#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ohq n VAL 2 N 0.00 1.23 -3.88 6.31 0.31 -1.26 -4.20 118.33 116.84 1ohq n VAL 2 Ca 0.00 -0.31 -0.11 0.00 -0.01 0.00 0.00 64.34 63.91 1ohq n VAL 2 Cb 0.00 -1.94 -0.12 0.00 -0.91 0.00 0.00 33.84 30.87 1ohq n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1ohq s GLN 3 N -0.84 0.18 -0.22 5.55 -0.21 -1.02 -4.98 119.66 118.11 1ohq s GLN 3 Ca 0.62 -0.13 0.01 0.00 0.02 0.00 0.00 55.36 55.88 1ohq s GLN 3 Cb -0.50 0.07 0.05 0.00 1.00 0.00 0.00 33.01 33.64 1ohq s GLN 3 CO 0.52 -0.03 -0.07 -0.51 -2.12 0.00 0.00 175.29 173.07 1ohq s LEU 4 N -0.48 2.51 -0.34 2.90 1.02 -1.26 -1.92 118.68 121.11 1ohq s LEU 4 Ca -0.05 -1.08 -0.04 0.00 0.02 0.00 0.00 54.13 52.97 1ohq s LEU 4 Cb -0.03 -1.22 0.06 0.00 0.02 0.00 0.00 46.19 45.01 1ohq s LEU 4 CO 0.00 -0.20 0.08 -0.22 0.02 0.00 0.00 176.35 176.03 1ohq s LEU 5 N 1.38 4.30 0.21 1.79 2.96 -0.91 -3.97 118.68 124.44 1ohq s LEU 5 Ca -0.04 -1.34 -0.19 0.00 -0.22 0.00 0.00 54.13 52.34 1ohq s LEU 5 Cb -0.18 -1.80 -0.08 0.00 0.50 0.00 0.00 46.19 44.63 1ohq s LEU 5 CO -0.07 -0.34 0.69 -1.61 -1.32 0.00 0.00 176.35 173.71 1ohq s GLU 6 N 1.30 4.20 0.29 1.98 2.02 -1.26 -1.09 118.70 126.14 1ohq s GLU 6 Ca -0.02 0.80 0.03 0.00 0.02 0.00 0.00 54.97 55.80 1ohq s GLU 6 Cb -0.20 -2.89 -0.03 0.00 0.10 0.00 0.00 34.13 31.11 1ohq s GLU 6 CO 0.00 0.41 0.26 -1.54 0.02 0.00 0.00 175.26 174.41 1ohq s SER 7 N -1.67 1.01 0.00 -0.19 1.04 -0.80 -4.98 113.70 108.12 1ohq s SER 7 Ca 0.42 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 55.28 1ohq s SER 7 Cb -0.16 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1ohq s SER 7 CO 0.21 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 174.01 1ohq n GLY 8 N -0.49 0.69 3.79 7.32 0.00 -1.26 -1.57 105.19 113.66 1ohq n GLY 8 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1ohq n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ohq s GLY 9 N -1.43 1.61 0.00 -0.02 0.00 -1.26 -4.58 107.32 101.63 1ohq s GLY 9 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.42 1ohq s GLY 9 CO 0.00 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.89 1ohq n GLY 10 N -2.04 -1.41 3.78 0.20 0.00 -0.85 -5.00 105.19 99.87 1ohq n GLY 10 Ca 0.07 -1.38 -0.39 0.00 0.00 0.00 0.00 46.02 44.32 1ohq n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ohq s LEU 11 N 0.00 4.59 -0.12 0.99 0.20 -1.26 -2.31 118.68 120.77 1ohq s LEU 11 Ca 0.00 1.63 -0.09 0.00 0.69 0.00 0.00 54.13 56.36 1ohq s LEU 11 Cb 0.00 -3.29 0.04 0.00 -0.43 0.00 0.00 46.19 42.50 1ohq s LEU 11 CO 0.00 0.21 0.30 -0.69 -0.29 0.00 0.00 176.35 175.88 1ohq s VAL 12 N -1.16 -0.01 0.51 1.68 1.01 -0.52 -4.96 120.40 116.94 1ohq s VAL 12 Ca 0.36 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 1ohq s VAL 12 Cb -0.23 -0.44 -0.08 0.00 0.00 0.00 0.00 36.38 35.64 1ohq s VAL 12 CO 0.26 0.02 1.03 -1.10 0.00 0.00 0.00 175.10 175.30 1ohq s GLN 13 N 0.54 3.76 0.51 2.72 1.11 -1.26 -2.12 119.66 124.92 1ohq s GLN 13 Ca -0.03 1.25 -0.23 0.00 0.01 0.00 0.00 55.36 56.37 1ohq s GLN 13 Cb -0.05 -2.10 -0.06 0.00 -1.01 0.00 0.00 33.01 29.79 1ohq s GLN 13 CO -0.03 -0.45 1.28 -2.30 0.01 0.00 0.00 175.29 173.80 1ohq n PRO 14 N -1.23 1.67 0.00 2.91 -0.02 -1.26 -2.14 135.00 134.92 1ohq n PRO 14 Ca 0.09 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1ohq n PRO 14 Cb 0.53 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1ohq n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ohq n GLY 15 N 0.85 2.90 0.00 -1.23 0.00 -0.20 -4.95 105.19 102.56 1ohq n GLY 15 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1ohq n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ohq n GLY 16 N -0.56 -1.95 3.14 -0.02 0.00 -0.91 -4.01 105.19 100.87 1ohq n GLY 16 Ca 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 46.02 44.44 1ohq n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ohq s SER 17 N -1.36 0.36 -0.28 1.61 1.04 -1.26 -2.34 113.70 111.47 1ohq s SER 17 Ca 0.00 -1.02 -0.22 0.00 0.48 0.00 0.00 55.95 55.20 1ohq s SER 17 Cb 0.00 0.26 0.09 0.00 0.10 0.00 0.00 66.02 66.48 1ohq s SER 17 CO 0.00 -0.68 0.81 -0.22 0.98 0.00 0.00 173.24 174.14 1ohq s LEU 18 N -2.96 -0.71 -0.32 2.42 2.96 -0.43 -5.02 118.68 114.63 1ohq s LEU 18 Ca 0.13 1.26 -0.08 0.00 -0.22 0.00 0.00 54.13 55.22 1ohq s LEU 18 Cb 0.07 2.23 0.01 0.00 0.50 0.00 0.00 46.19 49.00 1ohq s LEU 18 CO -0.06 -0.21 0.13 -0.60 -1.32 0.00 0.00 176.35 174.29 1ohq s ARG 19 N 0.79 3.04 0.27 1.98 3.52 -1.26 -1.35 118.95 125.94 1ohq s ARG 19 Ca -0.03 -0.91 -0.29 0.00 -0.13 0.00 0.00 55.73 54.37 1ohq s ARG 19 Cb -0.05 -3.50 -0.09 0.00 -1.56 0.00 0.00 34.95 29.75 1ohq s ARG 19 CO -0.08 -0.52 1.01 -0.51 -0.81 0.00 0.00 175.30 174.39 1ohq s LEU 20 N 1.52 4.55 0.29 -0.88 1.02 -0.93 -4.60 118.68 119.66 1ohq s LEU 20 Ca 0.02 2.07 0.11 0.00 0.02 0.00 0.00 54.13 56.35 1ohq s LEU 20 Cb -0.18 -3.69 -0.05 0.00 0.02 0.00 0.00 46.19 42.29 1ohq s LEU 20 CO 0.04 -0.02 -0.16 -0.44 0.02 0.00 0.00 176.35 175.79 1ohq s SER 21 N -1.13 3.72 -0.32 2.29 0.01 -0.61 -1.48 113.70 116.18 1ohq s SER 21 Ca 0.44 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.71 1ohq s SER 21 Cb -0.27 -0.37 0.15 0.00 0.21 0.00 0.00 66.02 65.74 1ohq s SER 21 CO 0.34 -0.00 0.38 0.00 0.41 0.00 0.00 173.24 174.37 1ohq s ALA 23 N 2.09 3.20 0.07 0.00 0.00 -0.25 -1.82 121.76 125.05 1ohq s ALA 23 Ca 0.12 -0.39 -0.17 0.00 0.00 0.00 0.00 51.96 51.52 1ohq s ALA 23 Cb -0.13 -3.87 -0.06 0.00 0.00 0.00 0.00 23.12 19.05 1ohq s ALA 23 CO -0.21 -2.15 0.52 0.00 0.00 0.00 0.00 175.76 173.91 1ohq s ALA 24 N 4.40 3.62 0.22 0.00 0.00 -0.79 -2.15 121.76 127.06 1ohq s ALA 24 Ca 0.48 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1ohq s ALA 24 Cb -0.08 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.46 1ohq s ALA 24 CO 0.29 0.44 0.10 -1.54 0.00 0.00 0.00 175.76 175.05 1ohq s SER 25 N -1.27 0.75 0.00 0.00 1.04 -0.81 -4.83 113.70 108.58 1ohq s SER 25 Ca 0.30 -1.36 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1ohq s SER 25 Cb -0.17 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1ohq s SER 25 CO 0.18 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1ohq n GLY 26 N -0.35 1.72 3.83 7.32 0.00 -1.26 -2.44 105.19 114.00 1ohq n GLY 26 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1ohq n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ohq s PHE 27 N -2.60 0.04 -0.09 1.61 -0.12 -1.26 -4.67 117.98 110.90 1ohq s PHE 27 Ca 0.00 -0.55 0.03 0.00 -0.05 0.00 0.00 56.93 56.37 1ohq s PHE 27 Cb 0.00 0.75 -0.01 0.00 -0.63 0.00 0.00 43.02 43.13 1ohq s PHE 27 CO 0.00 -1.20 -0.20 1.03 -0.05 0.00 0.00 175.22 174.79 1ohq s ARG 28 N -2.53 2.94 0.32 1.99 1.81 -1.26 -4.96 118.95 117.26 1ohq s ARG 28 Ca 0.17 -0.81 0.22 0.00 -1.72 0.00 0.00 55.73 53.59 1ohq s ARG 28 Cb -0.04 -2.36 0.17 0.00 -0.45 0.00 0.00 34.95 32.27 1ohq s ARG 28 CO 0.08 0.30 1.35 -0.84 -0.68 0.00 0.00 175.30 175.50 1ohq h ILE 29 N 5.28 0.10 -0.52 1.52 3.07 -1.91 -3.31 117.51 121.73 1ohq h ILE 29 Ca -0.28 -1.15 -0.00 0.00 1.55 0.00 0.00 64.86 64.98 1ohq h ILE 29 Cb 1.20 1.85 -0.03 0.00 -0.27 0.00 0.00 36.82 39.58 1ohq h ILE 29 CO 0.50 0.06 0.32 0.77 -1.05 0.00 0.00 178.15 178.74 1ohq h SER 30 N 0.00 0.62 0.00 2.16 4.64 -1.96 -3.29 113.55 115.72 1ohq h SER 30 Ca -0.01 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1ohq h SER 30 Cb 1.06 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1ohq h SER 30 CO 0.01 0.48 -0.01 0.44 -0.87 0.00 0.00 176.83 176.88 1ohq h ASP 31 N 0.72 0.00 -3.94 4.97 3.32 -1.99 -3.49 116.42 116.01 1ohq h ASP 31 Ca 0.19 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.68 1ohq h ASP 31 Cb -0.03 0.00 0.16 0.00 0.22 0.00 0.00 39.33 39.68 1ohq h ASP 31 CO -0.04 0.34 0.43 -0.62 -1.72 0.00 0.00 179.24 177.63 1ohq n GLU 32 N -3.85 1.19 -2.33 3.56 -0.58 -1.24 -4.90 120.64 112.49 1ohq n GLU 32 Ca -0.00 0.46 -0.41 0.00 -0.42 0.00 0.00 57.16 56.79 1ohq n GLU 32 Cb 0.00 -2.45 -0.03 0.00 -0.57 0.00 0.00 31.44 28.39 1ohq n GLU 32 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ohq s ASP 33 N -1.24 7.06 0.28 1.62 1.01 -1.25 -4.92 116.67 119.23 1ohq s ASP 33 Ca 0.78 2.42 0.04 0.00 0.71 0.00 0.00 52.55 56.50 1ohq s ASP 33 Cb -0.40 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 40.86 1ohq s ASP 33 CO 0.44 -0.32 0.20 -0.04 0.21 0.00 0.00 175.17 175.66 1ohq s MET 34 N -1.35 1.55 -0.03 8.23 -1.94 -0.74 -1.90 119.30 123.12 1ohq s MET 34 Ca 0.48 -1.88 -0.16 0.00 -1.71 0.00 0.00 55.69 52.42 1ohq s MET 34 Cb -0.35 0.21 0.05 0.00 2.01 0.00 0.00 34.83 36.75 1ohq s MET 34 CO 0.44 -0.52 0.71 0.41 -0.01 0.00 0.00 175.02 176.05 1ohq n GLY 35 N -0.51 0.34 2.97 -0.03 0.00 -0.89 -1.11 105.19 105.96 1ohq n GLY 35 Ca 0.04 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 1ohq n GLY 35 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ohq s TRP 36 N -2.32 1.02 0.20 1.61 0.52 0.20 -1.09 118.94 119.08 1ohq s TRP 36 Ca 0.17 -0.31 0.10 0.00 0.02 0.00 0.00 56.10 56.07 1ohq s TRP 36 Cb -0.00 -0.79 -0.04 0.00 -1.15 0.00 0.00 33.47 31.49 1ohq s TRP 36 CO -0.01 -0.18 -0.12 0.08 0.02 0.00 0.00 176.95 176.74 1ohq s VAL 37 N 0.60 3.00 0.06 4.03 1.01 -0.13 -0.87 120.40 128.10 1ohq s VAL 37 Ca -0.10 -1.81 -0.07 0.00 0.00 0.00 0.00 61.98 60.00 1ohq s VAL 37 Cb -0.13 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1ohq s VAL 37 CO 0.01 -0.16 0.13 0.00 0.00 0.00 0.00 175.10 175.08 1ohq s ARG 38 N -2.94 0.70 -0.22 2.72 1.70 -0.55 -0.08 118.95 120.28 1ohq s ARG 38 Ca 0.25 -0.88 -0.03 0.00 -0.47 0.00 0.00 55.73 54.60 1ohq s ARG 38 Cb -0.08 0.28 0.07 0.00 -0.57 0.00 0.00 34.95 34.65 1ohq s ARG 38 CO 0.15 -0.19 0.07 -1.14 -1.08 0.00 0.00 175.30 173.11 1ohq s GLN 39 N -3.24 0.47 0.64 3.89 0.74 -0.80 -1.82 119.66 119.54 1ohq s GLN 39 Ca 0.00 -0.48 -0.15 0.00 0.05 0.00 0.00 55.36 54.78 1ohq s GLN 39 Cb 0.02 -1.88 -0.01 0.00 1.10 0.00 0.00 33.01 32.25 1ohq s GLN 39 CO -0.08 -0.77 1.09 0.00 -0.55 0.00 0.00 175.29 174.99 1ohq s ALA 40 N 1.92 2.55 -0.23 1.58 0.00 -1.26 -2.05 121.76 124.27 1ohq s ALA 40 Ca 0.03 0.50 -0.42 0.00 0.00 0.00 0.00 51.96 52.07 1ohq s ALA 40 Cb -0.17 -3.29 -0.18 0.00 0.00 0.00 0.00 23.12 19.48 1ohq s ALA 40 CO -0.16 -1.13 1.53 -2.30 0.00 0.00 0.00 175.76 173.69 1ohq n PRO 41 N -2.30 0.64 0.00 0.00 -0.02 -1.25 -1.38 135.00 130.68 1ohq n PRO 41 Ca 0.10 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1ohq n PRO 41 Cb 0.52 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 1ohq n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ohq n GLY 42 N 3.42 2.33 2.19 -1.23 0.00 -1.26 -4.96 105.19 105.68 1ohq n GLY 42 Ca 0.25 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 1ohq n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ohq n LYS 43 N -1.87 0.71 -2.85 1.61 4.76 -0.48 -5.12 118.16 114.91 1ohq n LYS 43 Ca 0.00 -1.72 -0.21 0.00 -2.87 0.00 0.00 58.31 53.51 1ohq n LYS 43 Cb 0.00 -0.16 0.07 0.00 -1.84 0.00 0.00 35.03 33.09 1ohq n LYS 43 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ohq s GLY 44 N -3.53 1.78 0.70 0.72 0.00 -1.26 -4.65 107.32 101.09 1ohq s GLY 44 Ca 0.34 -1.87 -0.14 0.00 0.00 0.00 0.00 44.72 43.06 1ohq s GLY 44 CO 0.22 -1.43 1.13 1.08 0.00 0.00 0.00 173.10 174.09 1ohq s LEU 45 N -4.78 3.29 -0.30 0.66 1.02 -1.26 -4.38 118.68 112.94 1ohq s LEU 45 Ca 0.62 2.05 -0.12 0.00 0.02 0.00 0.00 54.13 56.70 1ohq s LEU 45 Cb -0.07 -4.55 0.13 0.00 0.02 0.00 0.00 46.19 41.72 1ohq s LEU 45 CO 0.40 -1.89 0.70 -0.70 0.02 0.00 0.00 176.35 174.88 1ohq s GLU 46 N -4.21 0.56 0.16 1.70 2.12 -0.76 -5.00 118.70 113.29 1ohq s GLU 46 Ca 0.67 1.32 -0.31 0.00 0.36 0.00 0.00 54.97 57.01 1ohq s GLU 46 Cb -0.22 0.70 -0.10 0.00 0.26 0.00 0.00 34.13 34.78 1ohq s GLU 46 CO 0.45 -0.18 1.54 -1.58 -0.54 0.00 0.00 175.26 174.95 1ohq s TRP 47 N 2.62 3.08 -0.26 5.30 0.52 -1.26 -1.49 118.94 127.46 1ohq s TRP 47 Ca -0.06 0.70 -0.08 0.00 0.02 0.00 0.00 56.10 56.68 1ohq s TRP 47 Cb -0.10 -3.89 -0.15 0.00 -1.15 0.00 0.00 33.47 28.18 1ohq s TRP 47 CO -0.19 -3.23 -0.22 0.28 0.02 0.00 0.00 176.95 173.61 1ohq n VAL 48 N 3.85 1.53 -3.57 4.03 0.31 -0.05 -4.51 118.33 119.91 1ohq n VAL 48 Ca 0.13 -0.46 -0.08 0.00 -0.01 0.00 0.00 64.34 63.92 1ohq n VAL 48 Cb 0.39 -1.69 -0.02 0.00 -0.91 0.00 0.00 33.84 31.61 1ohq n VAL 48 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1ohq s SER 49 N -7.03 -0.37 0.12 4.52 1.04 -1.14 -1.87 113.70 108.97 1ohq s SER 49 Ca -0.36 -0.15 -0.11 0.00 0.48 0.00 0.00 55.95 55.81 1ohq s SER 49 Cb 0.11 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.74 1ohq s SER 49 CO 0.56 -0.84 0.29 -0.94 0.98 0.00 0.00 173.24 173.28 1ohq s SER 50 N -2.69 -0.01 -0.15 7.02 1.04 -0.97 -0.63 113.70 117.31 1ohq s SER 50 Ca 0.06 -0.59 -0.02 0.00 0.48 0.00 0.00 55.95 55.88 1ohq s SER 50 Cb -0.02 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.56 1ohq s SER 50 CO -0.06 -0.81 0.00 -0.51 0.98 0.00 0.00 173.24 172.84 1ohq s ILE 51 N -3.87 0.62 0.25 -1.02 2.07 -0.27 -1.51 121.20 117.48 1ohq s ILE 51 Ca 0.07 -0.35 -0.11 0.00 -1.41 0.00 0.00 60.65 58.86 1ohq s ILE 51 Cb 0.03 -0.93 -0.01 0.00 0.13 0.00 0.00 42.46 41.69 1ohq s ILE 51 CO -0.09 0.04 0.44 -0.72 -1.91 0.00 0.00 174.94 172.69 1ohq s TYR 52 N 1.84 0.50 0.00 3.50 -0.85 -0.85 -1.79 117.35 119.69 1ohq s TYR 52 Ca 0.02 -0.84 0.00 0.00 -0.52 0.00 0.00 57.07 55.73 1ohq s TYR 52 Cb -0.15 0.09 0.00 0.00 0.38 0.00 0.00 41.96 42.28 1ohq s TYR 52 CO -0.07 -0.96 0.00 0.41 -1.52 0.00 0.00 175.55 173.41 1ohq n GLY 53 N -0.38 -3.62 0.15 5.49 0.00 -1.26 -2.57 105.19 102.99 1ohq n GLY 53 Ca -0.01 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 1ohq n GLY 53 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ohq h PRO 54 N 0.00 0.41 -0.28 1.61 0.13 -2.00 -3.32 132.00 128.55 1ohq h PRO 54 Ca 0.00 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1ohq h PRO 54 Cb 0.00 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.05 1ohq h PRO 54 CO 0.00 0.33 0.00 -1.13 -0.23 0.00 0.00 178.00 176.97 1ohq n SER 55 N -4.83 1.86 -2.86 1.44 3.41 -1.26 -4.93 113.62 106.45 1ohq n SER 55 Ca -0.02 -1.87 -0.17 0.00 -0.26 0.00 0.00 58.87 56.55 1ohq n SER 55 Cb 0.06 -0.19 0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1ohq n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ohq n GLY 56 N 1.11 -0.19 3.73 5.00 0.00 -1.25 -4.97 105.19 108.62 1ohq n GLY 56 Ca 0.14 0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1ohq n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ohq s SER 57 N -3.47 7.03 0.05 1.61 0.01 -1.06 -4.77 113.70 113.10 1ohq s SER 57 Ca 0.32 2.24 0.01 0.00 1.31 0.00 0.00 55.95 59.84 1ohq s SER 57 Cb -0.14 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 1ohq s SER 57 CO 0.56 -0.44 0.11 0.42 0.41 0.00 0.00 173.24 174.30 1ohq s THR 58 N 0.24 4.81 0.03 1.44 -4.23 -1.26 -2.01 115.64 114.65 1ohq s THR 58 Ca 0.55 -0.57 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1ohq s THR 58 Cb -0.33 -3.30 -0.02 0.00 1.34 0.00 0.00 72.50 70.19 1ohq s THR 58 CO 0.35 0.19 -0.05 -0.31 -0.54 0.00 0.00 174.62 174.26 1ohq s TYR 59 N -1.37 0.43 0.01 3.99 1.51 -0.57 -5.01 117.35 116.34 1ohq s TYR 59 Ca 0.29 -0.50 0.00 0.00 -1.01 0.00 0.00 57.07 55.85 1ohq s TYR 59 Cb -0.12 -0.28 -0.01 0.00 -0.11 0.00 0.00 41.96 41.44 1ohq s TYR 59 CO 0.21 -0.14 -0.01 0.71 -1.11 0.00 0.00 175.55 175.22 1ohq s TYR 60 N -1.38 0.08 0.58 2.71 1.51 -1.26 -2.28 117.35 117.31 1ohq s TYR 60 Ca -0.13 -0.16 -0.20 0.00 -1.01 0.00 0.00 57.07 55.57 1ohq s TYR 60 Cb -0.10 -0.06 -0.04 0.00 -0.11 0.00 0.00 41.96 41.66 1ohq s TYR 60 CO -0.00 -0.06 1.33 0.00 -1.11 0.00 0.00 175.55 175.71 1ohq s ALA 61 N -0.43 2.66 0.29 3.71 0.00 -0.78 -4.85 121.76 122.35 1ohq s ALA 61 Ca -0.05 1.28 0.01 0.00 0.00 0.00 0.00 51.96 53.21 1ohq s ALA 61 Cb -0.03 -3.56 0.56 0.00 0.00 0.00 0.00 23.12 20.09 1ohq s ALA 61 CO -0.00 -1.43 1.84 -0.44 0.00 0.00 0.00 175.76 175.73 1ohq h ASP 62 N 1.14 0.92 1.38 0.00 5.19 -1.94 -2.31 116.42 120.81 1ohq h ASP 62 Ca -0.51 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1ohq h ASP 62 Cb 1.31 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.68 1ohq h ASP 62 CO 0.56 0.50 0.00 0.77 -3.12 0.00 0.00 179.24 177.95 1ohq h SER 63 N 0.99 0.00 -0.07 6.45 4.64 -1.98 -3.21 113.55 120.38 1ohq h SER 63 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1ohq h SER 63 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1ohq h SER 63 CO -0.25 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.04 1ohq n VAL 64 N -3.01 0.16 -2.08 0.95 0.24 -0.94 -4.98 118.33 108.68 1ohq n VAL 64 Ca 0.02 -0.58 -0.41 0.00 -2.04 0.00 0.00 64.34 61.33 1ohq n VAL 64 Cb 0.39 1.11 -0.03 0.00 -1.47 0.00 0.00 33.84 33.85 1ohq n VAL 64 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1ohq s LYS 65 N -0.93 4.30 0.00 7.34 1.02 -0.92 -1.82 119.74 128.74 1ohq s LYS 65 Ca 0.14 2.21 0.00 0.00 0.02 0.00 0.00 55.97 58.34 1ohq s LYS 65 Cb 0.10 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1ohq s LYS 65 CO 0.14 -0.39 0.00 0.41 -0.92 0.00 0.00 175.35 174.59 1ohq n GLY 66 N 2.53 2.43 0.07 -3.33 0.00 -1.26 -4.81 105.19 100.81 1ohq n GLY 66 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1ohq n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ohq n ARG 67 N -2.00 0.35 -4.04 1.61 1.74 -0.96 -5.03 116.66 108.34 1ohq n ARG 67 Ca 0.00 0.07 -0.33 0.00 -0.77 0.00 0.00 57.85 56.83 1ohq n ARG 67 Cb 0.00 -1.26 -0.06 0.00 -1.02 0.00 0.00 32.46 30.12 1ohq n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ohq s PHE 68 N -2.26 3.35 -0.09 -1.55 0.40 -0.76 -1.83 117.98 115.24 1ohq s PHE 68 Ca -0.18 0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.37 1ohq s PHE 68 Cb 0.05 -1.75 0.03 0.00 0.51 0.00 0.00 43.02 41.86 1ohq s PHE 68 CO 0.30 0.57 0.02 0.99 0.70 0.00 0.00 175.22 177.80 1ohq s THR 69 N -1.26 0.33 -0.01 0.64 2.01 -0.31 -4.90 115.64 112.14 1ohq s THR 69 Ca 0.25 0.04 -0.15 0.00 0.31 0.00 0.00 61.69 62.14 1ohq s THR 69 Cb -0.12 -0.57 -0.06 0.00 0.01 0.00 0.00 72.50 71.76 1ohq s THR 69 CO 0.17 0.16 0.42 -0.51 -0.69 0.00 0.00 174.62 174.17 1ohq s ILE 70 N 1.98 5.03 0.19 1.82 2.07 -1.26 -1.12 121.20 129.91 1ohq s ILE 70 Ca 0.04 0.86 -0.16 0.00 -1.41 0.00 0.00 60.65 59.99 1ohq s ILE 70 Cb -0.13 -3.73 0.02 0.00 0.13 0.00 0.00 42.46 38.75 1ohq s ILE 70 CO -0.06 0.56 0.47 -0.94 -1.91 0.00 0.00 174.94 173.06 1ohq s SER 71 N -0.92 -0.19 0.01 4.50 1.04 -1.11 -5.01 113.70 112.02 1ohq s SER 71 Ca 0.24 -0.57 0.08 0.00 0.48 0.00 0.00 55.95 56.18 1ohq s SER 71 Cb -0.17 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.48 1ohq s SER 71 CO 0.13 -1.02 -0.24 -0.13 0.98 0.00 0.00 173.24 172.97 1ohq s ARG 72 N -3.89 1.77 -0.48 4.02 0.52 -1.26 -1.15 118.95 118.47 1ohq s ARG 72 Ca 0.11 -0.93 0.00 0.00 -0.52 0.00 0.00 55.73 54.39 1ohq s ARG 72 Cb -0.00 -1.80 0.13 0.00 0.52 0.00 0.00 34.95 33.79 1ohq s ARG 72 CO -0.02 0.48 0.25 0.34 0.02 0.00 0.00 175.30 176.37 1ohq s ASP 73 N -0.86 4.92 0.48 0.23 -1.08 -0.70 -4.98 116.67 114.68 1ohq s ASP 73 Ca 0.09 -2.51 0.16 0.00 -0.52 0.00 0.00 52.55 49.77 1ohq s ASP 73 Cb -0.09 -1.75 1.12 0.00 -1.46 0.00 0.00 42.92 40.74 1ohq s ASP 73 CO 0.00 -0.39 2.05 0.78 0.52 0.00 0.00 175.17 178.14 1ohq h ASN 74 N 7.31 0.00 -0.58 -0.34 2.35 -1.97 -0.97 115.58 121.38 1ohq h ASN 74 Ca -0.07 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.59 1ohq h ASN 74 Cb 0.98 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.33 1ohq h ASN 74 CO 0.66 0.12 0.02 0.77 -1.65 0.00 0.00 177.43 177.35 1ohq h SER 75 N 0.00 1.00 0.23 5.81 4.64 -1.96 -3.06 113.55 120.20 1ohq h SER 75 Ca -0.00 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1ohq h SER 75 Cb 0.22 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1ohq h SER 75 CO 0.02 1.05 -0.33 0.29 -0.87 0.00 0.00 176.83 176.99 1ohq n LYS 76 N -4.23 0.77 -3.64 4.77 5.02 -0.96 -4.97 118.16 114.91 1ohq n LYS 76 Ca 0.02 -0.49 -0.21 0.00 -2.02 0.00 0.00 58.31 55.62 1ohq n LYS 76 Cb 0.33 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1ohq n LYS 76 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ohq n ASN 77 N -0.69 -1.90 -3.88 4.39 5.15 -0.41 -4.84 115.26 113.08 1ohq n ASN 77 Ca 0.11 -0.81 -0.18 0.00 -0.60 0.00 0.00 54.58 53.10 1ohq n ASN 77 Cb 0.36 -4.19 -0.16 0.00 -0.53 0.00 0.00 39.78 35.26 1ohq n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1ohq s THR 78 N -3.61 0.39 -0.00 -0.44 2.01 -1.09 -1.88 115.64 111.02 1ohq s THR 78 Ca 0.07 -0.07 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 1ohq s THR 78 Cb -0.02 -0.43 -0.05 0.00 0.01 0.00 0.00 72.50 72.01 1ohq s THR 78 CO 0.80 0.18 0.37 -0.22 -0.69 0.00 0.00 174.62 175.06 1ohq s LEU 79 N 0.76 4.44 0.24 4.42 2.96 -0.75 -1.73 118.68 129.02 1ohq s LEU 79 Ca -0.09 0.85 0.11 0.00 -0.22 0.00 0.00 54.13 54.78 1ohq s LEU 79 Cb -0.12 -2.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.93 1ohq s LEU 79 CO -0.00 0.31 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.83 1ohq s TYR 80 N -1.14 2.16 -0.33 5.38 2.02 -0.30 -0.79 117.35 124.36 1ohq s TYR 80 Ca 0.24 -0.39 -0.02 0.00 -0.37 0.00 0.00 57.07 56.54 1ohq s TYR 80 Cb -0.15 -0.98 0.11 0.00 -0.40 0.00 0.00 41.96 40.54 1ohq s TYR 80 CO 0.13 0.59 0.15 -1.17 -1.57 0.00 0.00 175.55 173.68 1ohq s LEU 81 N -3.27 1.31 -0.36 -1.29 2.96 -0.55 -2.74 118.68 114.74 1ohq s LEU 81 Ca 0.26 -1.73 -0.29 0.00 -0.22 0.00 0.00 54.13 52.15 1ohq s LEU 81 Cb -0.05 -0.57 0.01 0.00 0.50 0.00 0.00 46.19 46.09 1ohq s LEU 81 CO 0.12 -0.38 1.27 -1.58 -1.32 0.00 0.00 176.35 174.46 1ohq s GLN 82 N 1.55 3.82 -0.39 1.98 2.00 -0.27 -2.19 119.66 126.16 1ohq s GLN 82 Ca 0.12 1.02 -0.08 0.00 -2.00 0.00 0.00 55.36 54.43 1ohq s GLN 82 Cb -0.19 -3.90 0.07 0.00 0.80 0.00 0.00 33.01 29.78 1ohq s GLN 82 CO -0.21 -1.25 0.20 -1.64 -0.50 0.00 0.00 175.29 171.89 1ohq s MET 83 N 4.34 2.58 0.33 1.67 -1.94 -0.46 -1.16 119.30 124.67 1ohq s MET 83 Ca 0.55 -1.37 0.07 0.00 -1.71 0.00 0.00 55.69 53.22 1ohq s MET 83 Cb -0.14 -3.66 -0.02 0.00 2.01 0.00 0.00 34.83 33.02 1ohq s MET 83 CO 0.26 -0.85 0.35 -0.80 -0.01 0.00 0.00 175.02 173.97 1ohq s ASN 84 N 1.83 5.55 -1.43 3.03 0.01 -0.76 -1.31 114.94 121.85 1ohq s ASN 84 Ca 0.02 -0.37 -0.04 0.00 -0.71 0.00 0.00 52.86 51.76 1ohq s ASN 84 Cb -0.22 -1.09 0.03 0.00 0.41 0.00 0.00 41.25 40.38 1ohq s ASN 84 CO 0.02 -0.37 0.60 -1.20 -1.51 0.00 0.00 177.10 174.64 1ohq n SER 85 N -1.46 -1.40 -4.77 -1.22 7.64 -1.11 -4.70 113.62 106.60 1ohq n SER 85 Ca -0.02 -0.93 -0.41 0.00 1.01 0.00 0.00 58.87 58.53 1ohq n SER 85 Cb 0.59 -3.38 -0.01 0.00 -1.01 0.00 0.00 64.21 60.40 1ohq n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ohq s LEU 86 N -6.96 4.35 0.46 -3.43 1.43 -0.99 -4.69 118.68 108.85 1ohq s LEU 86 Ca 0.17 2.79 0.03 0.00 -1.03 0.00 0.00 54.13 56.08 1ohq s LEU 86 Cb -0.09 -3.71 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 1ohq s LEU 86 CO 0.87 -0.70 0.09 0.00 0.23 0.00 0.00 176.35 176.83 1ohq s ARG 87 N -1.98 2.07 0.44 1.70 1.70 -1.26 -1.03 118.95 120.60 1ohq s ARG 87 Ca 0.52 -2.30 0.12 0.00 -0.47 0.00 0.00 55.73 53.60 1ohq s ARG 87 Cb -0.41 -0.96 0.98 0.00 -0.57 0.00 0.00 34.95 33.99 1ohq s ARG 87 CO 0.55 -0.47 2.01 0.00 -1.08 0.00 0.00 175.30 176.32 1ohq h ALA 88 N 1.57 1.71 0.00 7.88 0.00 -1.97 -2.48 119.26 125.97 1ohq h ALA 88 Ca -0.38 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1ohq h ALA 88 Cb 1.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1ohq h ALA 88 CO 0.62 0.22 0.00 1.05 0.00 0.00 0.00 179.25 181.14 1ohq h GLU 89 N 0.13 0.00 -0.00 0.00 4.11 -1.96 -2.42 114.58 114.43 1ohq h GLU 89 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1ohq h GLU 89 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1ohq h GLU 89 CO 0.01 0.00 -0.25 -0.25 0.07 0.00 0.00 179.01 178.59 1ohq n ASP 90 N -2.64 0.40 -4.57 3.06 8.00 -0.93 -4.82 116.55 115.05 1ohq n ASP 90 Ca -0.01 -0.17 -0.44 0.00 0.71 0.00 0.00 54.79 54.89 1ohq n ASP 90 Cb 0.14 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.16 1ohq n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1ohq n THR 91 N -1.31 0.26 -3.63 -3.53 -1.04 -0.91 -4.87 114.28 99.25 1ohq n THR 91 Ca 0.08 -0.47 -0.05 0.00 -2.04 0.00 0.00 64.05 61.57 1ohq n THR 91 Cb 0.32 -2.42 -0.02 0.00 -1.82 0.00 0.00 70.33 66.39 1ohq n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ohq s ALA 92 N 8.63 -1.76 -0.24 2.41 0.00 -0.74 -3.96 121.76 126.10 1ohq s ALA 92 Ca 1.02 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 53.36 1ohq s ALA 92 Cb -0.41 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1ohq s ALA 92 CO 0.37 -0.88 0.58 0.08 0.00 0.00 0.00 175.76 175.91 1ohq s VAL 93 N -3.16 5.04 -0.18 0.00 1.01 -0.87 -1.50 120.40 120.73 1ohq s VAL 93 Ca 0.09 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 63.02 1ohq s VAL 93 Cb -0.01 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1ohq s VAL 93 CO -0.03 0.08 0.10 -0.31 0.00 0.00 0.00 175.10 174.95 1ohq s TYR 94 N 2.20 3.36 -0.19 5.22 1.51 0.35 -1.90 117.35 127.91 1ohq s TYR 94 Ca 0.25 0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 56.55 1ohq s TYR 94 Cb -0.16 -2.10 0.00 0.00 -0.11 0.00 0.00 41.96 39.59 1ohq s TYR 94 CO 0.09 0.28 -0.12 0.71 -1.11 0.00 0.00 175.55 175.40 1ohq s TYR 95 N 0.21 2.85 0.74 2.71 2.02 0.89 -1.07 117.35 125.71 1ohq s TYR 95 Ca 0.07 -1.18 -0.15 0.00 -0.37 0.00 0.00 57.07 55.44 1ohq s TYR 95 Cb -0.12 -1.98 0.05 0.00 -0.40 0.00 0.00 41.96 39.51 1ohq s TYR 95 CO -0.01 -0.60 1.20 0.00 -1.57 0.00 0.00 175.55 174.57 1ohq s ALA 97 N -2.04 -0.61 0.23 0.00 0.00 -0.25 -2.15 121.76 116.94 1ohq s ALA 97 Ca 0.74 -0.13 -0.13 0.00 0.00 0.00 0.00 51.96 52.44 1ohq s ALA 97 Cb -0.29 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1ohq s ALA 97 CO 0.46 -0.45 0.47 -1.54 0.00 0.00 0.00 175.76 174.70 1ohq s SER 98 N -2.29 -0.11 -0.15 0.00 1.04 -1.07 -2.09 113.70 109.03 1ohq s SER 98 Ca -0.02 -0.84 -0.04 0.00 0.48 0.00 0.00 55.95 55.53 1ohq s SER 98 Cb 0.00 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.76 1ohq s SER 98 CO -0.06 -1.11 0.16 0.00 0.98 0.00 0.00 173.24 173.22 1ohq s ALA 99 N -3.99 -0.02 -0.03 5.32 0.00 -0.80 -1.88 121.76 120.37 1ohq s ALA 99 Ca 0.19 0.18 0.03 0.00 0.00 0.00 0.00 51.96 52.37 1ohq s ALA 99 Cb -0.00 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 1ohq s ALA 99 CO 0.06 -0.97 -0.12 -0.51 0.00 0.00 0.00 175.76 174.22 1ohq s LEU 100 N 2.26 2.88 -0.49 0.00 2.01 -0.57 -3.85 118.68 120.92 1ohq s LEU 100 Ca 0.04 -0.18 0.06 0.00 0.01 0.00 0.00 54.13 54.06 1ohq s LEU 100 Cb -0.15 -1.63 0.22 0.00 0.01 0.00 0.00 46.19 44.65 1ohq s LEU 100 CO -0.09 0.32 0.52 -1.84 1.01 0.00 0.00 176.35 176.28 1ohq n GLU 101 N 2.04 1.14 0.26 1.70 0.28 -1.26 -0.03 120.64 124.76 1ohq n GLU 101 Ca -0.17 -3.71 0.12 0.00 -0.16 0.00 0.00 57.16 53.25 1ohq n GLU 101 Cb 0.52 -1.71 0.69 0.00 1.43 0.00 0.00 31.44 32.38 1ohq n GLU 101 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 1ohq h PRO 102 N 4.64 0.00 -2.09 3.44 0.13 -1.99 -3.29 132.00 132.84 1ohq h PRO 102 Ca 0.16 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.71 1ohq h PRO 102 Cb 0.82 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.55 1ohq h PRO 102 CO 0.56 0.13 -0.86 1.28 -0.23 0.00 0.00 178.00 178.88 1ohq n LEU 103 N -3.63 1.92 0.00 1.56 4.77 -1.26 -4.98 117.00 115.37 1ohq n LEU 103 Ca -0.02 -5.06 0.00 0.00 -0.03 0.00 0.00 56.01 50.90 1ohq n LEU 103 Cb 0.26 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1ohq n LEU 103 CO 0.31 2.08 0.00 -0.24 -1.33 0.00 0.00 177.39 178.20 1ohq n SER 104 N 1.10 0.00 -3.87 -1.43 2.88 -1.24 -4.93 113.62 106.13 1ohq n SER 104 Ca 0.25 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.68 1ohq n SER 104 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.83 1ohq n SER 104 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1ohq s GLU 105 N -0.04 0.42 0.02 -1.46 0.41 -1.26 -5.05 118.70 111.73 1ohq s GLU 105 Ca 0.00 -0.31 -0.30 0.00 -0.41 0.00 0.00 54.97 53.94 1ohq s GLU 105 Cb 0.00 0.17 -0.06 0.00 -1.78 0.00 0.00 34.13 32.46 1ohq s GLU 105 CO 0.00 -0.09 1.53 -1.25 -0.49 0.00 0.00 175.26 174.95 1ohq s PRO 106 N -1.14 4.23 0.18 0.39 0.05 -1.26 -4.29 135.00 133.16 1ohq s PRO 106 Ca -0.12 2.13 -0.15 0.00 0.05 0.00 0.00 61.00 62.91 1ohq s PRO 106 Cb -0.07 -3.64 -0.07 0.00 0.05 0.00 0.00 34.50 30.77 1ohq s PRO 106 CO 0.01 -0.68 0.60 -0.51 0.05 0.00 0.00 177.00 176.48 1ohq s LEU 107 N 2.73 4.31 0.11 -3.56 1.43 0.96 -4.93 118.68 119.72 1ohq s LEU 107 Ca 0.69 1.15 0.07 0.00 -1.03 0.00 0.00 54.13 55.01 1ohq s LEU 107 Cb -0.35 -3.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 1ohq s LEU 107 CO 0.29 0.05 -0.08 -0.83 0.23 0.00 0.00 176.35 176.01 1ohq s GLY 108 N -1.79 1.82 0.06 -3.19 0.00 -1.26 -1.51 107.32 101.44 1ohq s GLY 108 Ca 0.41 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.92 1ohq s GLY 108 CO 0.20 -1.21 -0.07 -1.36 0.00 0.00 0.00 173.10 170.66 1ohq s PHE 109 N -1.26 0.73 0.02 1.90 0.40 -0.79 -5.02 117.98 113.96 1ohq s PHE 109 Ca 0.23 -0.70 -0.02 0.00 -0.60 0.00 0.00 56.93 55.83 1ohq s PHE 109 Cb -0.11 -0.43 -0.01 0.00 0.51 0.00 0.00 43.02 42.97 1ohq s PHE 109 CO 0.15 -0.13 0.02 -1.58 0.70 0.00 0.00 175.22 174.38 1ohq s TRP 110 N -2.42 0.21 0.41 0.36 0.52 -1.26 -2.59 118.94 114.18 1ohq s TRP 110 Ca -0.01 -0.44 -0.06 0.00 0.02 0.00 0.00 56.10 55.61 1ohq s TRP 110 Cb -0.03 -0.16 0.09 0.00 -1.15 0.00 0.00 33.47 32.23 1ohq s TRP 110 CO -0.02 -0.24 0.57 0.41 0.02 0.00 0.00 176.95 177.68 1ohq n GLY 111 N 1.43 -0.92 0.23 0.98 0.00 -0.91 -4.58 105.19 101.43 1ohq n GLY 111 Ca -0.23 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.17 1ohq n GLY 111 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1ohq h GLN 112 N 0.00 0.00 0.00 1.61 -0.00 -1.92 -3.45 115.11 111.35 1ohq h GLN 112 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.47 1ohq h GLN 112 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.01 1ohq h GLN 112 CO 0.14 0.09 0.00 0.41 -0.00 0.00 0.00 178.83 179.47 1ohq n GLY 113 N 0.61 0.41 2.91 0.06 0.00 -1.26 -5.05 105.19 102.87 1ohq n GLY 113 Ca 0.02 -1.38 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 1ohq n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ohq s THR 114 N -0.94 0.54 -0.03 2.61 2.01 -0.23 -4.89 115.64 114.71 1ohq s THR 114 Ca 0.00 -0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.56 1ohq s THR 114 Cb 0.00 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.94 1ohq s THR 114 CO 0.00 0.22 0.96 -0.22 -0.69 0.00 0.00 174.62 174.89 1ohq s LEU 115 N 0.77 4.34 -0.15 4.42 2.96 -1.26 -0.49 118.68 129.26 1ohq s LEU 115 Ca -0.10 1.59 0.02 0.00 -0.22 0.00 0.00 54.13 55.42 1ohq s LEU 115 Cb -0.13 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.04 1ohq s LEU 115 CO 0.00 -0.29 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.85 1ohq s VAL 116 N 1.22 1.99 -0.09 1.68 1.01 -0.56 -2.02 120.40 123.63 1ohq s VAL 116 Ca 0.50 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1ohq s VAL 116 Cb -0.20 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1ohq s VAL 116 CO 0.25 0.53 -0.19 -0.89 0.00 0.00 0.00 175.10 174.80 1ohq s THR 117 N 1.00 2.52 -0.24 3.92 2.01 -0.98 -1.79 115.64 122.08 1ohq s THR 117 Ca -0.03 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 1ohq s THR 117 Cb -0.15 -1.99 0.01 0.00 0.01 0.00 0.00 72.50 70.38 1ohq s THR 117 CO -0.05 0.56 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.71 1ohq s VAL 118 N 0.06 3.27 0.00 3.82 1.01 -1.26 -1.44 120.40 125.86 1ohq s VAL 118 Ca -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1ohq s VAL 118 Cb -0.15 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.64 1ohq s VAL 118 CO 0.05 0.28 0.00 -1.54 0.00 0.00 0.00 175.10 173.89