#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oxp s HIS 8 N 0.00 -0.03 0.20 -1.77 -3.43 -1.26 -5.12 115.29 103.87 2oxp s HIS 8 Ca 0.00 0.09 -0.30 0.00 -0.80 0.00 0.00 55.06 54.05 2oxp s HIS 8 Cb 0.00 0.00 -0.08 0.00 -1.43 0.00 0.00 32.58 31.07 2oxp s HIS 8 CO 0.00 -0.05 0.93 0.15 -2.00 0.00 0.00 174.74 173.77 2oxp s LYS 9 N -0.14 4.79 0.09 -0.38 1.02 -1.26 -4.40 119.74 119.46 2oxp s LYS 9 Ca -0.02 1.45 0.08 0.00 0.02 0.00 0.00 55.97 57.50 2oxp s LYS 9 Cb -0.01 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 2oxp s LYS 9 CO 0.00 0.44 -0.22 -1.21 -0.92 0.00 0.00 175.35 173.44 2oxp s GLU 10 N -0.85 1.24 0.52 1.68 2.02 0.51 -4.93 118.70 118.89 2oxp s GLU 10 Ca 0.42 -1.12 -0.20 0.00 0.02 0.00 0.00 54.97 54.09 2oxp s GLU 10 Cb -0.25 -1.49 -0.07 0.00 0.10 0.00 0.00 34.13 32.42 2oxp s GLU 10 CO 0.31 0.36 1.10 -1.25 0.02 0.00 0.00 175.26 175.80 2oxp s PRO 11 N -1.71 3.51 0.17 0.39 0.04 -1.26 -0.45 135.00 135.68 2oxp s PRO 11 Ca 0.08 1.54 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 2oxp s PRO 11 Cb -0.10 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.43 2oxp s PRO 11 CO 0.04 -0.71 0.47 0.00 0.04 0.00 0.00 177.00 176.84 2oxp s ALA 12 N -1.82 -0.94 -0.06 8.56 0.00 -0.79 -4.66 121.76 122.04 2oxp s ALA 12 Ca 0.71 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 52.58 2oxp s ALA 12 Cb -0.22 0.80 -0.00 0.00 0.00 0.00 0.00 23.12 23.70 2oxp s ALA 12 CO 0.25 -0.74 -0.22 0.99 0.00 0.00 0.00 175.76 176.04 2oxp s THR 13 N -3.84 1.86 0.07 0.00 2.01 -0.56 -4.15 115.64 111.03 2oxp s THR 13 Ca 0.07 -0.94 -0.31 0.00 0.31 0.00 0.00 61.69 60.82 2oxp s THR 13 Cb 0.00 -1.59 -0.08 0.00 0.01 0.00 0.00 72.50 70.85 2oxp s THR 13 CO -0.07 0.52 1.49 -0.22 -0.69 0.00 0.00 174.62 175.66 2oxp s LEU 14 N 0.05 4.35 -0.20 4.42 0.20 -1.26 -0.14 118.68 126.10 2oxp s LEU 14 Ca -0.08 2.35 -0.10 0.00 0.69 0.00 0.00 54.13 56.98 2oxp s LEU 14 Cb -0.14 -3.57 -0.09 0.00 -0.43 0.00 0.00 46.19 41.96 2oxp s LEU 14 CO 0.05 -0.76 -0.26 -0.38 -0.29 0.00 0.00 176.35 174.70 2oxp n ILE 15 N 4.39 1.14 -3.62 6.68 5.41 -0.47 -4.85 119.36 128.04 2oxp n ILE 15 Ca 0.14 -0.27 -0.10 0.00 1.00 0.00 0.00 62.75 63.52 2oxp n ILE 15 Cb 0.42 -1.79 -0.06 0.00 -0.71 0.00 0.00 39.64 37.49 2oxp n ILE 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2oxp s LYS 16 N -2.39 0.54 0.58 0.38 -2.85 -0.98 -5.03 119.74 109.99 2oxp s LYS 16 Ca -0.28 0.43 -0.17 0.00 -1.00 0.00 0.00 55.97 54.95 2oxp s LYS 16 Cb 0.11 0.26 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 2oxp s LYS 16 CO 0.36 -0.11 1.07 0.00 0.10 0.00 0.00 175.35 176.77 2oxp s ALA 17 N -0.25 2.71 0.14 0.59 0.00 -1.26 -1.09 121.76 122.61 2oxp s ALA 17 Ca 0.01 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.50 2oxp s ALA 17 Cb -0.03 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.82 2oxp s ALA 17 CO -0.03 -0.78 0.00 -0.89 0.00 0.00 0.00 175.76 174.06 2oxp n ILE 18 N -1.77 0.89 -3.36 0.00 5.41 -1.18 -4.79 119.36 114.56 2oxp n ILE 18 Ca 0.10 0.30 -0.00 0.00 1.00 0.00 0.00 62.75 64.14 2oxp n ILE 18 Cb 0.52 -1.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.13 2oxp n ILE 18 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2oxp n ASP 19 N -3.47 -0.01 -0.34 4.38 3.85 -0.84 -5.00 116.55 115.12 2oxp n ASP 19 Ca 0.00 -1.00 0.18 0.00 -0.71 0.00 0.00 54.79 53.26 2oxp n ASP 19 Cb 0.02 0.01 0.39 0.00 -1.35 0.00 0.00 41.12 40.19 2oxp n ASP 19 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2oxp h GLY 20 N 0.01 1.89 -0.22 6.12 0.00 -1.80 -2.97 103.07 106.10 2oxp h GLY 20 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2oxp h GLY 20 CO 0.00 -0.30 -0.11 2.09 0.00 0.00 0.00 176.54 178.23 2oxp n ASP 21 N -4.94 1.92 -3.80 0.19 3.85 -1.26 -4.72 116.55 107.78 2oxp n ASP 21 Ca 0.27 -2.92 -0.13 0.00 -0.71 0.00 0.00 54.79 51.30 2oxp n ASP 21 Cb 0.78 -0.39 -0.14 0.00 -1.35 0.00 0.00 41.12 40.01 2oxp n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2oxp s THR 22 N -2.38 -0.03 -0.03 2.12 2.01 -1.12 -0.75 115.64 115.46 2oxp s THR 22 Ca 0.27 0.10 -0.05 0.00 0.31 0.00 0.00 61.69 62.32 2oxp s THR 22 Cb 0.24 -0.13 0.01 0.00 0.01 0.00 0.00 72.50 72.62 2oxp s THR 22 CO 0.02 0.04 0.13 -0.69 -0.69 0.00 0.00 174.62 173.43 2oxp s VAL 23 N 0.58 0.03 -0.23 3.82 1.01 -0.58 -1.99 120.40 123.05 2oxp s VAL 23 Ca -0.05 -0.26 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 2oxp s VAL 23 Cb -0.06 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 2oxp s VAL 23 CO -0.02 -0.14 0.52 -0.75 0.00 0.00 0.00 175.10 174.71 2oxp s LYS 24 N -0.45 4.14 0.08 2.72 2.47 -0.25 -0.27 119.74 128.18 2oxp s LYS 24 Ca -0.05 0.38 0.05 0.00 -1.56 0.00 0.00 55.97 54.79 2oxp s LYS 24 Cb -0.03 -3.60 -0.03 0.00 -1.46 0.00 0.00 37.83 32.70 2oxp s LYS 24 CO 0.01 -0.24 -0.14 -0.51 0.16 0.00 0.00 175.35 174.62 2oxp s LEU 25 N 1.94 2.31 -0.29 5.43 1.02 0.25 -1.37 118.68 127.97 2oxp s LEU 25 Ca 0.23 -0.66 -0.17 0.00 0.02 0.00 0.00 54.13 53.55 2oxp s LEU 25 Cb -0.15 -0.51 -0.02 0.00 0.02 0.00 0.00 46.19 45.52 2oxp s LEU 25 CO 0.09 -0.10 0.46 -0.32 0.02 0.00 0.00 176.35 176.51 2oxp s MET 26 N -1.98 3.92 -0.14 1.70 -2.45 0.80 -0.21 119.30 120.94 2oxp s MET 26 Ca 0.01 0.08 -0.00 0.00 -1.25 0.00 0.00 55.69 54.52 2oxp s MET 26 Cb -0.09 -3.70 0.03 0.00 1.25 0.00 0.00 34.83 32.32 2oxp s MET 26 CO 0.02 -0.41 -0.10 -0.47 1.05 0.00 0.00 175.02 175.11 2oxp s TYR 27 N 2.24 1.87 -1.40 4.11 5.04 0.04 -1.49 117.35 127.75 2oxp s TYR 27 Ca 0.18 -1.05 -0.05 0.00 -2.44 0.00 0.00 57.07 53.70 2oxp s TYR 27 Cb -0.16 -1.43 0.03 0.00 0.35 0.00 0.00 41.96 40.76 2oxp s TYR 27 CO 0.11 -0.61 0.79 1.63 -1.34 0.00 0.00 175.55 176.13 2oxp n LYS 28 N 4.84 -5.06 -0.89 4.97 5.02 -1.26 -1.67 118.16 124.12 2oxp n LYS 28 Ca -0.14 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 2oxp n LYS 28 Cb 0.49 -5.26 0.00 0.00 -0.02 0.00 0.00 35.03 30.24 2oxp n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2oxp n GLY 29 N -1.65 0.65 3.15 0.72 0.00 -1.26 -5.00 105.19 101.80 2oxp n GLY 29 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2oxp n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oxp s GLN 30 N -0.34 2.63 0.24 1.61 -0.21 -0.67 -5.11 119.66 117.81 2oxp s GLN 30 Ca 0.00 -0.73 -0.30 0.00 0.02 0.00 0.00 55.36 54.36 2oxp s GLN 30 Cb 0.00 -2.06 -0.09 0.00 1.00 0.00 0.00 33.01 31.86 2oxp s GLN 30 CO 0.00 0.08 1.19 -1.25 -2.12 0.00 0.00 175.29 173.20 2oxp s PRO 31 N 0.57 4.51 -0.01 2.91 0.04 -1.26 -0.78 135.00 140.98 2oxp s PRO 31 Ca -0.15 1.92 -0.29 0.00 0.04 0.00 0.00 61.00 62.53 2oxp s PRO 31 Cb -0.17 -3.19 0.07 0.00 0.04 0.00 0.00 34.50 31.25 2oxp s PRO 31 CO 0.05 -0.02 0.65 0.00 0.04 0.00 0.00 177.00 177.71 2oxp s MET 32 N -0.85 1.09 0.00 4.56 0.23 0.71 -4.92 119.30 120.11 2oxp s MET 32 Ca 0.50 0.09 -0.24 0.00 -1.03 0.00 0.00 55.69 55.01 2oxp s MET 32 Cb -0.34 0.51 -0.05 0.00 -1.53 0.00 0.00 34.83 33.42 2oxp s MET 32 CO 0.41 -0.37 0.74 0.99 -2.03 0.00 0.00 175.02 174.76 2oxp s THR 33 N -1.72 4.86 -0.13 3.16 2.01 -1.26 -0.58 115.64 121.97 2oxp s THR 33 Ca -0.09 1.56 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2oxp s THR 33 Cb -0.00 -4.08 -0.01 0.00 0.01 0.00 0.00 72.50 68.41 2oxp s THR 33 CO 0.05 0.32 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.80 2oxp s PHE 34 N 0.26 2.79 -0.25 4.92 0.40 0.63 -0.36 117.98 126.36 2oxp s PHE 34 Ca 0.38 -0.73 -0.10 0.00 -0.60 0.00 0.00 56.93 55.88 2oxp s PHE 34 Cb -0.19 -1.84 -0.05 0.00 0.51 0.00 0.00 43.02 41.45 2oxp s PHE 34 CO 0.21 -0.27 0.16 0.50 0.70 0.00 0.00 175.22 176.52 2oxp s ARG 35 N 0.43 3.99 0.11 0.44 6.06 0.12 -1.52 118.95 128.57 2oxp s ARG 35 Ca -0.11 -0.31 -0.31 0.00 -2.50 0.00 0.00 55.73 52.50 2oxp s ARG 35 Cb -0.16 -3.54 -0.09 0.00 0.06 0.00 0.00 34.95 31.22 2oxp s ARG 35 CO 0.05 -0.03 1.59 -0.51 -2.50 0.00 0.00 175.30 173.90 2oxp s LEU 36 N 1.31 4.37 0.49 -0.88 1.02 0.07 -3.11 118.68 121.95 2oxp s LEU 36 Ca 0.07 2.52 -0.23 0.00 0.02 0.00 0.00 54.13 56.51 2oxp s LEU 36 Cb -0.14 -3.58 -0.06 0.00 0.02 0.00 0.00 46.19 42.42 2oxp s LEU 36 CO 0.06 -0.84 1.28 -0.76 0.02 0.00 0.00 176.35 176.12 2oxp s LEU 37 N 1.90 3.97 -0.58 1.79 1.43 -0.30 -3.85 118.68 123.04 2oxp s LEU 37 Ca 0.71 2.58 0.00 0.00 -1.03 0.00 0.00 54.13 56.39 2oxp s LEU 37 Cb -0.41 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 41.61 2oxp s LEU 37 CO 0.31 -1.21 0.00 0.18 0.23 0.00 0.00 176.35 175.86 2oxp n LEU 38 N -0.64 0.26 -4.27 1.79 4.77 -1.25 -4.94 117.00 112.71 2oxp n LEU 38 Ca 0.08 0.14 -0.19 0.00 -0.03 0.00 0.00 56.01 56.01 2oxp n LEU 38 Cb 0.46 -2.44 -0.11 0.00 -2.33 0.00 0.00 43.42 39.00 2oxp n LEU 38 CO 0.51 -0.95 -0.46 0.68 -1.33 0.00 0.00 177.39 175.85 2oxp s VAL 39 N -1.41 1.47 -0.24 4.08 -7.23 -1.22 -1.63 120.40 114.22 2oxp s VAL 39 Ca 0.00 -1.79 -0.04 0.00 -1.81 0.00 0.00 61.98 58.34 2oxp s VAL 39 Cb 0.00 -1.64 0.08 0.00 0.56 0.00 0.00 36.38 35.38 2oxp s VAL 39 CO 0.00 -0.40 0.10 -0.62 -0.31 0.00 0.00 175.10 173.88 2oxp s ASP 40 N -2.55 3.10 0.31 4.85 -1.08 -0.38 -4.69 116.67 116.23 2oxp s ASP 40 Ca 0.11 -1.03 -0.05 0.00 -0.52 0.00 0.00 52.55 51.06 2oxp s ASP 40 Cb -0.05 -0.38 -0.05 0.00 -1.46 0.00 0.00 42.92 40.98 2oxp s ASP 40 CO 0.04 -0.39 0.58 0.42 0.52 0.00 0.00 175.17 176.33 2oxp s THR 41 N 2.05 5.01 0.49 1.71 -4.23 -1.26 -1.82 115.64 117.59 2oxp s THR 41 Ca 0.06 0.04 -0.23 0.00 -1.18 0.00 0.00 61.69 60.38 2oxp s THR 41 Cb -0.16 -3.75 -0.06 0.00 1.34 0.00 0.00 72.50 69.86 2oxp s THR 41 CO -0.23 -0.38 1.35 -2.84 -0.54 0.00 0.00 174.62 171.97 2oxp s PRO 42 N -3.70 3.46 0.16 3.99 0.02 -1.26 -4.95 135.00 132.71 2oxp s PRO 42 Ca 0.44 2.22 -0.30 0.00 0.02 0.00 0.00 61.00 63.38 2oxp s PRO 42 Cb -0.11 -2.44 -0.07 0.00 0.02 0.00 0.00 34.50 31.90 2oxp s PRO 42 CO 0.31 -0.93 1.11 -1.21 -0.33 0.00 0.00 177.00 175.96 2oxp s GLU 43 N -2.68 4.57 -0.78 5.54 2.02 -1.26 -4.50 118.70 121.60 2oxp s GLU 43 Ca 0.66 1.72 -0.18 0.00 0.02 0.00 0.00 54.97 57.19 2oxp s GLU 43 Cb -0.39 -3.29 0.14 0.00 0.10 0.00 0.00 34.13 30.69 2oxp s GLU 43 CO 0.48 0.02 0.89 0.95 0.02 0.00 0.00 175.26 177.62 2oxp s THR 44 N -0.02 4.97 0.01 3.63 -4.23 -1.26 -0.82 115.64 117.92 2oxp s THR 44 Ca 0.51 -1.57 -0.15 0.00 -1.18 0.00 0.00 61.69 59.30 2oxp s THR 44 Cb -0.29 -4.60 0.02 0.00 1.34 0.00 0.00 72.50 68.97 2oxp s THR 44 CO 0.34 -1.26 0.32 0.54 -0.54 0.00 0.00 174.62 174.02 2oxp s VAL 51 N 2.08 0.07 0.23 2.29 0.11 -1.26 -5.01 120.40 118.91 2oxp s VAL 51 Ca 0.21 -0.56 0.07 0.00 -2.93 0.00 0.00 61.98 58.78 2oxp s VAL 51 Cb -0.13 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 2oxp s VAL 51 CO -0.03 -0.31 0.14 -1.61 -3.33 0.00 0.00 175.10 169.97 2oxp s GLU 52 N -1.87 2.80 0.12 1.54 2.02 -0.00 -5.05 118.70 118.26 2oxp s GLU 52 Ca -0.10 -1.07 -0.31 0.00 0.02 0.00 0.00 54.97 53.52 2oxp s GLU 52 Cb -0.03 -2.51 -0.10 0.00 0.10 0.00 0.00 34.13 31.58 2oxp s GLU 52 CO 0.01 0.42 1.86 1.63 0.02 0.00 0.00 175.26 179.20 2oxp n LYS 53 N -0.90 2.84 -0.99 1.61 5.02 -1.26 -1.48 118.16 123.00 2oxp n LYS 53 Ca -0.08 1.03 0.00 0.00 -2.02 0.00 0.00 58.31 57.24 2oxp n LYS 53 Cb 0.57 -2.94 0.00 0.00 -0.02 0.00 0.00 35.03 32.64 2oxp n LYS 53 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2oxp n TYR 54 N 5.85 0.00 0.28 2.13 4.01 -1.26 -4.79 117.16 123.38 2oxp n TYR 54 Ca 0.18 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.76 2oxp n TYR 54 Cb 0.38 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 39.20 2oxp n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2oxp h GLY 55 N 0.00 -0.69 0.98 2.72 0.00 -1.49 -0.15 103.07 104.45 2oxp h GLY 55 Ca 0.00 0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.61 2oxp h GLY 55 CO 0.00 -0.25 0.64 -2.55 0.00 0.00 0.00 176.54 174.38 2oxp h PRO 56 N -0.68 1.22 -0.27 4.80 0.11 -1.88 -1.50 132.00 133.80 2oxp h PRO 56 Ca -0.07 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2oxp h PRO 56 Cb 0.52 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 2oxp h PRO 56 CO 0.11 0.81 0.18 0.93 -0.21 0.00 0.00 178.00 179.82 2oxp h GLU 57 N 1.26 0.35 -0.70 1.05 3.07 -1.91 -0.08 114.58 117.63 2oxp h GLU 57 Ca 0.37 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.16 2oxp h GLU 57 Cb -0.07 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 27.73 2oxp h GLU 57 CO -0.10 0.23 0.25 0.00 -1.40 0.00 0.00 179.01 177.99 2oxp h ALA 58 N 1.10 0.91 -0.55 3.43 0.00 -0.62 -1.09 119.26 122.44 2oxp h ALA 58 Ca 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2oxp h ALA 58 Cb -0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2oxp h ALA 58 CO -0.03 0.56 0.20 0.77 0.00 0.00 0.00 179.25 180.75 2oxp h SER 59 N 1.01 0.78 -0.52 0.00 0.02 -0.98 -2.28 113.55 111.58 2oxp h SER 59 Ca 0.23 -0.19 -0.09 0.00 -0.84 0.00 0.00 61.79 60.91 2oxp h SER 59 Cb 0.25 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 2oxp h SER 59 CO -0.01 0.75 0.00 0.00 -1.14 0.00 0.00 176.83 176.43 2oxp h ALA 60 N 1.05 0.96 0.46 3.77 0.00 -0.77 -1.57 119.26 123.15 2oxp h ALA 60 Ca 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2oxp h ALA 60 Cb 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2oxp h ALA 60 CO -0.01 0.63 -0.24 0.35 0.00 0.00 0.00 179.25 179.98 2oxp h PHE 61 N 0.88 -0.63 -0.58 0.00 3.57 -0.98 -0.58 116.94 118.62 2oxp h PHE 61 Ca 0.16 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2oxp h PHE 61 Cb 0.51 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 2oxp h PHE 61 CO 0.03 -0.38 0.27 1.15 -2.23 0.00 0.00 178.31 177.15 2oxp h THR 62 N -0.65 1.21 -0.24 4.41 2.02 -1.41 -0.08 112.91 118.17 2oxp h THR 62 Ca -0.06 -0.61 0.02 0.00 0.77 0.00 0.00 66.41 66.54 2oxp h THR 62 Cb 0.51 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2oxp h THR 62 CO 0.08 0.24 0.09 0.50 0.37 0.00 0.00 175.52 176.80 2oxp h LYS 63 N 0.79 0.20 -0.26 6.66 3.64 -1.19 -0.35 116.57 126.05 2oxp h LYS 63 Ca 0.20 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.51 2oxp h LYS 63 Cb 0.13 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2oxp h LYS 63 CO -0.02 0.13 -0.05 -0.22 -2.27 0.00 0.00 179.45 177.02 2oxp h LYS 64 N 0.20 0.50 -0.71 1.90 3.64 -0.90 -0.74 116.57 120.45 2oxp h LYS 64 Ca 0.10 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2oxp h LYS 64 Cb 0.06 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 2oxp h LYS 64 CO -0.10 0.70 0.45 1.98 -2.27 0.00 0.00 179.45 180.21 2oxp h MET 65 N 0.25 0.95 -0.22 1.90 4.05 -0.85 -1.59 114.93 119.43 2oxp h MET 65 Ca 0.07 -0.07 -0.11 0.00 -0.28 0.00 0.00 59.70 59.31 2oxp h MET 65 Cb 0.51 -0.21 -0.00 0.00 -0.80 0.00 0.00 31.60 31.10 2oxp h MET 65 CO 0.02 0.66 -0.28 -0.44 0.23 0.00 0.00 176.91 177.10 2oxp h ASP 66 N 0.97 0.62 0.54 1.39 3.32 -1.00 -3.09 116.42 119.16 2oxp h ASP 66 Ca 0.26 -0.50 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 2oxp h ASP 66 Cb -0.07 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 2oxp h ASP 66 CO -0.05 1.00 -0.49 1.05 -1.72 0.00 0.00 179.24 179.03 2oxp h GLU 67 N 0.26 0.00 0.00 3.56 4.11 -1.02 -2.94 114.58 118.55 2oxp h GLU 67 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 2oxp h GLU 67 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2oxp h GLU 67 CO 0.07 0.49 -0.10 0.09 0.07 0.00 0.00 179.01 179.62 2oxp n ASN 68 N -3.89 0.42 -4.75 3.06 5.03 -0.61 -4.87 115.26 109.65 2oxp n ASN 68 Ca -0.01 0.43 -0.41 0.00 0.87 0.00 0.00 54.58 55.46 2oxp n ASN 68 Cb 0.52 -0.49 -0.03 0.00 -1.02 0.00 0.00 39.78 38.76 2oxp n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2oxp s ALA 69 N -3.05 3.52 0.08 5.41 0.00 -1.11 -4.92 121.76 121.68 2oxp s ALA 69 Ca 0.12 1.17 -0.02 0.00 0.00 0.00 0.00 51.96 53.23 2oxp s ALA 69 Cb 0.16 -3.48 -0.27 0.00 0.00 0.00 0.00 23.12 19.53 2oxp s ALA 69 CO 0.59 -0.56 1.14 -0.22 0.00 0.00 0.00 175.76 176.70 2oxp h LYS 70 N 4.47 0.22 -3.62 0.00 3.64 -1.89 -3.45 116.57 115.93 2oxp h LYS 70 Ca -0.47 -0.38 -0.32 0.00 -1.27 0.00 0.00 60.65 58.21 2oxp h LYS 70 Cb 1.22 0.14 -0.34 0.00 -0.41 0.00 0.00 32.23 32.84 2oxp h LYS 70 CO 0.72 1.17 -0.74 0.15 -2.27 0.00 0.00 179.45 178.48 2oxp s LYS 71 N -2.66 0.14 -0.13 1.90 1.02 -1.26 -5.02 119.74 113.73 2oxp s LYS 71 Ca -0.04 0.13 -0.02 0.00 0.02 0.00 0.00 55.97 56.06 2oxp s LYS 71 Cb 0.08 -0.38 -0.03 0.00 -0.52 0.00 0.00 37.83 36.98 2oxp s LYS 71 CO 0.87 -0.15 -0.05 0.42 -0.92 0.00 0.00 175.35 175.52 2oxp s ILE 72 N 1.06 3.81 0.03 2.17 -1.09 -1.26 -0.71 121.20 125.22 2oxp s ILE 72 Ca -0.09 -0.40 0.05 0.00 -2.23 0.00 0.00 60.65 57.98 2oxp s ILE 72 Cb -0.13 -2.64 -0.02 0.00 -1.58 0.00 0.00 42.46 38.09 2oxp s ILE 72 CO -0.02 0.52 -0.16 -1.61 -1.23 0.00 0.00 174.94 172.44 2oxp s GLU 73 N 0.04 1.10 -0.04 2.79 2.02 0.16 -1.88 118.70 122.89 2oxp s GLU 73 Ca -0.00 -0.75 0.02 0.00 0.02 0.00 0.00 54.97 54.26 2oxp s GLU 73 Cb -0.13 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 32.94 2oxp s GLU 73 CO 0.03 0.29 -0.10 0.14 0.02 0.00 0.00 175.26 175.64 2oxp s VAL 74 N -0.73 3.45 -0.26 2.63 -7.23 0.40 -0.58 120.40 118.08 2oxp s VAL 74 Ca 0.04 -0.65 -0.02 0.00 -1.81 0.00 0.00 61.98 59.54 2oxp s VAL 74 Cb -0.08 -2.41 0.08 0.00 0.56 0.00 0.00 36.38 34.53 2oxp s VAL 74 CO 0.01 0.54 0.07 -0.70 -0.31 0.00 0.00 175.10 174.71 2oxp s GLU 75 N -0.95 0.67 0.54 4.82 2.12 0.16 -0.36 118.70 125.71 2oxp s GLU 75 Ca 0.13 -0.76 -0.18 0.00 0.36 0.00 0.00 54.97 54.52 2oxp s GLU 75 Cb -0.11 -1.97 -0.06 0.00 0.26 0.00 0.00 34.13 32.25 2oxp s GLU 75 CO 0.03 -0.84 1.07 -0.06 -0.54 0.00 0.00 175.26 174.92 2oxp s PHE 76 N 1.75 2.89 0.00 5.30 0.40 -1.26 -1.02 117.98 126.04 2oxp s PHE 76 Ca 0.05 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 57.93 2oxp s PHE 76 Cb -0.17 -3.10 0.00 0.00 0.51 0.00 0.00 43.02 40.25 2oxp s PHE 76 CO -0.19 -1.15 0.00 -3.47 0.70 0.00 0.00 175.22 171.11 2oxp n ASP 77 N -1.48 0.00 0.10 1.36 -0.08 -1.26 -4.64 116.55 110.54 2oxp n ASP 77 Ca 0.10 -0.69 0.13 0.00 -1.51 0.00 0.00 54.79 52.82 2oxp n ASP 77 Cb 0.52 0.00 0.43 0.00 2.34 0.00 0.00 41.12 44.41 2oxp n ASP 77 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2oxp n LYS 78 N -0.69 0.23 0.00 -0.67 5.02 -1.26 -4.89 118.16 115.89 2oxp n LYS 78 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2oxp n LYS 78 Cb 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 2oxp n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2oxp n GLY 79 N 1.23 2.62 3.75 0.72 0.00 -1.22 -4.98 105.19 107.31 2oxp n GLY 79 Ca 0.05 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.87 2oxp n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oxp s GLN 80 N 4.34 4.11 0.02 1.61 -0.21 -1.19 -4.93 119.66 123.39 2oxp s GLN 80 Ca 0.00 2.61 0.24 0.00 0.02 0.00 0.00 55.36 58.22 2oxp s GLN 80 Cb 0.00 -3.01 0.29 0.00 1.00 0.00 0.00 33.01 31.29 2oxp s GLN 80 CO 0.00 -0.65 1.25 0.54 -2.12 0.00 0.00 175.29 174.31 2oxp n ARG 81 N 2.17 0.07 -3.97 2.91 1.74 -1.26 -4.78 116.66 113.52 2oxp n ARG 81 Ca 0.08 0.01 -0.10 0.00 -0.77 0.00 0.00 57.85 57.07 2oxp n ARG 81 Cb 0.37 -1.53 -0.12 0.00 -1.02 0.00 0.00 32.46 30.17 2oxp n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2oxp s THR 82 N -3.04 0.15 0.72 0.55 -4.23 -1.26 -0.53 115.64 107.99 2oxp s THR 82 Ca 0.09 -0.74 -0.00 0.00 -1.18 0.00 0.00 61.69 59.85 2oxp s THR 82 Cb 0.16 -0.26 0.14 0.00 1.34 0.00 0.00 72.50 73.89 2oxp s THR 82 CO 0.75 -0.38 0.99 -0.90 -0.54 0.00 0.00 174.62 174.54 2oxp n ASP 83 N 1.89 1.34 0.32 3.99 5.68 -0.34 -4.90 116.55 124.53 2oxp n ASP 83 Ca -0.21 -2.13 0.20 0.00 -0.50 0.00 0.00 54.79 52.14 2oxp n ASP 83 Cb 0.56 -0.64 1.08 0.00 -1.14 0.00 0.00 41.12 40.98 2oxp n ASP 83 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2oxp h LYS 84 N 0.00 0.00 -0.43 0.11 2.10 -2.02 -0.92 116.57 115.41 2oxp h LYS 84 Ca -0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 2oxp h LYS 84 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2oxp h LYS 84 CO 0.35 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.46 2oxp n TYR 85 N -3.38 0.57 -1.04 0.07 4.02 -1.26 -4.92 117.16 111.22 2oxp n TYR 85 Ca -0.03 -0.28 -0.01 0.00 -0.01 0.00 0.00 57.90 57.57 2oxp n TYR 85 Cb 0.11 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.42 2oxp n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2oxp n GLY 86 N 1.25 0.50 3.79 2.72 0.00 -0.35 -5.02 105.19 108.09 2oxp n GLY 86 Ca 0.16 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 2oxp n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oxp s ARG 87 N -1.04 4.30 0.26 1.61 0.52 -1.26 -4.76 118.95 118.58 2oxp s ARG 87 Ca 0.00 0.83 -0.30 0.00 -0.52 0.00 0.00 55.73 55.75 2oxp s ARG 87 Cb 0.00 -3.27 -0.09 0.00 0.52 0.00 0.00 34.95 32.11 2oxp s ARG 87 CO 0.00 0.57 1.29 0.20 0.02 0.00 0.00 175.30 177.38 2oxp s GLY 88 N -0.92 2.72 -0.39 -3.53 0.00 0.52 -1.20 107.32 104.51 2oxp s GLY 88 Ca 0.31 1.15 -0.10 0.00 0.00 0.00 0.00 44.72 46.08 2oxp s GLY 88 CO 0.20 1.95 0.22 1.08 0.00 0.00 0.00 173.10 176.55 2oxp s LEU 89 N -0.90 4.83 0.32 0.66 1.43 0.31 0.16 118.68 125.50 2oxp s LEU 89 Ca 0.52 -1.16 -0.16 0.00 -1.03 0.00 0.00 54.13 52.31 2oxp s LEU 89 Cb -0.37 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 43.87 2oxp s LEU 89 CO 0.44 -0.43 0.67 0.00 0.23 0.00 0.00 176.35 177.26 2oxp s ALA 90 N 1.51 -0.65 -0.24 4.21 0.00 -1.18 -4.36 121.76 121.05 2oxp s ALA 90 Ca 0.02 -0.70 -0.11 0.00 0.00 0.00 0.00 51.96 51.16 2oxp s ALA 90 Cb -0.20 0.86 -0.05 0.00 0.00 0.00 0.00 23.12 23.73 2oxp s ALA 90 CO 0.05 -0.96 0.18 0.71 0.00 0.00 0.00 175.76 175.74 2oxp s TYR 91 N -3.28 3.32 -0.16 0.00 2.02 -0.19 -1.15 117.35 117.91 2oxp s TYR 91 Ca 0.17 0.25 -0.08 0.00 -0.37 0.00 0.00 57.07 57.04 2oxp s TYR 91 Cb -0.04 -2.29 -0.04 0.00 -0.40 0.00 0.00 41.96 39.19 2oxp s TYR 91 CO 0.10 0.06 0.13 0.42 -1.57 0.00 0.00 175.55 174.69 2oxp s ILE 92 N 1.08 5.41 -0.09 2.71 -1.09 -1.26 -0.67 121.20 127.29 2oxp s ILE 92 Ca 0.08 0.18 0.04 0.00 -2.23 0.00 0.00 60.65 58.73 2oxp s ILE 92 Cb -0.14 -3.42 -0.01 0.00 -1.58 0.00 0.00 42.46 37.32 2oxp s ILE 92 CO 0.05 0.52 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.75 2oxp s TYR 93 N -0.27 2.56 -0.29 3.97 2.02 0.26 0.25 117.35 125.84 2oxp s TYR 93 Ca 0.11 -0.84 -0.01 0.00 -0.37 0.00 0.00 57.07 55.96 2oxp s TYR 93 Cb -0.11 -1.69 0.05 0.00 -0.40 0.00 0.00 41.96 39.81 2oxp s TYR 93 CO 0.01 -0.30 -0.02 0.00 -1.57 0.00 0.00 175.55 173.67 2oxp s ALA 94 N 0.13 2.77 -1.44 3.71 0.00 0.62 -0.66 121.76 126.89 2oxp s ALA 94 Ca -0.11 -1.79 -0.09 0.00 0.00 0.00 0.00 51.96 49.97 2oxp s ALA 94 Cb -0.16 -1.87 0.05 0.00 0.00 0.00 0.00 23.12 21.14 2oxp s ALA 94 CO 0.06 -1.27 0.90 -0.25 0.00 0.00 0.00 175.76 175.21 2oxp n ASP 95 N 4.57 -3.65 0.00 0.00 10.43 0.11 -1.27 116.55 126.75 2oxp n ASP 95 Ca -0.13 -0.77 0.00 0.00 2.57 0.00 0.00 54.79 56.46 2oxp n ASP 95 Cb 0.43 -4.05 0.00 0.00 1.84 0.00 0.00 41.12 39.34 2oxp n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2oxp n GLY 96 N -1.67 2.29 3.68 0.44 0.00 -1.26 -5.02 105.19 103.65 2oxp n GLY 96 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 2oxp n GLY 96 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oxp s LYS 97 N -0.21 4.12 -0.04 1.61 2.20 -0.40 -5.02 119.74 122.00 2oxp s LYS 97 Ca 0.00 -0.16 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 2oxp s LYS 97 Cb 0.00 -3.52 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 2oxp s LYS 97 CO 0.00 0.09 1.44 1.41 -0.36 0.00 0.00 175.35 177.92 2oxp s MET 98 N 0.97 4.25 0.15 4.03 -2.45 -1.26 -0.27 119.30 124.72 2oxp s MET 98 Ca 0.10 1.97 -0.11 0.00 -1.25 0.00 0.00 55.69 56.40 2oxp s MET 98 Cb -0.13 -3.69 0.02 0.00 1.25 0.00 0.00 34.83 32.28 2oxp s MET 98 CO 0.04 -0.66 1.59 0.28 1.05 0.00 0.00 175.02 177.32 2oxp h VAL 99 N 5.14 1.27 -0.38 10.11 2.07 -0.57 -2.04 116.25 131.85 2oxp h VAL 99 Ca -0.36 -1.18 0.07 0.00 0.82 0.00 0.00 66.70 66.04 2oxp h VAL 99 Cb 1.17 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 2oxp h VAL 99 CO 0.92 0.41 0.02 0.78 0.02 0.00 0.00 177.57 179.73 2oxp h ASN 100 N 0.79 -0.11 -0.40 0.57 4.21 -1.91 -1.54 115.58 117.19 2oxp h ASN 100 Ca 0.14 0.08 -0.06 0.00 1.21 0.00 0.00 56.30 57.67 2oxp h ASN 100 Cb 0.60 0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 37.93 2oxp h ASN 100 CO 0.04 -0.02 0.03 -0.08 -1.29 0.00 0.00 177.43 176.11 2oxp h GLU 101 N 0.13 0.68 -0.63 0.81 4.81 -1.89 -2.98 114.58 115.51 2oxp h GLU 101 Ca 0.19 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2oxp h GLU 101 Cb 0.25 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2oxp h GLU 101 CO -0.29 0.75 0.28 0.00 -0.73 0.00 0.00 179.01 179.01 2oxp h ALA 102 N 0.90 1.30 -0.10 2.92 0.00 -0.95 -0.20 119.26 123.14 2oxp h ALA 102 Ca 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2oxp h ALA 102 Cb 0.42 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2oxp h ALA 102 CO 0.01 0.53 0.04 -0.07 0.00 0.00 0.00 179.25 179.76 2oxp h LEU 103 N 0.90 0.13 -0.68 0.00 3.38 -1.24 -0.88 115.31 116.93 2oxp h LEU 103 Ca 0.22 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2oxp h LEU 103 Cb 0.14 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2oxp h LEU 103 CO -0.02 0.26 0.15 0.58 0.09 0.00 0.00 178.44 179.50 2oxp h VAL 104 N -0.01 1.26 0.00 1.22 2.07 -1.36 -0.60 116.25 118.84 2oxp h VAL 104 Ca 0.03 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.52 2oxp h VAL 104 Cb 0.17 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2oxp h VAL 104 CO -0.00 0.37 -0.25 -0.09 0.02 0.00 0.00 177.57 177.62 2oxp h ARG 105 N 1.03 0.00 -0.01 1.57 9.65 -0.82 -1.85 114.38 123.96 2oxp h ARG 105 Ca 0.21 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 2oxp h ARG 105 Cb 0.39 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 2oxp h ARG 105 CO 0.01 0.25 -0.04 0.94 2.80 0.00 0.00 179.97 183.92 2oxp n GLN 106 N -4.07 1.14 -1.72 0.20 -0.06 -0.35 -4.38 117.38 108.14 2oxp n GLN 106 Ca -0.02 -0.43 -0.10 0.00 -2.00 0.00 0.00 57.00 54.45 2oxp n GLN 106 Cb 0.31 -1.49 -0.02 0.00 -4.06 0.00 0.00 30.24 24.98 2oxp n GLN 106 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2oxp n GLY 107 N 1.16 0.57 0.93 1.69 0.00 -0.69 -4.42 105.19 104.41 2oxp n GLY 107 Ca 0.19 -0.54 0.09 0.00 0.00 0.00 0.00 46.02 45.76 2oxp n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oxp n LEU 108 N -1.25 3.14 -3.56 0.99 4.77 -0.27 -1.76 117.00 119.07 2oxp n LEU 108 Ca -0.11 -1.63 -0.16 0.00 -0.03 0.00 0.00 56.01 54.09 2oxp n LEU 108 Cb 0.45 -0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2oxp n LEU 108 CO 0.14 0.71 0.49 0.00 -1.33 0.00 0.00 177.39 177.41 2oxp s ALA 109 N -1.19 -1.80 0.18 -1.18 0.00 -1.19 -4.40 121.76 112.19 2oxp s ALA 109 Ca 0.32 1.54 0.05 0.00 0.00 0.00 0.00 51.96 53.86 2oxp s ALA 109 Cb 0.18 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 2oxp s ALA 109 CO 0.25 -0.35 0.20 0.15 0.00 0.00 0.00 175.76 176.00 2oxp s LYS 110 N -0.76 3.06 0.07 0.00 1.02 -0.76 -4.29 119.74 118.08 2oxp s LYS 110 Ca -0.07 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.78 2oxp s LYS 110 Cb -0.01 -2.72 -0.06 0.00 -0.52 0.00 0.00 37.83 34.53 2oxp s LYS 110 CO 0.06 0.47 1.14 0.08 -0.92 0.00 0.00 175.35 176.18 2oxp s VAL 111 N -1.84 4.15 0.18 3.17 1.01 -1.26 -1.25 120.40 124.56 2oxp s VAL 111 Ca 0.32 1.60 -0.24 0.00 0.00 0.00 0.00 61.98 63.66 2oxp s VAL 111 Cb -0.10 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.31 2oxp s VAL 111 CO 0.25 0.15 0.84 0.00 0.00 0.00 0.00 175.10 176.34 2oxp s ALA 112 N 0.80 -1.52 -0.86 5.51 0.00 -0.65 -4.86 121.76 120.18 2oxp s ALA 112 Ca 0.56 0.11 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 2oxp s ALA 112 Cb -0.28 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 2oxp s ALA 112 CO 0.30 -0.98 0.78 0.66 0.00 0.00 0.00 175.76 176.53 2oxp n TYR 113 N -0.43 -2.77 -2.85 0.00 4.01 -1.26 -3.42 117.16 110.44 2oxp n TYR 113 Ca -0.07 1.02 -0.43 0.00 -0.16 0.00 0.00 57.90 58.26 2oxp n TYR 113 Cb 0.61 -4.10 -0.03 0.00 -0.31 0.00 0.00 39.34 35.51 2oxp n TYR 113 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2oxp s VAL 114 N -3.15 4.52 0.31 -0.72 1.01 -1.26 -4.36 120.40 116.74 2oxp s VAL 114 Ca 0.18 -1.27 0.09 0.00 0.00 0.00 0.00 61.98 60.99 2oxp s VAL 114 Cb -0.02 -4.82 -0.06 0.00 0.00 0.00 0.00 36.38 31.47 2oxp s VAL 114 CO 0.75 -1.59 -0.11 -0.31 0.00 0.00 0.00 175.10 173.84 2oxp s TYR 115 N 3.30 2.25 -1.18 5.22 4.12 -1.26 -4.87 117.35 124.93 2oxp s TYR 115 Ca 0.34 -0.51 -0.15 0.00 0.02 0.00 0.00 57.07 56.78 2oxp s TYR 115 Cb -0.05 -1.21 0.14 0.00 -1.52 0.00 0.00 41.96 39.33 2oxp s TYR 115 CO -0.07 0.54 0.38 1.63 0.02 0.00 0.00 175.55 178.05 2oxp n LYS 116 N -0.69 -1.69 -1.68 -0.62 4.76 -1.26 -1.07 118.16 115.91 2oxp n LYS 116 Ca -0.05 0.11 -0.09 0.00 -2.87 0.00 0.00 58.31 55.41 2oxp n LYS 116 Cb 0.62 -4.67 -0.02 0.00 -1.84 0.00 0.00 35.03 29.12 2oxp n LYS 116 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2oxp n GLY 117 N -0.87 0.58 3.10 0.72 0.00 -1.26 -3.20 105.19 104.26 2oxp n GLY 117 Ca 0.07 -0.57 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 2oxp n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2oxp n ASN 118 N 0.42 4.81 -0.53 1.61 3.02 -0.24 -3.44 115.26 120.91 2oxp n ASN 118 Ca -0.10 -3.17 0.02 0.00 -0.03 0.00 0.00 54.58 51.30 2oxp n ASN 118 Cb 0.43 -1.13 0.03 0.00 -0.61 0.00 0.00 39.78 38.49 2oxp n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2oxp n ASN 119 N 2.13 0.53 -0.27 6.41 0.23 -1.26 -4.54 115.26 118.49 2oxp n ASN 119 Ca 0.24 -2.22 0.05 0.00 -0.53 0.00 0.00 54.58 52.12 2oxp n ASN 119 Cb 0.37 -0.26 0.19 0.00 -2.08 0.00 0.00 39.78 38.01 2oxp n ASN 119 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2oxp h THR 120 N 5.71 0.72 -0.63 5.53 2.02 -2.01 -1.94 112.91 122.31 2oxp h THR 120 Ca -0.02 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2oxp h THR 120 Cb 1.38 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 2oxp h THR 120 CO 0.01 0.10 0.00 1.41 0.37 0.00 0.00 175.52 177.41 2oxp n HIS 121 N -4.93 1.70 -0.08 3.16 8.25 -1.26 -4.61 115.22 117.45 2oxp n HIS 121 Ca 0.15 -0.65 -0.07 0.00 -0.26 0.00 0.00 57.72 56.89 2oxp n HIS 121 Cb 0.40 -0.34 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 2oxp n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2oxp h GLU 122 N 4.10 -0.04 -0.66 -0.41 4.81 -1.71 -1.01 114.58 119.66 2oxp h GLU 122 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2oxp h GLU 122 Cb 1.64 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 31.00 2oxp h GLU 122 CO 0.32 -0.03 0.30 1.96 -0.73 0.00 0.00 179.01 180.83 2oxp h GLN 123 N -0.04 0.97 -0.83 1.92 1.08 -1.81 0.23 115.11 116.62 2oxp h GLN 123 Ca 0.15 -0.16 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 2oxp h GLN 123 Cb 0.27 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 2oxp h GLN 123 CO -0.33 0.79 0.55 1.25 -0.95 0.00 0.00 178.83 180.14 2oxp h LEU 124 N 0.92 0.95 -0.51 1.46 5.85 -1.79 -0.88 115.31 121.31 2oxp h LEU 124 Ca 0.22 -0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.76 2oxp h LEU 124 Cb 0.15 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2oxp h LEU 124 CO -0.02 0.69 -0.62 -0.07 -0.34 0.00 0.00 178.44 178.07 2oxp h LEU 125 N 1.12 0.49 -0.99 2.25 3.38 -0.67 -2.70 115.31 118.20 2oxp h LEU 125 Ca 0.31 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2oxp h LEU 125 Cb -0.12 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2oxp h LEU 125 CO -0.07 0.99 0.17 0.03 0.09 0.00 0.00 178.44 179.64 2oxp h ARG 126 N 0.31 0.90 -0.54 1.13 -0.00 0.05 -1.43 114.38 114.80 2oxp h ARG 126 Ca -0.01 -0.18 -0.12 0.00 -0.50 0.00 0.00 59.98 59.18 2oxp h ARG 126 Cb 1.17 -0.14 -0.02 0.00 0.00 0.00 0.00 29.97 30.98 2oxp h ARG 126 CO 0.11 0.79 -0.12 0.87 0.00 0.00 0.00 179.97 181.62 2oxp h LYS 127 N 0.87 1.03 -0.57 0.04 1.57 -1.08 -1.79 116.57 116.64 2oxp h LYS 127 Ca 0.19 -0.38 -0.09 0.00 -1.87 0.00 0.00 60.65 58.50 2oxp h LYS 127 Cb 0.28 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2oxp h LYS 127 CO -0.01 1.07 -0.00 0.00 -0.57 0.00 0.00 179.45 179.95 2oxp h ALA 128 N 0.94 0.92 -0.45 3.86 0.00 -1.15 -2.28 119.26 121.11 2oxp h ALA 128 Ca 0.14 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2oxp h ALA 128 Cb 0.69 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2oxp h ALA 128 CO 0.05 0.64 0.13 1.49 0.00 0.00 0.00 179.25 181.56 2oxp h GLU 129 N 0.90 0.71 -0.94 0.00 4.81 -1.07 -1.32 114.58 117.67 2oxp h GLU 129 Ca 0.16 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2oxp h GLU 129 Cb 0.53 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 2oxp h GLU 129 CO 0.03 0.69 0.59 0.00 -0.73 0.00 0.00 179.01 179.59 2oxp h ALA 130 N 0.99 1.19 -0.30 2.92 0.00 -1.16 0.30 119.26 123.20 2oxp h ALA 130 Ca 0.14 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2oxp h ALA 130 Cb 0.29 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2oxp h ALA 130 CO -0.00 0.62 -0.13 0.37 0.00 0.00 0.00 179.25 180.11 2oxp h GLN 131 N 1.28 0.62 -0.57 0.00 5.75 -1.19 -0.10 115.11 120.90 2oxp h GLN 131 Ca 0.34 -0.26 -0.05 0.00 -0.15 0.00 0.00 58.65 58.53 2oxp h GLN 131 Cb -0.10 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 2oxp h GLN 131 CO -0.07 0.84 0.16 0.00 -2.65 0.00 0.00 178.83 177.11 2oxp h ALA 132 N 0.76 1.21 -0.43 3.38 0.00 -0.93 -0.59 119.26 122.66 2oxp h ALA 132 Ca 0.07 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 2oxp h ALA 132 Cb 0.65 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2oxp h ALA 132 CO 0.04 0.55 -0.19 -0.22 0.00 0.00 0.00 179.25 179.43 2oxp h LYS 133 N 0.84 0.88 -0.60 0.00 3.64 -0.80 -0.56 116.57 119.97 2oxp h LYS 133 Ca 0.19 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 2oxp h LYS 133 Cb 0.27 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 2oxp h LYS 133 CO -0.01 1.03 0.31 -0.22 -2.27 0.00 0.00 179.45 178.30 2oxp h LYS 134 N 0.71 0.82 -0.01 1.90 3.64 -0.62 -1.51 116.57 121.50 2oxp h LYS 134 Ca 0.10 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2oxp h LYS 134 Cb 0.76 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2oxp h LYS 134 CO 0.06 0.62 -0.03 0.39 -2.27 0.00 0.00 179.45 178.22 2oxp n GLU 135 N -4.38 1.33 -3.85 1.90 1.02 -0.26 -4.93 120.64 111.47 2oxp n GLU 135 Ca 0.05 -0.60 -0.28 0.00 -0.02 0.00 0.00 57.16 56.31 2oxp n GLU 135 Cb 0.11 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.07 2oxp n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2oxp n LYS 136 N -0.31 -5.81 -2.66 3.49 5.02 -0.57 -4.92 118.16 112.40 2oxp n LYS 136 Ca 0.19 0.63 -0.42 0.00 -2.02 0.00 0.00 58.31 56.70 2oxp n LYS 136 Cb 0.28 -5.51 -0.04 0.00 -0.02 0.00 0.00 35.03 29.74 2oxp n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oxp s LEU 137 N -7.22 4.43 0.00 -0.35 1.43 -0.32 -3.04 118.68 113.61 2oxp s LEU 137 Ca 0.58 1.80 0.00 0.00 -1.03 0.00 0.00 54.13 55.47 2oxp s LEU 137 Cb -0.28 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.35 2oxp s LEU 137 CO 0.81 -0.21 0.00 0.59 0.23 0.00 0.00 176.35 177.77 2oxp n ASN 138 N 3.34 0.00 -0.33 2.29 3.02 -1.26 -0.79 115.26 121.53 2oxp n ASN 138 Ca 0.05 0.00 0.22 0.00 -0.03 0.00 0.00 54.58 54.82 2oxp n ASN 138 Cb 0.49 0.00 0.50 0.00 -0.61 0.00 0.00 39.78 40.16 2oxp n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2oxp h ILE 139 N 0.00 0.52 -0.18 2.41 2.04 -1.66 0.15 117.51 120.79 2oxp h ILE 139 Ca 0.00 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.72 2oxp h ILE 139 Cb 0.00 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 2oxp h ILE 139 CO 0.00 0.08 0.00 0.79 0.00 0.00 0.00 178.15 179.02 2oxp n TRP 140 N -4.66 0.23 1.39 1.37 7.02 0.03 -5.15 117.44 117.67 2oxp n TRP 140 Ca 0.26 -0.11 0.11 0.00 -1.02 0.00 0.00 57.50 56.74 2oxp n TRP 140 Cb 0.87 0.00 0.66 0.00 -2.42 0.00 0.00 31.31 30.42 2oxp n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54