.62 114.87 2dgq n SER 105 Ca -0.11 0.48 0.10 0.00 1.01 0.00 0.00 58.87 60.36 2dgq n SER 105 Cb 0.39 -0.49 -0.15 0.00 -1.01 0.00 0.00 64.21 62.95 2dgq n SER 105 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dgq n ALA 106 N -1.49 3.77 -0.06 -0.43 0.00 0.36 -4.58 120.51 118.08 2dgq n ALA 106 Ca 0.06 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.84 2dgq n ALA 106 Cb 0.28 -0.76 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 2dgq n ALA 106 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dgq n LEU 107 N -1.88 2.19 -4.53 0.00 4.77 0.61 -4.40 117.00 113.75 2dgq n LEU 107 Ca -0.00 0.02 -0.34 0.00 -0.03 0.00 0.00 56.01 55.66 2dgq n LEU 107 Cb 0.45 -0.38 -0.10 0.00 -2.33 0.00 0.00 43.42 41.06 2dgq n LEU 107 CO 0.44 0.53 2.02 1.57 -1.33 0.00 0.00 177.39 180.62 2dgq n HIS 108 N -3.10 0.96 -2.55 -1.77 -0.00 0.10 0.30 115.22 109.16 2dgq n HIS 108 Ca -0.22 0.19 -0.11 0.00 0.46 0.00 0.00 57.72 58.04 2dgq n HIS 108 Cb 0.70 -2.35 0.01 0.00 -0.12 0.00 0.00 29.99 28.23 2dgq n HIS 108 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2dgq n GLU 109 N 8.49 -2.16 0.00 1.57 1.02 0.62 -4.90 120.64 125.28 2dgq n GLU 109 Ca 0.51 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 58.14 2dgq n GLU 109 Cb 0.31 -4.47 0.00 0.00 -0.02 0.00 0.00 31.44 27.26 2dgq n GLU 109 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2dgq n GLN 110 N -2.35 0.00 -3.96 3.49 3.00 0.15 -4.98 117.38 112.72 2dgq n GLN 110 Ca -0.08 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.67 2dgq n GLN 110 Cb 0.57 -0.67 -0.03 0.00 0.00 0.00 0.00 30.24 30.11 2dgq n GLN 110 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2dgq s LYS 111 N -1.85 3.41 -0.30 -1.09 2.36 -1.13 -4.98 119.74 116.16 2dgq s LYS 111 Ca 0.00 -0.65 -0.02 0.00 -2.55 0.00 0.00 55.97 52.75 2dgq s LYS 111 Cb 0.00 -2.93 0.10 0.00 -1.05 0.00 0.00 37.83 33.95 2dgq s LYS 111 CO 0.00 0.50 0.10 0.99 1.55 0.00 0.00 175.35 178.49 2dgq s THR 112 N -1.80 0.61 0.75 3.43 2.01 -1.26 -0.66 115.64 118.72 2dgq s THR 112 Ca 0.34 -1.20 -0.15 0.00 0.31 0.00 0.00 61.69 60.98 2dgq s THR 112 Cb -0.10 -1.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.94 2dgq s THR 112 CO 0.28 -0.68 0.77 0.18 -0.69 0.00 0.00 174.62 174.49 2dgq n LEU 113 N 4.96 2.24 -4.62 4.42 4.77 -1.26 -4.86 117.00 122.65 2dgq n LEU 113 Ca -0.03 0.60 -0.43 0.00 -0.03 0.00 0.00 56.01 56.12 2dgq n LEU 113 Cb 0.42 -1.33 -0.03 0.00 -2.33 0.00 0.00 43.42 40.16 2dgq n LEU 113 CO 0.09 -2.56 1.40 -2.16 -1.33 0.00 0.00 177.39 172.83 2dgq s PRO 114 N -3.22 3.66 0.00 3.23 0.04 -1.26 -2.47 135.00 134.98 2dgq s PRO 114 Ca 0.69 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.26 2dgq s PRO 114 Cb -0.33 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.14 2dgq s PRO 114 CO 0.55 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 176.54 2dgq n GLY 115 N 4.89 1.01 2.92 0.56 0.00 -1.26 -5.02 105.19 108.29 2dgq n GLY 115 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2dgq n GLY 115 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dgq s MET 116 N -0.61 1.41 0.44 1.61 -1.94 -1.03 -4.97 119.30 114.21 2dgq s MET 116 Ca 0.00 -1.88 0.29 0.00 -1.71 0.00 0.00 55.69 52.40 2dgq s MET 116 Cb 0.00 -2.91 1.39 0.00 2.01 0.00 0.00 34.83 35.32 2dgq s MET 116 CO 0.00 -1.00 1.66 -0.91 -0.01 0.00 0.00 175.02 174.76 2dgq h ASN 117 N 7.41 0.25 -2.70 3.03 2.35 -1.97 -3.39 115.58 120.55 2dgq h ASN 117 Ca -0.06 0.11 -0.57 0.00 -0.55 0.00 0.00 56.30 55.23 2dgq h ASN 117 Cb 0.99 0.09 -0.04 0.00 0.05 0.00 0.00 38.32 39.41 2dgq h ASN 117 CO 0.54 -0.11 -0.49 0.00 -1.65 0.00 0.00 177.43 175.72 2dgq s ARG 118 N -5.29 3.37 0.87 0.81 3.03 -1.26 -5.11 118.95 115.37 2dgq s ARG 118 Ca -0.08 -0.58 -0.15 0.00 2.03 0.00 0.00 55.73 56.96 2dgq s ARG 118 Cb 0.28 -2.95 0.22 0.00 -1.03 0.00 0.00 34.95 31.47 2dgq s ARG 118 CO 0.82 0.55 0.77 -0.35 -1.13 0.00 0.00 175.30 175.96 2dgq n PRO 119 N -0.24 -2.53 -3.23 3.89 -0.04 -1.26 -4.60 135.00 126.98 2dgq n PRO 119 Ca -0.07 -1.23 -0.35 0.00 -0.04 0.00 0.00 63.50 61.81 2dgq n PRO 119 Cb 0.53 -1.15 -0.06 0.00 -0.04 0.00 0.00 33.50 32.78 2dgq n PRO 119 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2dgq s ILE 120 N -2.39 4.73 -0.19 0.52 2.07 0.17 -4.88 121.20 121.22 2dgq s ILE 120 Ca 0.50 1.00 0.01 0.00 -1.41 0.00 0.00 60.65 60.75 2dgq s ILE 120 Cb -0.05 -3.76 0.02 0.00 0.13 0.00 0.00 42.46 38.80 2dgq s ILE 120 CO 0.38 0.16 -0.18 -1.10 -1.91 0.00 0.00 174.94 172.29 2dgq s GLN 121 N -2.14 2.97 -0.04 3.50 -0.21 -1.26 -0.28 119.66 122.19 2dgq s GLN 121 Ca 0.42 -0.85 0.03 0.00 0.02 0.00 0.00 55.36 54.99 2dgq s GLN 121 Cb -0.15 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.25 2dgq s GLN 121 CO 0.20 -0.23 -0.14 0.08 -2.12 0.00 0.00 175.29 173.08 2dgq s VAL 122 N 1.29 1.18 0.01 1.09 1.01 -1.26 -2.15 120.40 121.56 2dgq s VAL 122 Ca 0.04 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 2dgq s VAL 122 Cb -0.14 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.21 2dgq s VAL 122 CO -0.12 0.35 0.13 -1.59 0.00 0.00 0.00 175.10 173.87 2dgq s LYS 123 N 0.22 0.51 -1.04 2.72 -2.85 -0.85 -4.68 119.74 113.77 2dgq s LYS 123 Ca -0.06 -0.48 -0.24 0.00 -1.00 0.00 0.00 55.97 54.19 2dgq s LYS 123 Cb -0.12 0.21 -0.07 0.00 -2.06 0.00 0.00 37.83 35.80 2dgq s LYS 123 CO 0.02 -0.13 1.94 -1.25 0.10 0.00 0.00 175.35 176.03 2dgq s PRO 124 N -1.68 2.53 0.35 1.78 0.04 -1.26 -0.26 135.00 136.50 2dgq s PRO 124 Ca -0.13 -0.71 -0.23 0.00 0.04 0.00 0.00 61.00 59.97 2dgq s PRO 124 Cb -0.06 -5.15 -0.15 0.00 0.04 0.00 0.00 34.50 29.18 2dgq s PRO 124 CO 0.00 -3.66 0.36 0.00 0.04 0.00 0.00 177.00 173.74 2dgq n ALA 125 N 14.16 -2.43 -3.64 8.56 0.00 0.97 -4.91 120.51 133.22 2dgq n ALA 125 Ca 0.42 0.22 -0.03 0.00 0.00 0.00 0.00 53.44 54.06 2dgq n ALA 125 Cb 0.47 -1.62 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 2dgq n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dgq s ALA 126 N -1.43 -2.26 -0.19 0.00 0.00 -1.26 -4.59 121.76 112.04 2dgq s ALA 126 Ca 0.61 2.18 -0.18 0.00 0.00 0.00 0.00 51.96 54.57 2dgq s ALA 126 Cb -0.70 -1.70 -0.14 0.00 0.00 0.00 0.00 23.12 20.58 2dgq s ALA 126 CO 0.60 -0.34 0.10 1.03 0.00 0.00 0.00 175.76 177.15 2dgq h SER 127 N 5.90 0.00 0.26 0.00 0.87 -2.03 -3.41 113.55 115.15 2dgq h SER 127 Ca -0.28 -0.36 -0.33 0.00 -1.23 0.00 0.00 61.79 59.59 2dgq h SER 127 Cb 1.19 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.09 2dgq h SER 127 CO 0.19 1.24 -2.02 -1.84 -0.53 0.00 0.00 176.83 173.87 2dgq n GLU 128 N -4.50 0.66 0.00 2.24 0.00 -1.26 -5.04 120.64 112.74 2dgq n GLU 128 Ca -0.24 0.16 0.00 0.00 0.00 0.00 0.00 57.16 57.08 2dgq n GLU 128 Cb 0.54 -1.67 0.00 0.00 0.00 0.00 0.00 31.44 30.31 2dgq n GLU 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dgq n GLY 129 N 1.65 3.16 3.40 -1.84 0.00 -1.26 -3.98 105.19 106.32 2dgq n GLY 129 Ca -0.24 -0.22 -0.45 0.00 0.00 0.00 0.00 46.02 45.10 2dgq n GLY 129 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2dgq s ARG 130 N 0.00 3.74 -0.03 1.61 3.00 -1.26 -5.00 118.95 121.02 2dgq s ARG 130 Ca 0.00 -2.30 0.05 0.00 -1.00 0.00 0.00 55.73 52.48 2dgq s ARG 130 Cb 0.00 -4.72 -0.01 0.00 0.00 0.00 0.00 34.95 30.22 2dgq s ARG 130 CO 0.00 -1.54 -0.17 0.20 0.00 0.00 0.00 175.30 173.80 2dgq s GLY 131 N 2.72 0.85 0.72 8.12 0.00 -1.26 -5.13 107.32 113.35 2dgq s GLY 131 Ca 0.29 -0.69 -0.16 0.00 0.00 0.00 0.00 44.72 44.15 2dgq s GLY 131 CO -0.08 -0.48 1.12 -1.84 0.00 0.00 0.00 173.10 171.82 2dgq n GLU 132 N 2.88 0.62 0.06 2.90 0.28 -1.26 -4.96 120.64 121.16 2dgq n GLU 132 Ca -0.16 0.27 -0.09 0.00 -0.16 0.00 0.00 57.16 57.02 2dgq n GLU 132 Cb 0.54 -2.37 -0.06 0.00 1.43 0.00 0.00 31.44 30.98 2dgq n GLU 132 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 177.13 177.74 2dgq h SER 133 N -0.16 -0.21 0.00 -1.84 0.02 -2.00 -3.49 113.55 105.87 2dgq h SER 133 Ca -0.48 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 2dgq h SER 133 Cb 1.33 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.92 2dgq h SER 133 CO 0.49 0.34 0.00 0.61 -1.14 0.00 0.00 176.83 177.12 2dgq n GLY 134 N 0.77 -1.78 3.77 -3.77 0.00 -1.26 -5.14 105.19 97.78 2dgq n GLY 134 Ca -0.07 0.61 -0.39 0.00 0.00 0.00 0.00 46.02 46.17 2dgq n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dgq s PRO 135 N 0.00 4.24 -0.77 1.61 0.04 -1.26 -4.88 135.00 133.98 2dgq s PRO 135 Ca 0.00 1.97 -0.26 0.00 0.04 0.00 0.00 61.00 62.75 2dgq s PRO 135 Cb 0.00 -2.89 -0.14 0.00 0.04 0.00 0.00 34.50 31.51 2dgq s PRO 135 CO 0.00 -0.19 2.42 0.45 0.04 0.00 0.00 177.00 179.71 2dgq s SER 136 N -0.87 3.89 0.09 6.66 0.15 -1.26 -4.85 113.70 117.52 2dgq s SER 136 Ca 0.52 0.11 -0.10 0.00 0.70 0.00 0.00 55.95 57.18 2dgq s SER 136 Cb -0.34 -2.55 0.01 0.00 -1.71 0.00 0.00 66.02 61.43 2dgq s SER 136 CO 0.44 -3.85 0.24 -0.44 1.20 0.00 0.00 173.24 170.83 2dgq s SER 137 N 10.99 0.03 0.00 5.45 0.01 -1.26 -5.24 113.70 123.69 2dgq s SER 137 Ca 0.93 -0.54 0.00 0.00 1.31 0.00 0.00 55.95 57.65 2dgq s SER 137 Cb -0.13 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.46 2dgq s SER 137 CO 0.09 -0.74 0.00 0.61 0.41 0.00 0.00 173.24 173.61