#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 0.25 -0.71 1.61 0.15 -1.26 -5.11 113.70 108.63 2dgq s SER 32 Ca 0.00 -1.16 -0.22 0.00 0.70 0.00 0.00 55.95 55.27 2dgq s SER 32 Cb 0.00 0.61 0.07 0.00 -1.71 0.00 0.00 66.02 64.99 2dgq s SER 32 CO 0.00 -1.20 1.03 -0.55 1.20 0.00 0.00 173.24 173.72 2dgq s SER 33 N -3.10 6.24 0.00 5.45 0.15 -1.26 -4.91 113.70 116.27 2dgq s SER 33 Ca 0.26 -1.10 0.00 0.00 0.70 0.00 0.00 55.95 55.81 2dgq s SER 33 Cb -0.00 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 2dgq s SER 33 CO 0.13 -1.43 0.00 0.61 1.20 0.00 0.00 173.24 173.75 2dgq n GLY 34 N 5.41 -1.29 3.62 9.45 0.00 -1.26 -5.16 105.19 115.95 2dgq n GLY 34 Ca 0.01 -0.95 -0.04 0.00 0.00 0.00 0.00 46.02 45.04 2dgq n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dgq s SER 35 N -3.99 -0.90 0.06 1.61 1.04 -1.26 -5.17 113.70 105.10 2dgq s SER 35 Ca 0.00 1.35 -0.02 0.00 0.48 0.00 0.00 55.95 57.75 2dgq s SER 35 Cb 0.00 1.66 -0.04 0.00 0.10 0.00 0.00 66.02 67.73 2dgq s SER 35 CO 0.00 -0.20 0.25 -0.44 0.98 0.00 0.00 173.24 173.83 2dgq s SER 36 N 2.05 6.41 0.00 7.02 0.01 -1.26 -5.07 113.70 122.85 2dgq s SER 36 Ca -0.08 0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2dgq s SER 36 Cb -0.07 -2.01 0.00 0.00 0.21 0.00 0.00 66.02 64.15 2dgq s SER 36 CO -0.19 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2dgq n GLY 37 N 0.42 1.87 3.50 3.44 0.00 -1.26 -5.13 105.19 108.03 2dgq n GLY 37 Ca -0.06 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.85 1.97 -2.14 1.61 0.24 -1.26 -4.85 118.33 113.05 2dgq n VAL 38 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 2dgq n VAL 38 Cb 0.00 -0.70 -0.03 0.00 -1.47 0.00 0.00 33.84 31.65 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 -1.60 4.13 -0.04 7.34 0.04 -1.26 -5.01 135.00 138.59 2dgq s PRO 39 Ca 0.62 1.95 -0.07 0.00 0.04 0.00 0.00 61.00 63.55 2dgq s PRO 39 Cb -0.64 -3.93 -0.04 0.00 0.04 0.00 0.00 34.50 29.92 2dgq s PRO 39 CO 0.58 -0.88 0.21 -1.64 0.04 0.00 0.00 177.00 175.31 2dgq s MET 40 N 4.00 3.52 0.22 4.56 -1.94 -1.26 -5.10 119.30 123.30 2dgq s MET 40 Ca 0.68 -0.11 0.02 0.00 -1.71 0.00 0.00 55.69 54.57 2dgq s MET 40 Cb -0.29 -3.13 -0.01 0.00 2.01 0.00 0.00 34.83 33.41 2dgq s MET 40 CO 0.25 0.71 0.08 0.36 -0.01 0.00 0.00 175.02 176.41 2dgq n LYS 41 N 1.45 0.74 -4.06 2.03 0.00 -1.26 -4.78 118.16 112.29 2dgq n LYS 41 Ca -0.15 -1.88 -0.35 0.00 -0.00 0.00 0.00 58.31 55.94 2dgq n LYS 41 Cb 0.54 1.02 -0.11 0.00 -0.00 0.00 0.00 35.03 36.48 2dgq n LYS 41 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2dgq s ASP 42 N -2.36 5.18 0.53 -5.58 -1.08 -0.67 -4.97 116.67 107.72 2dgq s ASP 42 Ca 0.11 -0.08 0.40 0.00 -0.52 0.00 0.00 52.55 52.46 2dgq s ASP 42 Cb 0.01 -1.89 1.58 0.00 -1.46 0.00 0.00 42.92 41.15 2dgq s ASP 42 CO 0.08 0.11 1.70 1.12 0.52 0.00 0.00 175.17 178.69 2dgq h HIS 43 N 7.19 0.11 -0.81 -5.34 2.07 -2.01 0.94 115.15 117.29 2dgq h HIS 43 Ca -0.35 0.00 -0.56 0.00 -2.85 0.00 0.00 60.37 56.61 2dgq h HIS 43 Cb 1.18 -0.03 -0.35 0.00 2.57 0.00 0.00 27.41 30.78 2dgq h HIS 43 CO 0.59 -0.02 -0.12 -3.47 -3.07 0.00 0.00 177.93 171.83 2dgq n ASP 44 N -4.18 5.72 -4.48 3.10 2.03 -1.26 -5.04 116.55 112.44 2dgq n ASP 44 Ca 0.34 -3.77 -0.29 0.00 0.52 0.00 0.00 54.79 51.59 2dgq n ASP 44 Cb 1.52 -0.61 0.18 0.00 -0.72 0.00 0.00 41.12 41.49 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 -3.65 1.29 0.07 -1.67 0.00 0.32 -4.74 121.76 113.39 2dgq s ALA 45 Ca 0.56 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.91 2dgq s ALA 45 Cb 0.45 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.54 2dgq s ALA 45 CO 0.02 -2.77 -0.11 0.42 0.00 0.00 0.00 175.76 173.32 2dgq s ILE 46 N -3.18 0.89 -0.41 0.00 1.01 -1.26 -5.01 121.20 113.24 2dgq s ILE 46 Ca 0.67 -1.39 -0.09 0.00 0.00 0.00 0.00 60.65 59.84 2dgq s ILE 46 Cb -0.14 -1.08 0.07 0.00 0.01 0.00 0.00 42.46 41.33 2dgq s ILE 46 CO 0.55 -0.41 0.23 -0.75 0.00 0.00 0.00 174.94 174.56 2dgq s LYS 47 N -2.16 2.58 0.22 2.79 2.20 -1.26 -3.88 119.74 120.23 2dgq s LYS 47 Ca -0.01 -1.43 -0.30 0.00 -0.36 0.00 0.00 55.97 53.87 2dgq s LYS 47 Cb -0.07 -3.73 -0.08 0.00 -1.51 0.00 0.00 37.83 32.44 2dgq s LYS 47 CO 0.01 -0.91 0.97 -0.51 -0.36 0.00 0.00 175.35 174.55 2dgq s LEU 48 N 1.41 4.60 -0.15 5.43 1.43 0.35 0.18 118.68 131.93 2dgq s LEU 48 Ca 0.03 1.97 0.01 0.00 -1.03 0.00 0.00 54.13 55.11 2dgq s LEU 48 Cb -0.22 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.41 2dgq s LEU 48 CO 0.02 0.06 -0.19 0.12 0.23 0.00 0.00 176.35 176.59 2dgq s PHE 49 N -0.92 2.52 -0.16 0.29 5.36 0.11 -0.49 117.98 124.69 2dgq s PHE 49 Ca 0.43 -1.39 -0.06 0.00 -0.96 0.00 0.00 56.93 54.95 2dgq s PHE 49 Cb -0.26 -1.76 -0.04 0.00 -0.34 0.00 0.00 43.02 40.62 2dgq s PHE 49 CO 0.33 -0.69 0.04 0.08 -1.46 0.00 0.00 175.22 173.52 2dgq s VAL 50 N 1.18 4.62 -0.23 3.12 1.01 -0.91 -1.92 120.40 127.26 2dgq s VAL 50 Ca 0.01 -0.10 0.10 0.00 0.00 0.00 0.00 61.98 61.99 2dgq s VAL 50 Cb -0.14 -3.05 0.44 0.00 0.00 0.00 0.00 36.38 33.63 2dgq s VAL 50 CO -0.08 0.50 1.20 0.61 0.00 0.00 0.00 175.10 177.33 2dgq n GLY 51 N 3.19 5.39 2.57 4.51 0.00 -0.88 -1.97 105.19 118.00 2dgq n GLY 51 Ca -0.17 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 43.94 2dgq n GLY 51 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2dgq n GLN 52 N -0.89 2.23 -3.75 1.61 -0.06 -1.25 -4.81 117.38 110.45 2dgq n GLN 52 Ca 0.28 -3.72 -0.38 0.00 -2.00 0.00 0.00 57.00 51.18 2dgq n GLN 52 Cb 0.82 -1.76 -0.12 0.00 -4.06 0.00 0.00 30.24 25.11 2dgq n GLN 52 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 2dgq s ILE 53 N -4.04 3.88 1.19 1.69 1.01 -1.24 -4.77 121.20 118.92 2dgq s ILE 53 Ca 0.35 -0.92 -0.19 0.00 0.00 0.00 0.00 60.65 59.90 2dgq s ILE 53 Cb 0.38 -3.10 0.28 0.00 0.01 0.00 0.00 42.46 40.03 2dgq s ILE 53 CO -0.02 -0.05 1.11 -2.16 0.00 0.00 0.00 174.94 173.81 2dgq s PRO 54 N 1.45 -1.12 0.05 2.79 0.04 -1.26 -4.15 135.00 132.81 2dgq s PRO 54 Ca 0.00 -0.03 -0.18 0.00 0.04 0.00 0.00 61.00 60.83 2dgq s PRO 54 Cb -0.18 -1.61 -0.06 0.00 0.04 0.00 0.00 34.50 32.69 2dgq s PRO 54 CO 0.03 -3.65 0.52 -0.98 0.04 0.00 0.00 177.00 172.96 2dgq s ARG 55 N -5.38 4.13 0.00 4.56 3.03 -1.26 -4.18 118.95 119.85 2dgq s ARG 55 Ca 0.71 0.65 0.00 0.00 2.03 0.00 0.00 55.73 59.11 2dgq s ARG 55 Cb -0.10 -3.24 0.00 0.00 -1.03 0.00 0.00 34.95 30.58 2dgq s ARG 55 CO 0.56 0.64 0.00 0.41 -1.13 0.00 0.00 175.30 175.78 2dgq n GLY 56 N 1.78 1.61 3.24 3.88 0.00 -1.26 -5.09 105.19 109.35 2dgq n GLY 56 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 2dgq n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dgq n LEU 57 N 0.00 0.00 0.00 0.99 4.77 -1.26 -5.12 117.00 116.38 2dgq n LEU 57 Ca 0.00 -2.07 -0.05 0.00 -0.03 0.00 0.00 56.01 53.85 2dgq n LEU 57 Cb 0.00 -0.35 0.02 0.00 -2.33 0.00 0.00 43.42 40.75 2dgq n LEU 57 CO 0.00 -0.68 0.35 0.47 -1.33 0.00 0.00 177.39 176.20 2dgq n ASP 58 N -2.45 -1.44 0.32 -1.43 9.92 -1.26 -4.99 116.55 115.21 2dgq n ASP 58 Ca 0.14 -1.98 0.14 0.00 -0.53 0.00 0.00 54.79 52.55 2dgq n ASP 58 Cb 0.50 2.40 0.70 0.00 -0.64 0.00 0.00 41.12 44.08 2dgq n ASP 58 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2dgq h GLU 59 N 0.00 0.00 -0.04 -1.24 3.07 -1.98 0.54 114.58 114.93 2dgq h GLU 59 Ca -0.21 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.51 2dgq h GLU 59 Cb 0.79 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.68 2dgq h GLU 59 CO 0.27 0.00 -0.61 -0.56 -1.40 0.00 0.00 179.01 176.71 2dgq h GLN 60 N 0.00 0.15 0.00 2.33 3.07 -1.99 0.28 115.11 118.95 2dgq h GLN 60 Ca 0.01 -0.10 0.00 0.00 0.09 0.00 0.00 58.65 58.65 2dgq h GLN 60 Cb 0.88 0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.46 2dgq h GLN 60 CO -0.00 0.71 -1.00 -3.47 0.09 0.00 0.00 178.83 175.16 2dgq n ASP 61 N -3.85 0.81 -0.02 0.06 2.03 0.18 -4.12 116.55 111.64 2dgq n ASP 61 Ca -0.02 0.29 -0.15 0.00 0.52 0.00 0.00 54.79 55.43 2dgq n ASP 61 Cb 0.62 0.48 -0.14 0.00 -0.72 0.00 0.00 41.12 41.35 2dgq n ASP 61 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dgq n LEU 62 N -2.60 1.75 -0.26 -2.67 4.77 -0.80 -4.26 117.00 112.92 2dgq n LEU 62 Ca 0.00 0.26 0.05 0.00 -0.03 0.00 0.00 56.01 56.29 2dgq n LEU 62 Cb 0.54 -0.46 0.16 0.00 -2.33 0.00 0.00 43.42 41.33 2dgq n LEU 62 CO 0.40 0.64 0.82 0.11 -1.33 0.00 0.00 177.39 178.04 2dgq h LYS 63 N 0.03 0.10 -0.39 3.23 1.79 -0.59 -1.27 116.57 119.48 2dgq h LYS 63 Ca -0.39 -0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.15 2dgq h LYS 63 Cb 2.03 -0.02 -0.09 0.00 -1.58 0.00 0.00 32.23 32.57 2dgq h LYS 63 CO 0.07 0.07 -0.36 -1.35 -1.08 0.00 0.00 179.45 176.80 2dgq h PRO 64 N 0.10 -0.27 0.48 3.15 0.11 -1.75 0.97 132.00 134.79 2dgq h PRO 64 Ca 0.42 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.52 2dgq h PRO 64 Cb 0.73 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.91 2dgq h PRO 64 CO -0.67 -0.18 -0.23 -0.07 -0.21 0.00 0.00 178.00 176.64 2dgq h LEU 65 N -0.28 -0.55 -2.14 2.35 3.38 -1.49 -2.35 115.31 114.22 2dgq h LEU 65 Ca 0.16 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.15 2dgq h LEU 65 Cb 0.56 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2dgq h LEU 65 CO -0.54 -0.31 0.17 -0.26 0.09 0.00 0.00 178.44 177.59 2dgq h PHE 66 N -0.76 0.00 -0.01 1.13 0.04 -0.93 0.39 116.94 116.80 2dgq h PHE 66 Ca -0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2dgq h PHE 66 Cb 0.55 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.70 2dgq h PHE 66 CO -0.02 0.00 -0.01 0.39 -0.60 0.00 0.00 178.31 178.07 2dgq n GLU 67 N -4.13 1.17 0.14 1.51 1.02 0.33 -3.05 120.64 117.64 2dgq n GLU 67 Ca 0.02 -0.34 0.06 0.00 -0.02 0.00 0.00 57.16 56.88 2dgq n GLU 67 Cb 0.30 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.27 2dgq n GLU 67 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2dgq h GLU 68 N 0.83 0.00 0.00 3.49 4.81 0.30 -3.37 114.58 120.63 2dgq h GLU 68 Ca 0.00 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.87 2dgq h GLU 68 Cb 0.21 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.53 2dgq h GLU 68 CO 0.00 0.27 -2.31 1.19 -0.73 0.00 0.00 179.01 177.43 2dgq n PHE 69 N -3.07 0.00 -3.74 0.92 3.72 -1.22 -5.09 117.46 108.98 2dgq n PHE 69 Ca 0.01 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.40 2dgq n PHE 69 Cb 0.67 -0.87 -0.00 0.00 -0.94 0.00 0.00 39.48 38.34 2dgq n PHE 69 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2dgq s GLY 70 N -6.02 -0.25 0.57 1.37 0.00 -1.17 -4.94 107.32 96.88 2dgq s GLY 70 Ca -0.31 0.28 -0.19 0.00 0.00 0.00 0.00 44.72 44.50 2dgq s GLY 70 CO 0.50 0.95 1.17 0.50 0.00 0.00 0.00 173.10 176.23 2dgq s ARG 71 N -2.63 3.15 0.22 2.90 3.00 -1.26 -3.99 118.95 120.34 2dgq s ARG 71 Ca 0.16 1.72 0.04 0.00 0.00 0.00 0.00 55.73 57.66 2dgq s ARG 71 Cb 0.01 -1.96 -0.03 0.00 0.00 0.00 0.00 34.95 32.97 2dgq s ARG 71 CO -0.00 -1.04 0.34 0.42 0.00 0.00 0.00 175.30 175.02 2dgq s ILE 72 N -1.68 5.24 -0.15 1.52 1.01 -1.26 -3.78 121.20 122.10 2dgq s ILE 72 Ca 0.75 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 60.53 2dgq s ILE 72 Cb -0.27 -3.81 -0.13 0.00 0.01 0.00 0.00 42.46 38.25 2dgq s ILE 72 CO 0.30 -0.27 -0.06 0.00 0.00 0.00 0.00 174.94 174.91 2dgq n TYR 73 N -1.20 0.00 -3.51 3.97 4.19 0.17 -4.68 117.16 116.11 2dgq n TYR 73 Ca -0.08 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.13 2dgq n TYR 73 Cb 0.56 -0.64 -0.05 0.00 0.49 0.00 0.00 39.34 39.70 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 -2.33 0.26 -0.17 2.98 2.12 -1.14 -5.00 118.70 115.43 2dgq s GLU 74 Ca -0.15 0.55 0.01 0.00 0.36 0.00 0.00 54.97 55.74 2dgq s GLU 74 Cb 0.05 0.20 0.02 0.00 0.26 0.00 0.00 34.13 34.65 2dgq s GLU 74 CO 0.45 -0.07 -0.20 -1.17 -0.54 0.00 0.00 175.26 173.74 2dgq s LEU 75 N 1.78 2.17 -0.03 2.70 2.96 -1.26 -1.86 118.68 125.14 2dgq s LEU 75 Ca -0.06 -0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 53.23 2dgq s LEU 75 Cb -0.04 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.19 2dgq s LEU 75 CO -0.15 0.02 0.03 -0.89 -1.32 0.00 0.00 176.35 174.04 2dgq s THR 76 N 1.18 -0.02 0.24 3.68 2.01 -0.96 -4.96 115.64 116.81 2dgq s THR 76 Ca 0.02 0.26 -0.05 0.00 0.31 0.00 0.00 61.69 62.23 2dgq s THR 76 Cb -0.14 -0.15 -0.05 0.00 0.01 0.00 0.00 72.50 72.17 2dgq s THR 76 CO -0.10 0.13 0.50 0.68 -0.69 0.00 0.00 174.62 175.14 2dgq s VAL 77 N 1.45 5.06 -0.14 3.82 -7.23 -1.26 0.07 120.40 122.17 2dgq s VAL 77 Ca -0.04 0.07 -0.09 0.00 -1.81 0.00 0.00 61.98 60.11 2dgq s VAL 77 Cb -0.13 -3.69 -0.04 0.00 0.56 0.00 0.00 36.38 33.08 2dgq s VAL 77 CO -0.03 -0.19 0.17 -0.76 -0.31 0.00 0.00 175.10 173.99 2dgq s LEU 78 N -3.21 4.33 0.02 1.32 1.43 -0.71 -4.93 118.68 116.92 2dgq s LEU 78 Ca 0.43 0.45 0.03 0.00 -1.03 0.00 0.00 54.13 54.01 2dgq s LEU 78 Cb -0.11 -2.15 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 2dgq s LEU 78 CO 0.27 0.31 -0.10 -0.54 0.23 0.00 0.00 176.35 176.52 2dgq s LYS 79 N -0.50 0.68 1.08 1.70 1.02 -1.26 -2.44 119.74 120.02 2dgq s LYS 79 Ca 0.14 -0.54 -0.19 0.00 0.02 0.00 0.00 55.97 55.40 2dgq s LYS 79 Cb -0.12 -0.61 0.08 0.00 -0.52 0.00 0.00 37.83 36.66 2dgq s LYS 79 CO 0.03 0.15 -0.13 -0.25 -0.92 0.00 0.00 175.35 174.24 2dgq n ASP 80 N 2.22 -2.63 -0.06 2.83 9.92 -0.98 -4.85 116.55 122.99 2dgq n ASP 80 Ca -0.17 -0.19 -0.10 0.00 -0.53 0.00 0.00 54.79 53.79 2dgq n ASP 80 Cb 0.56 -0.84 -0.05 0.00 -0.64 0.00 0.00 41.12 40.15 2dgq n ASP 80 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2dgq n ARG 81 N -1.39 0.29 -0.20 -1.24 1.85 -1.26 -3.38 116.66 111.32 2dgq n ARG 81 Ca 0.02 0.09 -0.10 0.00 -1.00 0.00 0.00 57.85 56.86 2dgq n ARG 81 Cb 0.57 -1.13 0.02 0.00 -1.05 0.00 0.00 32.46 30.87 2dgq n ARG 81 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 2dgq h LEU 82 N -0.18 1.02 0.00 2.89 3.38 -2.01 -3.37 115.31 117.05 2dgq h LEU 82 Ca -0.29 -0.32 -0.38 0.00 0.09 0.00 0.00 57.88 56.98 2dgq h LEU 82 Cb 1.37 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 41.78 2dgq h LEU 82 CO -0.10 1.09 -2.26 0.35 0.09 0.00 0.00 178.44 177.61 2dgq n THR 83 N -4.20 1.27 -0.48 0.22 -2.24 -1.26 -5.04 114.28 102.54 2dgq n THR 83 Ca 0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2dgq n THR 83 Cb 0.35 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 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 1.56 1.18 3.89 3.38 0.00 -1.22 -5.01 105.19 108.97 2dgq n GLY 84 Ca -0.45 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 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 4.38 -0.84 0.99 1.43 -1.26 -4.69 118.68 118.69 2dgq s LEU 85 Ca 0.00 0.45 -0.28 0.00 -1.03 0.00 0.00 54.13 53.27 2dgq s LEU 85 Cb 0.00 -2.41 -0.18 0.00 0.03 0.00 0.00 46.19 43.62 2dgq s LEU 85 CO 0.00 0.32 2.56 1.57 0.23 0.00 0.00 176.35 181.03 2dgq n HIS 86 N 1.40 0.80 -0.20 0.29 -0.00 -1.26 -2.32 115.22 113.93 2dgq n HIS 86 Ca -0.15 0.26 -0.07 0.00 -0.00 0.00 0.00 57.72 57.76 2dgq n HIS 86 Cb 0.54 -2.32 -0.02 0.00 -0.00 0.00 0.00 29.99 28.18 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 14.23 -0.21 0.00 1.57 1.57 -1.81 -3.44 116.57 128.48 2dgq h LYS 87 Ca -0.10 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2dgq h LYS 87 Cb 1.27 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2dgq h LYS 87 CO 1.33 -0.14 0.00 0.41 -0.57 0.00 0.00 179.45 180.48 2dgq n GLY 88 N -1.42 0.07 3.64 3.86 0.00 -1.26 -5.00 105.19 105.08 2dgq n GLY 88 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.86 -1.68 -0.31 0.00 0.00 -0.83 -1.74 121.76 114.33 2dgq s ALA 90 Ca 0.11 1.19 -0.14 0.00 0.00 0.00 0.00 51.96 53.12 2dgq s ALA 90 Cb 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2dgq s ALA 90 CO -0.03 -0.38 0.31 -0.06 0.00 0.00 0.00 175.76 175.60 2dgq s PHE 91 N -1.36 3.22 -0.18 0.00 0.08 0.11 -2.14 117.98 117.72 2dgq s PHE 91 Ca -0.10 0.07 -0.04 0.00 0.12 0.00 0.00 56.93 56.97 2dgq s PHE 91 Cb -0.00 -2.56 -0.03 0.00 -0.57 0.00 0.00 43.02 39.86 2dgq s PHE 91 CO 0.08 -0.32 -0.02 -1.17 -0.10 0.00 0.00 175.22 173.69 2dgq s LEU 92 N 1.93 3.25 -0.24 -0.37 2.96 0.36 -2.26 118.68 124.30 2dgq s LEU 92 Ca 0.11 -0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.83 2dgq s LEU 92 Cb -0.16 -1.80 0.02 0.00 0.50 0.00 0.00 46.19 44.75 2dgq s LEU 92 CO 0.11 0.12 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.30 2dgq s THR 93 N 0.67 2.87 0.10 3.68 2.01 -0.78 -0.49 115.64 123.70 2dgq s THR 93 Ca -0.01 -1.00 -0.22 0.00 0.31 0.00 0.00 61.69 60.77 2dgq s THR 93 Cb -0.14 -2.45 -0.07 0.00 0.01 0.00 0.00 72.50 69.85 2dgq s THR 93 CO 0.02 0.22 0.65 -0.31 -0.69 0.00 0.00 174.62 174.51 2dgq s TYR 94 N 1.33 3.83 0.32 4.92 2.02 -1.25 0.46 117.35 128.98 2dgq s TYR 94 Ca 0.01 1.41 0.01 0.00 -0.37 0.00 0.00 57.07 58.12 2dgq s TYR 94 Cb -0.16 -2.61 0.54 0.00 -0.40 0.00 0.00 41.96 39.33 2dgq s TYR 94 CO -0.05 0.54 1.95 0.00 -1.57 0.00 0.00 175.55 176.42 2dgq s ALA 96 N -5.86 3.52 -0.12 0.00 0.00 -1.26 -1.67 121.76 116.38 2dgq s ALA 96 Ca -0.11 -2.07 -0.26 0.00 0.00 0.00 0.00 51.96 49.52 2dgq s ALA 96 Cb 0.19 -0.41 -0.27 0.00 0.00 0.00 0.00 23.12 22.63 2dgq s ALA 96 CO 0.79 -0.12 0.76 0.07 0.00 0.00 0.00 175.76 177.26 2dgq h ARG 97 N 1.49 0.09 0.12 0.00 0.11 -1.85 -3.32 114.38 111.01 2dgq h ARG 97 Ca -0.43 -0.15 0.02 0.00 0.10 0.00 0.00 59.98 59.52 2dgq h ARG 97 Cb 1.25 0.06 -0.04 0.00 1.11 0.00 0.00 29.97 32.35 2dgq h ARG 97 CO 0.69 1.07 -0.33 -0.44 0.10 0.00 0.00 179.97 181.06 2dgq h ASP 98 N -0.81 -0.97 -1.02 0.08 5.19 -1.97 -1.26 116.42 115.66 2dgq h ASP 98 Ca -0.07 0.11 0.35 0.00 -0.62 0.00 0.00 57.03 56.81 2dgq h ASP 98 Cb 1.21 0.37 -0.16 0.00 0.18 0.00 0.00 39.33 40.93 2dgq h ASP 98 CO 0.03 -0.42 0.58 0.28 -3.12 0.00 0.00 179.24 176.59 2dgq h SER 99 N -0.56 0.45 0.20 6.45 0.02 -1.93 0.85 113.55 119.04 2dgq h SER 99 Ca 0.03 0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 2dgq h SER 99 Cb 0.59 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.30 2dgq h SER 99 CO -0.20 -0.22 -0.10 0.00 -1.14 0.00 0.00 176.83 175.18 2dgq h ALA 100 N 1.88 -0.27 -0.66 3.77 0.00 -1.39 -2.45 119.26 120.13 2dgq h ALA 100 Ca 0.77 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 55.60 2dgq h ALA 100 Cb 1.87 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 19.66 2dgq h ALA 100 CO -0.64 -0.39 0.07 -0.07 0.00 0.00 0.00 179.25 178.23 2dgq h LEU 101 N -0.80 -0.15 0.25 0.00 3.38 0.16 0.44 115.31 118.58 2dgq h LEU 101 Ca -0.03 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2dgq h LEU 101 Cb 0.51 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2dgq h LEU 101 CO 0.05 -0.08 -0.12 0.11 0.09 0.00 0.00 178.44 178.49 2dgq h LYS 102 N 0.18 -0.32 -1.05 1.13 1.57 -1.05 0.97 116.57 118.00 2dgq h LYS 102 Ca 0.35 0.02 0.29 0.00 -1.87 0.00 0.00 60.65 59.44 2dgq h LYS 102 Cb 0.58 0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.90 2dgq h LYS 102 CO -0.51 -0.21 0.72 0.00 -0.57 0.00 0.00 179.45 178.88 2dgq h ALA 103 N -1.84 2.67 0.37 3.86 0.00 -1.20 1.48 119.26 124.59 2dgq h ALA 103 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2dgq h ALA 103 Cb 0.25 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2dgq h ALA 103 CO 0.06 -1.01 -0.18 0.37 0.00 0.00 0.00 179.25 178.49 2dgq h GLN 104 N 0.17 -0.48 0.00 0.00 4.15 0.10 -0.46 115.11 118.59 2dgq h GLN 104 Ca 0.54 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.99 2dgq h GLN 104 Cb 1.78 0.11 0.00 0.00 0.21 0.00 0.00 27.48 29.58 2dgq h GLN 104 CO -0.13 -0.32 0.00 0.45 -1.93 0.00 0.00 178.83 176.91 2dgq n SER 105 N -4.17 0.00 -0.02 -0.69 2.88 0.31 0.22 113.62 112.16 2dgq n SER 105 Ca -0.06 -0.44 0.09 0.00 -1.33 0.00 0.00 58.87 57.13 2dgq n SER 105 Cb 0.19 -0.12 -0.17 0.00 -0.75 0.00 0.00 64.21 63.36 2dgq n SER 105 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dgq n ALA 106 N -1.12 2.70 -0.04 -1.46 0.00 0.50 -4.63 120.51 116.45 2dgq n ALA 106 Ca 0.15 -0.58 -0.07 0.00 0.00 0.00 0.00 53.44 52.94 2dgq n ALA 106 Cb 0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 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 -2.30 2.47 -4.25 0.00 4.77 -0.19 -4.70 117.00 112.81 2dgq n LEU 107 Ca -0.06 -0.01 -0.60 0.00 -0.03 0.00 0.00 56.01 55.31 2dgq n LEU 107 Cb 0.61 -0.29 -0.12 0.00 -2.33 0.00 0.00 43.42 41.29 2dgq n LEU 107 CO 0.46 0.54 1.73 1.57 -1.33 0.00 0.00 177.39 180.36 2dgq n HIS 108 N -2.90 1.16 -3.74 -1.77 -0.00 0.13 0.16 115.22 108.27 2dgq n HIS 108 Ca -0.16 0.77 -0.26 0.00 0.46 0.00 0.00 57.72 58.53 2dgq n HIS 108 Cb 0.65 -2.29 0.05 0.00 -0.12 0.00 0.00 29.99 28.28 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 7.51 -6.40 0.00 1.57 1.02 0.16 -4.84 120.64 119.65 2dgq n GLU 109 Ca 0.55 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 58.39 2dgq n GLU 109 Cb -0.04 -5.62 0.00 0.00 -0.02 0.00 0.00 31.44 25.76 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 -4.70 0.00 -3.02 3.49 6.02 0.42 -4.97 117.38 114.62 2dgq n GLN 110 Ca -0.04 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.77 2dgq n GLN 110 Cb 0.57 -0.42 0.03 0.00 1.02 0.00 0.00 30.24 31.44 2dgq n GLN 110 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2dgq s LYS 111 N -1.64 2.65 -0.27 -1.09 -0.14 -1.04 -4.94 119.74 113.27 2dgq s LYS 111 Ca 0.00 -1.38 -0.04 0.00 -1.36 0.00 0.00 55.97 53.19 2dgq s LYS 111 Cb 0.00 -2.72 0.15 0.00 -1.68 0.00 0.00 37.83 33.58 2dgq s LYS 111 CO 0.00 -0.47 0.51 0.99 -0.76 0.00 0.00 175.35 175.62 2dgq s THR 112 N -2.46 -0.82 0.81 2.17 2.01 -1.26 -0.30 115.64 115.79 2dgq s THR 112 Ca 0.57 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 62.45 2dgq s THR 112 Cb -0.09 -0.89 0.08 0.00 0.01 0.00 0.00 72.50 71.62 2dgq s THR 112 CO 0.35 -0.03 1.16 -0.76 -0.69 0.00 0.00 174.62 174.65 2dgq s LEU 113 N 2.73 3.08 -0.38 4.42 1.43 -1.26 -4.90 118.68 123.79 2dgq s LEU 113 Ca 0.11 2.20 -0.28 0.00 -1.03 0.00 0.00 54.13 55.12 2dgq s LEU 113 Cb -0.14 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.50 2dgq s LEU 113 CO -0.18 -2.55 1.72 -2.16 0.23 0.00 0.00 176.35 173.41 2dgq s PRO 114 N -4.37 3.30 0.00 1.29 0.04 -1.26 -2.52 135.00 131.48 2dgq s PRO 114 Ca 0.69 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2dgq s PRO 114 Cb -0.24 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 30.11 2dgq s PRO 114 CO 0.52 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 176.07 2dgq n GLY 115 N 5.38 1.33 3.06 0.56 0.00 -1.26 -5.02 105.19 109.25 2dgq n GLY 115 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.36 2.39 0.24 1.61 -1.94 -1.05 -5.01 119.30 115.19 2dgq s MET 116 Ca 0.00 -0.61 0.01 0.00 -1.71 0.00 0.00 55.69 53.37 2dgq s MET 116 Cb 0.00 -2.07 0.28 0.00 2.01 0.00 0.00 34.83 35.05 2dgq s MET 116 CO 0.00 -0.13 1.62 -0.91 -0.01 0.00 0.00 175.02 175.60 2dgq h ASN 117 N 7.66 0.52 -3.09 3.03 4.21 -1.99 -3.44 115.58 122.47 2dgq h ASN 117 Ca -0.34 -0.22 -0.53 0.00 1.21 0.00 0.00 56.30 56.42 2dgq h ASN 117 Cb 1.16 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 38.20 2dgq h ASN 117 CO 0.52 0.86 -0.21 -0.13 -1.29 0.00 0.00 177.43 177.17 2dgq s ARG 118 N -4.24 3.60 1.21 0.81 0.52 -1.26 -5.10 118.95 114.49 2dgq s ARG 118 Ca -0.07 -0.11 -0.19 0.00 -0.52 0.00 0.00 55.73 54.84 2dgq s ARG 118 Cb 0.13 -2.72 0.29 0.00 0.52 0.00 0.00 34.95 33.16 2dgq s ARG 118 CO 0.81 0.30 1.11 -1.25 0.02 0.00 0.00 175.30 176.29 2dgq s PRO 119 N -3.39 -1.27 -0.24 3.54 0.04 -1.26 -4.69 135.00 127.74 2dgq s PRO 119 Ca 0.42 -0.08 -0.23 0.00 0.04 0.00 0.00 61.00 61.15 2dgq s PRO 119 Cb -0.11 -1.59 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 2dgq s PRO 119 CO 0.29 -3.74 0.75 -1.50 0.04 0.00 0.00 177.00 172.84 2dgq s ILE 120 N -3.01 4.90 -0.28 0.56 2.07 0.59 -4.83 121.20 121.20 2dgq s ILE 120 Ca 0.71 1.41 -0.11 0.00 -1.41 0.00 0.00 60.65 61.25 2dgq s ILE 120 Cb -0.09 -4.05 -0.05 0.00 0.13 0.00 0.00 42.46 38.40 2dgq s ILE 120 CO 0.56 -0.02 0.19 -1.10 -1.91 0.00 0.00 174.94 172.66 2dgq s GLN 121 N 2.60 3.89 -0.13 3.50 1.11 -1.26 -0.67 119.66 128.71 2dgq s GLN 121 Ca 0.32 -0.36 -0.00 0.00 0.01 0.00 0.00 55.36 55.33 2dgq s GLN 121 Cb -0.15 -3.65 0.03 0.00 -1.01 0.00 0.00 33.01 28.22 2dgq s GLN 121 CO 0.08 -0.20 -0.07 0.08 0.01 0.00 0.00 175.29 175.19 2dgq s VAL 122 N 1.75 1.07 0.11 1.09 1.01 -1.26 -2.08 120.40 122.08 2dgq s VAL 122 Ca 0.07 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.71 2dgq s VAL 122 Cb -0.16 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2dgq s VAL 122 CO 0.11 0.30 -0.14 -1.59 0.00 0.00 0.00 175.10 173.77 2dgq s LYS 123 N 1.68 0.97 -1.04 2.72 -2.85 -0.81 -4.68 119.74 115.73 2dgq s LYS 123 Ca 0.04 -1.17 -0.24 0.00 -1.00 0.00 0.00 55.97 53.61 2dgq s LYS 123 Cb -0.13 -0.89 -0.07 0.00 -2.06 0.00 0.00 37.83 34.68 2dgq s LYS 123 CO -0.08 0.18 1.94 -1.25 0.10 0.00 0.00 175.35 176.24 2dgq s PRO 124 N -2.42 2.53 0.17 1.78 0.04 -1.26 0.04 135.00 135.87 2dgq s PRO 124 Ca 0.06 -0.73 -0.11 0.00 0.04 0.00 0.00 61.00 60.26 2dgq s PRO 124 Cb -0.06 -5.15 0.20 0.00 0.04 0.00 0.00 34.50 29.52 2dgq s PRO 124 CO 0.03 -3.68 1.08 0.00 0.04 0.00 0.00 177.00 174.47 2dgq n ALA 125 N 14.18 -0.04 -3.48 8.56 0.00 0.13 -2.67 120.51 137.19 2dgq n ALA 125 Ca 0.42 0.71 -0.43 0.00 0.00 0.00 0.00 53.44 54.15 2dgq n ALA 125 Cb 0.47 -0.34 -0.06 0.00 0.00 0.00 0.00 19.45 19.52 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 -5.70 3.79 -0.82 0.00 0.00 -1.23 -5.02 121.76 112.79 2dgq s ALA 126 Ca -0.10 -3.12 -0.18 0.00 0.00 0.00 0.00 51.96 48.56 2dgq s ALA 126 Cb 0.15 -3.13 0.14 0.00 0.00 0.00 0.00 23.12 20.28 2dgq s ALA 126 CO 0.51 -2.15 0.96 -1.12 0.00 0.00 0.00 175.76 173.96 2dgq s SER 127 N 1.92 6.52 -0.38 0.00 0.01 -1.09 -4.49 113.70 116.19 2dgq s SER 127 Ca 0.14 -1.93 0.03 0.00 1.31 0.00 0.00 55.95 55.51 2dgq s SER 127 Cb -0.17 -2.35 0.11 0.00 0.21 0.00 0.00 66.02 63.82 2dgq s SER 127 CO -0.05 -1.03 0.10 -0.70 0.41 0.00 0.00 173.24 171.98 2dgq s GLU 128 N 2.38 1.49 0.00 12.44 2.56 -1.26 -4.79 118.70 131.52 2dgq s GLU 128 Ca 0.25 -1.95 0.00 0.00 0.00 0.00 0.00 54.97 53.26 2dgq s GLU 128 Cb -0.11 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 32.95 2dgq s GLU 128 CO -0.04 -0.99 0.00 0.41 -0.56 0.00 0.00 175.26 174.08 2dgq n GLY 129 N 4.06 0.13 3.47 -1.50 0.00 -1.26 -5.08 105.19 105.00 2dgq n GLY 129 Ca 0.04 -0.10 -0.44 0.00 0.00 0.00 0.00 46.02 45.51 2dgq n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dgq n ARG 130 N -1.36 0.55 0.00 1.61 1.74 -1.26 -4.60 116.66 113.34 2dgq n ARG 130 Ca 0.00 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2dgq n ARG 130 Cb 0.00 -2.25 0.00 0.00 -1.02 0.00 0.00 32.46 29.19 2dgq n ARG 130 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dgq n GLY 131 N 6.50 1.22 3.86 -0.13 0.00 -1.26 -5.02 105.19 110.36 2dgq n GLY 131 Ca 0.51 0.07 -0.28 0.00 0.00 0.00 0.00 46.02 46.32 2dgq n GLY 131 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dgq n GLU 132 N 0.00 -5.49 -2.00 1.61 2.13 -1.26 -4.88 120.64 110.75 2dgq n GLU 132 Ca 0.00 0.61 -0.42 0.00 0.66 0.00 0.00 57.16 58.01 2dgq n GLU 132 Cb 0.00 -5.43 -0.03 0.00 0.27 0.00 0.00 31.44 26.25 2dgq n GLU 132 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2dgq s SER 133 N -3.54 6.65 -0.20 4.31 1.04 -1.26 -4.98 113.70 115.72 2dgq s SER 133 Ca 0.52 2.57 -0.32 0.00 0.48 0.00 0.00 55.95 59.19 2dgq s SER 133 Cb -0.26 -2.60 0.15 0.00 0.10 0.00 0.00 66.02 63.41 2dgq s SER 133 CO 0.82 -0.76 1.19 -0.83 0.98 0.00 0.00 173.24 174.65 2dgq s GLY 134 N 0.94 -0.20 0.19 7.32 0.00 -1.26 -5.15 107.32 109.16 2dgq s GLY 134 Ca 0.66 1.96 -0.30 0.00 0.00 0.00 0.00 44.72 47.04 2dgq s GLY 134 CO 0.34 0.76 1.31 2.56 0.00 0.00 0.00 173.10 178.07 2dgq s PRO 135 N -1.85 4.39 0.89 2.90 0.04 -1.26 -5.03 135.00 135.07 2dgq s PRO 135 Ca 0.07 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 2dgq s PRO 135 Cb -0.01 -3.20 0.17 0.00 0.04 0.00 0.00 34.50 31.51 2dgq s PRO 135 CO -0.04 -0.26 1.22 -1.12 0.04 0.00 0.00 177.00 176.84 2dgq s SER 136 N 0.38 3.53 0.33 6.66 0.01 -1.26 -5.09 113.70 118.26 2dgq s SER 136 Ca 0.57 0.10 0.01 0.00 1.31 0.00 0.00 55.95 57.94 2dgq s SER 136 Cb -0.36 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.58 2dgq s SER 136 CO 0.38 -2.45 0.52 -0.44 0.41 0.00 0.00 173.24 171.66 2dgq s SER 137 N -4.83 6.29 0.00 2.44 0.01 -1.26 -5.35 113.70 111.00 2dgq s SER 137 Ca 0.71 0.39 0.00 0.00 1.31 0.00 0.00 55.95 58.36 2dgq s SER 137 Cb -0.04 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.18 2dgq s SER 137 CO 0.50 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.50