#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oh0 s PRO 4 N 0.00 3.86 0.99 3.23 0.02 -1.26 -4.92 135.00 136.93 1oh0 s PRO 4 Ca 0.00 2.39 -0.13 0.00 0.02 0.00 0.00 61.00 63.28 1oh0 s PRO 4 Cb 0.00 -2.76 0.18 0.00 0.02 0.00 0.00 34.50 31.94 1oh0 s PRO 4 CO 0.00 -0.67 1.12 0.95 -0.33 0.00 0.00 177.00 178.08 1oh0 s THR 5 N -1.19 1.95 0.20 0.99 -4.23 -1.26 -3.91 115.64 108.19 1oh0 s THR 5 Ca 0.58 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.99 1oh0 s THR 5 Cb -0.43 -2.62 0.13 0.00 1.34 0.00 0.00 72.50 70.92 1oh0 s THR 5 CO 0.56 0.00 1.76 0.00 -0.54 0.00 0.00 174.62 176.40 1oh0 h ALA 6 N -1.83 0.78 -0.79 3.99 0.00 -1.91 0.79 119.26 120.30 1oh0 h ALA 6 Ca -0.51 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1oh0 h ALA 6 Cb 1.32 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1oh0 h ALA 6 CO 0.56 -0.14 0.29 1.96 0.00 0.00 0.00 179.25 181.92 1oh0 h GLN 7 N 0.47 1.19 -0.42 0.00 4.20 -1.91 -1.92 115.11 116.71 1oh0 h GLN 7 Ca 0.29 -0.23 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 1oh0 h GLN 7 Cb 0.31 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1oh0 h GLN 7 CO -0.26 0.97 -0.09 0.93 -0.67 0.00 0.00 178.83 179.72 1oh0 h GLU 8 N 1.15 0.73 -0.51 1.46 5.08 -1.61 -2.19 114.58 118.68 1oh0 h GLU 8 Ca 0.26 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1oh0 h GLU 8 Cb 0.24 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1oh0 h GLU 8 CO -0.02 0.80 0.25 0.28 -1.00 0.00 0.00 179.01 179.33 1oh0 h VAL 9 N 0.67 1.19 -0.71 3.13 2.07 -0.47 -0.80 116.25 121.33 1oh0 h VAL 9 Ca 0.12 -0.53 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1oh0 h VAL 9 Cb 0.54 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 1oh0 h VAL 9 CO 0.03 0.21 0.44 1.56 0.02 0.00 0.00 177.57 179.83 1oh0 h GLN 10 N 0.68 0.82 -0.40 1.57 4.20 -0.99 -0.93 115.11 120.07 1oh0 h GLN 10 Ca 0.18 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 1oh0 h GLN 10 Cb 0.10 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1oh0 h GLN 10 CO -0.02 0.54 -0.01 0.78 -0.67 0.00 0.00 178.83 179.45 1oh0 h GLY 11 N 0.85 0.77 0.94 3.46 0.00 -1.02 -2.08 103.07 105.99 1oh0 h GLY 11 Ca 0.29 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1oh0 h GLY 11 CO -0.13 0.53 0.12 1.41 0.00 0.00 0.00 176.54 178.47 1oh0 h LEU 12 N 0.53 0.62 -0.78 3.11 3.38 -0.85 -0.90 115.31 120.44 1oh0 h LEU 12 Ca 0.11 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 1oh0 h LEU 12 Cb 0.49 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1oh0 h LEU 12 CO 0.02 0.68 -0.24 0.24 0.09 0.00 0.00 178.44 179.23 1oh0 h MET 13 N 0.54 0.66 -0.55 1.13 2.86 -1.18 -1.08 114.93 117.30 1oh0 h MET 13 Ca 0.13 -0.26 -0.12 0.00 -2.06 0.00 0.00 59.70 57.40 1oh0 h MET 13 Cb 0.29 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 1oh0 h MET 13 CO -0.00 0.84 -0.11 0.00 1.06 0.00 0.00 176.91 178.70 1oh0 h ALA 14 N 1.16 0.76 -0.79 6.32 0.00 -1.24 -2.73 119.26 122.74 1oh0 h ALA 14 Ca 0.08 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1oh0 h ALA 14 Cb 0.72 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1oh0 h ALA 14 CO 0.06 0.68 0.37 -0.09 0.00 0.00 0.00 179.25 180.26 1oh0 h ARG 15 N 0.93 1.14 -0.48 0.00 2.43 -0.82 -2.32 114.38 115.25 1oh0 h ARG 15 Ca 0.14 -0.17 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1oh0 h ARG 15 Cb 0.68 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 1oh0 h ARG 15 CO 0.05 0.89 0.19 -0.92 -1.51 0.00 0.00 179.97 178.67 1oh0 h TYR 16 N 1.12 0.33 -0.81 2.20 3.20 -0.97 -0.97 116.97 121.06 1oh0 h TYR 16 Ca 0.27 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.13 1oh0 h TYR 16 Cb 0.13 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1oh0 h TYR 16 CO 0.01 0.12 0.39 0.82 -1.64 0.00 0.00 178.16 177.87 1oh0 h ILE 17 N 0.37 1.25 -0.88 1.81 1.08 -1.17 -0.78 117.51 119.19 1oh0 h ILE 17 Ca 0.23 -0.71 -0.02 0.00 -0.39 0.00 0.00 64.86 63.97 1oh0 h ILE 17 Cb 0.22 0.21 -0.04 0.00 -3.07 0.00 0.00 36.82 34.14 1oh0 h ILE 17 CO -0.22 0.30 0.49 -0.33 -0.69 0.00 0.00 178.15 177.71 1oh0 h GLU 18 N 1.16 1.22 -0.44 2.37 5.08 -0.80 -0.46 114.58 122.71 1oh0 h GLU 18 Ca 0.28 -0.14 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 1oh0 h GLU 18 Cb 0.12 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1oh0 h GLU 18 CO -0.04 0.89 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.58 1oh0 h LEU 19 N 1.23 0.91 -0.53 1.33 3.38 -0.59 -2.78 115.31 118.26 1oh0 h LEU 19 Ca 0.31 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1oh0 h LEU 19 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1oh0 h LEU 19 CO -0.05 1.09 0.19 0.58 0.09 0.00 0.00 178.44 180.34 1oh0 h VAL 20 N 0.78 1.22 -0.44 1.22 2.07 -0.71 -0.70 116.25 119.69 1oh0 h VAL 20 Ca 0.10 -0.72 0.06 0.00 0.82 0.00 0.00 66.70 66.96 1oh0 h VAL 20 Cb 0.76 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1oh0 h VAL 20 CO 0.06 0.27 0.30 -0.78 0.02 0.00 0.00 177.57 177.44 1oh0 h ASP 21 N 0.72 0.31 -0.08 0.57 3.58 -0.88 -1.67 116.42 118.97 1oh0 h ASP 21 Ca 0.17 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1oh0 h ASP 21 Cb 0.23 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1oh0 h ASP 21 CO -0.01 0.20 0.00 1.33 -2.88 0.00 0.00 179.24 177.88 1oh0 n VAL 22 N -4.47 0.07 -2.37 2.25 0.24 -1.07 -4.65 118.33 108.33 1oh0 n VAL 22 Ca 0.06 -0.54 -0.13 0.00 -2.04 0.00 0.00 64.34 61.69 1oh0 n VAL 22 Cb 0.25 1.39 0.00 0.00 -1.47 0.00 0.00 33.84 34.02 1oh0 n VAL 22 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oh0 n GLY 23 N 1.28 -0.12 3.34 7.63 0.00 -0.37 -4.92 105.19 112.02 1oh0 n GLY 23 Ca 0.14 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1oh0 n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1oh0 n ASP 24 N -0.52 4.70 -0.21 1.61 -0.08 -0.60 -4.79 116.55 116.66 1oh0 n ASP 24 Ca -0.13 -2.91 -0.01 0.00 -1.51 0.00 0.00 54.79 50.23 1oh0 n ASP 24 Cb 0.60 -1.71 0.10 0.00 2.34 0.00 0.00 41.12 42.46 1oh0 n ASP 24 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1oh0 h ILE 25 N 5.06 0.89 -0.62 5.18 1.08 -1.91 -1.50 117.51 125.68 1oh0 h ILE 25 Ca 0.47 -0.19 0.04 0.00 -0.39 0.00 0.00 64.86 64.79 1oh0 h ILE 25 Cb 0.81 0.28 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1oh0 h ILE 25 CO 1.56 0.10 0.37 -0.33 -0.69 0.00 0.00 178.15 179.15 1oh0 h GLU 26 N 0.56 0.69 -0.31 2.37 5.08 -1.99 -0.78 114.58 120.19 1oh0 h GLU 26 Ca 0.30 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.48 1oh0 h GLU 26 Cb 0.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1oh0 h GLU 26 CO -0.23 0.45 -0.35 0.00 -1.00 0.00 0.00 179.01 177.88 1oh0 h ALA 27 N 1.29 0.79 -0.06 3.43 0.00 -1.87 -2.58 119.26 120.27 1oh0 h ALA 27 Ca 0.26 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1oh0 h ALA 27 Cb 0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1oh0 h ALA 27 CO -0.13 0.65 0.03 0.82 0.00 0.00 0.00 179.25 180.62 1oh0 h ILE 28 N 0.59 1.13 -0.89 0.00 2.04 -0.83 -2.69 117.51 116.86 1oh0 h ILE 28 Ca 0.06 -0.38 0.05 0.00 1.00 0.00 0.00 64.86 65.59 1oh0 h ILE 28 Cb 0.88 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 1oh0 h ILE 28 CO 0.08 0.11 0.58 0.58 0.00 0.00 0.00 178.15 179.50 1oh0 h VAL 29 N -0.04 1.11 0.00 1.67 2.07 -1.11 -0.84 116.25 119.11 1oh0 h VAL 29 Ca 0.02 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1oh0 h VAL 29 Cb 0.15 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1oh0 h VAL 29 CO -0.00 0.19 0.00 1.56 0.02 0.00 0.00 177.57 179.34 1oh0 h GLN 30 N 1.06 0.00 0.00 1.57 1.08 -1.23 -2.12 115.11 115.48 1oh0 h GLN 30 Ca 0.37 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.53 1oh0 h GLN 30 Cb 0.10 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1oh0 h GLN 30 CO -0.12 0.00 -0.17 0.52 -0.95 0.00 0.00 178.83 178.10 1oh0 h MET 31 N 0.00 0.00 -6.74 1.46 2.86 -0.82 -3.45 114.93 108.24 1oh0 h MET 31 Ca 0.00 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.15 1oh0 h MET 31 Cb 0.42 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1oh0 h MET 31 CO 0.00 0.17 0.10 0.71 1.06 0.00 0.00 176.91 178.96 1oh0 s TYR 32 N -3.45 3.37 0.69 -0.22 1.51 -0.80 -0.40 117.35 118.05 1oh0 s TYR 32 Ca 0.03 1.22 -0.15 0.00 -1.01 0.00 0.00 57.07 57.16 1oh0 s TYR 32 Cb 0.08 -2.54 0.02 0.00 -0.11 0.00 0.00 41.96 39.41 1oh0 s TYR 32 CO 0.64 0.08 1.13 0.00 -1.11 0.00 0.00 175.55 176.30 1oh0 s ALA 33 N -2.00 2.35 0.53 3.71 0.00 0.20 -4.70 121.76 121.85 1oh0 s ALA 33 Ca 0.54 0.62 0.20 0.00 0.00 0.00 0.00 51.96 53.33 1oh0 s ALA 33 Cb -0.10 -3.36 1.35 0.00 0.00 0.00 0.00 23.12 21.02 1oh0 s ALA 33 CO 0.18 -1.48 2.10 0.38 0.00 0.00 0.00 175.76 176.93 1oh0 h ASP 34 N -0.14 0.00 -0.21 0.00 2.03 -1.93 -2.15 116.42 114.01 1oh0 h ASP 34 Ca -0.47 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 55.74 1oh0 h ASP 34 Cb 1.26 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.71 1oh0 h ASP 34 CO 0.52 0.00 -0.15 -0.90 -1.03 0.00 0.00 179.24 177.68 1oh0 n ASP 35 N -4.42 2.50 -4.66 4.15 5.75 -1.26 -1.91 116.55 116.71 1oh0 n ASP 35 Ca 0.02 -3.61 -0.30 0.00 -0.01 0.00 0.00 54.79 50.89 1oh0 n ASP 35 Cb 0.28 -0.57 0.17 0.00 -1.03 0.00 0.00 41.12 39.96 1oh0 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oh0 s ALA 36 N -3.14 1.11 0.09 2.12 0.00 -0.81 -4.33 121.76 116.80 1oh0 s ALA 36 Ca 0.41 0.11 0.09 0.00 0.00 0.00 0.00 51.96 52.58 1oh0 s ALA 36 Cb 0.37 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 1oh0 s ALA 36 CO -0.00 -2.76 -0.24 0.95 0.00 0.00 0.00 175.76 173.71 1oh0 s THR 37 N -2.75 1.95 -0.05 0.00 -4.23 -0.71 -0.95 115.64 108.89 1oh0 s THR 37 Ca 0.65 -1.52 0.02 0.00 -1.18 0.00 0.00 61.69 59.67 1oh0 s THR 37 Cb -0.21 -1.72 0.01 0.00 1.34 0.00 0.00 72.50 71.92 1oh0 s THR 37 CO 0.59 0.11 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.98 1oh0 s VAL 38 N -1.00 1.00 -0.27 2.29 1.01 -0.87 -1.58 120.40 120.98 1oh0 s VAL 38 Ca 0.10 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1oh0 s VAL 38 Cb -0.10 -0.91 0.07 0.00 0.00 0.00 0.00 36.38 35.45 1oh0 s VAL 38 CO 0.04 0.31 -0.03 -1.61 0.00 0.00 0.00 175.10 173.81 1oh0 s GLU 39 N 0.47 1.65 -0.26 2.72 2.02 -0.32 -1.10 118.70 123.87 1oh0 s GLU 39 Ca -0.09 -1.25 -0.01 0.00 0.02 0.00 0.00 54.97 53.63 1oh0 s GLU 39 Cb -0.13 -2.72 0.14 0.00 0.10 0.00 0.00 34.13 31.52 1oh0 s GLU 39 CO 0.02 -0.69 0.40 0.34 0.02 0.00 0.00 175.26 175.35 1oh0 s ASP 40 N 1.25 0.20 0.52 -0.19 -1.08 -1.26 -0.81 116.67 115.30 1oh0 s ASP 40 Ca -0.02 0.07 -0.18 0.00 -0.52 0.00 0.00 52.55 51.90 1oh0 s ASP 40 Cb -0.19 1.17 -0.07 0.00 -1.46 0.00 0.00 42.92 42.37 1oh0 s ASP 40 CO -0.08 -0.31 1.03 -2.16 0.52 0.00 0.00 175.17 174.17 1oh0 s PRO 41 N 2.56 3.70 0.19 4.34 0.04 -1.26 -4.96 135.00 139.61 1oh0 s PRO 41 Ca 0.12 1.25 -0.33 0.00 0.04 0.00 0.00 61.00 62.08 1oh0 s PRO 41 Cb -0.14 -2.09 -0.13 0.00 0.04 0.00 0.00 34.50 32.17 1oh0 s PRO 41 CO -0.21 -0.50 1.54 0.34 0.04 0.00 0.00 177.00 178.22 1oh0 n PHE 42 N -1.34 2.31 0.00 0.56 7.35 0.82 -1.48 117.46 125.68 1oh0 n PHE 42 Ca 0.09 0.29 0.00 0.00 -0.76 0.00 0.00 57.45 57.07 1oh0 n PHE 42 Cb 0.53 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.83 1oh0 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1oh0 n GLY 43 N 3.05 1.24 3.93 7.13 0.00 -1.26 -4.87 105.19 114.40 1oh0 n GLY 43 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1oh0 n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oh0 s GLN 44 N 0.00 3.53 0.38 1.61 -1.52 -0.55 -5.04 119.66 118.07 1oh0 s GLN 44 Ca 0.00 -0.17 -0.27 0.00 -1.95 0.00 0.00 55.36 52.98 1oh0 s GLN 44 Cb 0.00 -2.62 -0.11 0.00 -0.22 0.00 0.00 33.01 30.06 1oh0 s GLN 44 CO 0.00 0.12 1.30 -2.30 -0.25 0.00 0.00 175.29 174.16 1oh0 n PRO 45 N -1.60 2.08 -2.60 2.91 -0.02 -1.26 -4.73 135.00 129.77 1oh0 n PRO 45 Ca -0.03 0.73 -0.34 0.00 -2.02 0.00 0.00 63.50 61.84 1oh0 n PRO 45 Cb 0.55 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 1oh0 n PRO 45 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1oh0 s PRO 46 N -2.06 3.90 0.12 0.52 0.04 -1.26 -4.76 135.00 131.50 1oh0 s PRO 46 Ca 0.58 1.32 0.03 0.00 0.04 0.00 0.00 61.00 62.96 1oh0 s PRO 46 Cb -0.53 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 1oh0 s PRO 46 CO 0.60 -0.34 0.18 0.96 0.04 0.00 0.00 177.00 178.44 1oh0 s ILE 47 N -2.01 4.91 -0.03 0.56 -4.36 -0.26 -4.92 121.20 115.08 1oh0 s ILE 47 Ca 0.66 -0.76 0.04 0.00 -0.26 0.00 0.00 60.65 60.33 1oh0 s ILE 47 Cb -0.15 -3.46 -0.01 0.00 1.25 0.00 0.00 42.46 40.10 1oh0 s ILE 47 CO 0.19 -0.00 -0.16 -1.00 0.24 0.00 0.00 174.94 174.20 1oh0 s HIS 48 N -1.62 1.56 0.00 1.37 3.76 -1.26 -2.06 115.29 117.05 1oh0 s HIS 48 Ca 0.32 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.83 1oh0 s HIS 48 Cb -0.11 -1.05 0.00 0.00 1.11 0.00 0.00 32.58 32.53 1oh0 s HIS 48 CO 0.25 -0.12 0.00 0.41 -0.85 0.00 0.00 174.74 174.43 1oh0 n GLY 49 N 3.03 -1.02 0.33 -2.22 0.00 -0.13 -4.28 105.19 100.90 1oh0 n GLY 49 Ca -0.17 -1.47 0.06 0.00 0.00 0.00 0.00 46.02 44.43 1oh0 n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1oh0 h ARG 50 N 0.00 0.58 -0.02 1.61 3.08 -1.61 -0.53 114.38 117.48 1oh0 h ARG 50 Ca 0.00 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 1oh0 h ARG 50 Cb 0.00 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 1oh0 h ARG 50 CO 0.00 0.38 0.01 1.49 -1.07 0.00 0.00 179.97 180.78 1oh0 h GLU 51 N 0.59 0.03 -0.65 0.04 4.81 -1.87 0.24 114.58 117.78 1oh0 h GLU 51 Ca 0.21 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 1oh0 h GLU 51 Cb 0.11 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1oh0 h GLU 51 CO -0.06 0.21 0.18 1.96 -0.73 0.00 0.00 179.01 180.58 1oh0 h GLN 52 N -0.15 1.00 -0.54 1.92 4.20 -1.66 -1.27 115.11 118.61 1oh0 h GLN 52 Ca 0.01 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.41 1oh0 h GLN 52 Cb 0.19 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1oh0 h GLN 52 CO -0.00 0.87 -0.05 0.82 -0.67 0.00 0.00 178.83 179.81 1oh0 h ILE 53 N 0.96 1.27 -0.52 2.54 2.04 -0.93 -1.41 117.51 121.46 1oh0 h ILE 53 Ca 0.21 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 1oh0 h ILE 53 Cb 0.30 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1oh0 h ILE 53 CO -0.00 0.42 0.27 0.00 0.00 0.00 0.00 178.15 178.84 1oh0 h ALA 54 N 0.94 0.67 -0.78 1.87 0.00 -0.15 -1.27 119.26 120.55 1oh0 h ALA 54 Ca 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1oh0 h ALA 54 Cb 0.60 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1oh0 h ALA 54 CO 0.04 0.21 0.41 0.00 0.00 0.00 0.00 179.25 179.90 1oh0 h ALA 55 N 1.11 1.25 0.02 0.00 0.00 -1.05 -0.47 119.26 120.11 1oh0 h ALA 55 Ca 0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1oh0 h ALA 55 Cb 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1oh0 h ALA 55 CO -0.03 0.60 -0.01 0.35 0.00 0.00 0.00 179.25 180.16 1oh0 h PHE 56 N 1.09 -0.02 -0.13 0.00 3.57 -0.72 -2.12 116.94 118.61 1oh0 h PHE 56 Ca 0.27 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.68 1oh0 h PHE 56 Cb 0.06 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1oh0 h PHE 56 CO 0.01 0.10 -0.33 1.88 -2.23 0.00 0.00 178.31 177.74 1oh0 h TYR 57 N -0.14 0.30 -0.77 0.41 -1.99 -1.02 -1.81 116.97 111.95 1oh0 h TYR 57 Ca -0.00 -0.07 -0.05 0.00 2.00 0.00 0.00 58.73 60.61 1oh0 h TYR 57 Cb 0.13 -0.07 -0.03 0.00 2.00 0.00 0.00 36.73 38.76 1oh0 h TYR 57 CO -0.04 0.57 0.29 0.00 -0.00 0.00 0.00 178.16 178.98 1oh0 h ARG 58 N 0.23 1.16 -0.06 4.88 3.08 -0.90 0.14 114.38 122.92 1oh0 h ARG 58 Ca 0.03 -0.22 -0.15 0.00 0.07 0.00 0.00 59.98 59.71 1oh0 h ARG 58 Cb 0.70 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1oh0 h ARG 58 CO 0.05 0.95 -0.64 1.96 -1.07 0.00 0.00 179.97 181.23 1oh0 h GLN 59 N 1.12 0.22 0.10 0.04 4.20 -1.13 0.47 115.11 120.12 1oh0 h GLN 59 Ca 0.25 -0.16 -0.28 0.00 0.06 0.00 0.00 58.65 58.53 1oh0 h GLN 59 Cb 0.24 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1oh0 h GLN 59 CO -0.02 0.79 -1.33 0.78 -0.67 0.00 0.00 178.83 178.38 1oh0 h GLY 60 N 1.55 0.24 -0.20 3.46 0.00 -1.00 -3.38 103.07 103.74 1oh0 h GLY 60 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1oh0 h GLY 60 CO 0.10 0.53 -0.19 1.04 0.00 0.00 0.00 176.54 178.02 1oh0 n LEU 61 N -3.45 0.75 -0.32 3.11 4.77 0.48 -4.75 117.00 117.58 1oh0 n LEU 61 Ca -0.10 -0.68 0.20 0.00 -0.03 0.00 0.00 56.01 55.40 1oh0 n LEU 61 Cb 1.02 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 42.51 1oh0 n LEU 61 CO 0.51 0.16 0.96 1.23 -1.33 0.00 0.00 177.39 178.93 1oh0 h GLY 62 N 1.43 1.69 0.14 -0.72 0.00 -0.14 -2.40 103.07 103.06 1oh0 h GLY 62 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.29 1oh0 h GLY 62 CO 0.00 -0.55 -0.44 -1.33 0.00 0.00 0.00 176.54 174.23 1oh0 h GLY 63 N 0.12 -1.18 0.00 4.60 0.00 -1.85 -3.47 103.07 101.28 1oh0 h GLY 63 Ca 0.67 0.62 0.00 0.00 0.00 0.00 0.00 47.33 48.62 1oh0 h GLY 63 CO -0.75 -0.31 0.00 0.61 0.00 0.00 0.00 176.54 176.09 1oh0 n GLY 64 N -1.41 0.95 1.51 4.60 0.00 -0.91 -4.98 105.19 104.95 1oh0 n GLY 64 Ca -0.07 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.04 1oh0 n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oh0 n LYS 65 N -0.44 3.69 -3.47 1.61 4.76 -1.26 -4.93 118.16 118.12 1oh0 n LYS 65 Ca 0.00 -2.86 -0.37 0.00 -2.87 0.00 0.00 58.31 52.21 1oh0 n LYS 65 Cb 0.00 -1.87 -0.07 0.00 -1.84 0.00 0.00 35.03 31.25 1oh0 n LYS 65 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1oh0 s VAL 66 N -1.89 5.26 0.12 -0.18 1.01 -1.26 -4.51 120.40 118.96 1oh0 s VAL 66 Ca 0.49 0.64 0.10 0.00 0.00 0.00 0.00 61.98 63.20 1oh0 s VAL 66 Cb 0.32 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1oh0 s VAL 66 CO 0.23 0.34 -0.20 -0.13 0.00 0.00 0.00 175.10 175.34 1oh0 s ARG 67 N 0.77 1.69 -0.08 2.72 1.81 -0.50 -4.75 118.95 120.61 1oh0 s ARG 67 Ca 0.18 -1.23 -0.10 0.00 -1.72 0.00 0.00 55.73 52.86 1oh0 s ARG 67 Cb -0.14 -2.06 0.02 0.00 -0.45 0.00 0.00 34.95 32.33 1oh0 s ARG 67 CO 0.06 0.47 0.26 0.00 -0.68 0.00 0.00 175.30 175.41 1oh0 s ALA 68 N -1.16 -0.65 -0.13 2.13 0.00 -1.26 -0.35 121.76 120.34 1oh0 s ALA 68 Ca 0.17 0.59 -0.21 0.00 0.00 0.00 0.00 51.96 52.51 1oh0 s ALA 68 Cb -0.10 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.78 1oh0 s ALA 68 CO 0.09 -0.16 0.54 0.00 0.00 0.00 0.00 175.76 176.23 1oh0 s LEU 70 N -0.38 4.28 -0.02 0.00 1.43 -1.26 -1.53 118.68 121.20 1oh0 s LEU 70 Ca -0.05 2.74 0.06 0.00 -1.03 0.00 0.00 54.13 55.85 1oh0 s LEU 70 Cb -0.03 -3.81 0.15 0.00 0.03 0.00 0.00 46.19 42.53 1oh0 s LEU 70 CO 0.04 -0.80 1.12 0.35 0.23 0.00 0.00 176.35 177.29 1oh0 n THR 71 N 0.33 1.12 -3.61 5.49 -2.24 -0.48 -4.86 114.28 110.02 1oh0 n THR 71 Ca 0.02 -1.13 0.01 0.00 -2.27 0.00 0.00 64.05 60.68 1oh0 n THR 71 Cb 0.42 0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 69.06 1oh0 n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1oh0 s GLY 72 N -1.18 -0.40 0.73 3.38 0.00 -1.24 -4.97 107.32 103.64 1oh0 s GLY 72 Ca 0.12 0.87 -0.13 0.00 0.00 0.00 0.00 44.72 45.59 1oh0 s GLY 72 CO 0.06 0.20 1.12 2.56 0.00 0.00 0.00 173.10 177.03 1oh0 s PRO 73 N -2.39 2.36 -0.03 2.90 0.04 -1.26 -4.59 135.00 132.02 1oh0 s PRO 73 Ca 0.13 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 1oh0 s PRO 73 Cb 0.04 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.66 1oh0 s PRO 73 CO -0.04 -1.59 1.00 0.08 0.04 0.00 0.00 177.00 176.49 1oh0 s VAL 74 N -2.55 4.80 -0.09 -0.36 1.01 -1.26 -4.53 120.40 117.42 1oh0 s VAL 74 Ca 0.65 2.02 -0.18 0.00 0.00 0.00 0.00 61.98 64.47 1oh0 s VAL 74 Cb -0.20 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 1oh0 s VAL 74 CO 0.49 0.10 0.49 -0.13 0.00 0.00 0.00 175.10 176.06 1oh0 s ARG 75 N 1.38 4.30 0.03 2.72 3.00 0.21 -4.90 118.95 125.69 1oh0 s ARG 75 Ca 0.51 0.50 0.03 0.00 0.00 0.00 0.00 55.73 56.77 1oh0 s ARG 75 Cb -0.20 -3.40 -0.02 0.00 0.00 0.00 0.00 34.95 31.32 1oh0 s ARG 75 CO 0.24 0.23 -0.10 0.00 0.00 0.00 0.00 175.30 175.67 1oh0 s ALA 76 N 0.37 0.83 0.61 2.13 0.00 -1.26 -0.63 121.76 123.81 1oh0 s ALA 76 Ca 0.27 -0.66 0.09 0.00 0.00 0.00 0.00 51.96 51.66 1oh0 s ALA 76 Cb -0.16 -0.11 0.10 0.00 0.00 0.00 0.00 23.12 22.96 1oh0 s ALA 76 CO 0.12 0.13 0.85 -1.54 0.00 0.00 0.00 175.76 175.32 1oh0 s SER 77 N -0.98 4.93 0.00 0.00 1.04 0.18 -4.93 113.70 113.93 1oh0 s SER 77 Ca -0.01 -0.88 0.22 0.00 0.48 0.00 0.00 55.95 55.76 1oh0 s SER 77 Cb -0.07 0.44 0.53 0.00 0.10 0.00 0.00 66.02 67.02 1oh0 s SER 77 CO 0.01 -1.49 1.45 1.41 0.98 0.00 0.00 173.24 175.59 1oh0 n HIS 78 N -2.36 0.37 -1.83 5.02 8.25 -1.26 -3.75 115.22 119.65 1oh0 n HIS 78 Ca 0.17 -0.18 -0.17 0.00 -0.26 0.00 0.00 57.72 57.28 1oh0 n HIS 78 Cb 0.62 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.81 1oh0 n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1oh0 n ASN 79 N 1.07 4.23 -0.52 0.41 2.04 -1.26 -4.90 115.26 116.32 1oh0 n ASN 79 Ca 0.18 -3.79 -0.07 0.00 -0.44 0.00 0.00 54.58 50.46 1oh0 n ASN 79 Cb 0.51 -0.45 -0.03 0.00 -2.53 0.00 0.00 39.78 37.27 1oh0 n ASN 79 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1oh0 n GLY 80 N -0.85 0.89 3.52 4.83 0.00 -1.25 -4.86 105.19 107.47 1oh0 n GLY 80 Ca 0.39 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 1oh0 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oh0 s GLY 82 N -3.29 -0.25 -0.01 0.00 0.00 -0.34 -0.65 107.32 102.77 1oh0 s GLY 82 Ca 0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 44.72 44.96 1oh0 s GLY 82 CO 0.15 -0.09 0.03 0.00 0.00 0.00 0.00 173.10 173.19 1oh0 s ALA 83 N -3.85 -0.07 -0.01 3.20 0.00 0.20 -0.91 121.76 120.32 1oh0 s ALA 83 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 1oh0 s ALA 83 Cb -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1oh0 s ALA 83 CO -0.04 -0.02 0.06 0.00 0.00 0.00 0.00 175.76 175.77 1oh0 s MET 84 N -0.00 0.20 -0.15 0.00 0.23 -0.39 -0.61 119.30 118.57 1oh0 s MET 84 Ca -0.00 -0.13 -0.09 0.00 -1.03 0.00 0.00 55.69 54.43 1oh0 s MET 84 Cb -0.00 0.08 -0.05 0.00 -1.53 0.00 0.00 34.83 33.33 1oh0 s MET 84 CO 0.00 -0.04 0.16 -1.25 -2.03 0.00 0.00 175.02 171.87 1oh0 s PRO 85 N -0.52 3.87 0.27 3.16 0.04 -1.26 -1.72 135.00 138.84 1oh0 s PRO 85 Ca -0.06 -0.12 -0.12 0.00 0.04 0.00 0.00 61.00 60.74 1oh0 s PRO 85 Cb -0.04 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1oh0 s PRO 85 CO 0.00 0.51 0.51 -0.59 0.04 0.00 0.00 177.00 177.47 1oh0 s PHE 86 N -0.28 0.42 -0.00 0.56 -0.12 -0.23 -1.39 117.98 116.94 1oh0 s PHE 86 Ca 0.13 -0.79 0.04 0.00 -0.05 0.00 0.00 56.93 56.26 1oh0 s PHE 86 Cb -0.12 0.22 -0.01 0.00 -0.63 0.00 0.00 43.02 42.48 1oh0 s PHE 86 CO 0.02 -1.06 -0.12 0.50 -0.05 0.00 0.00 175.22 174.51 1oh0 s ARG 87 N -3.77 0.94 -0.01 1.99 3.52 -0.58 -1.08 118.95 119.95 1oh0 s ARG 87 Ca 0.23 -0.47 0.08 0.00 -0.13 0.00 0.00 55.73 55.44 1oh0 s ARG 87 Cb -0.01 -0.91 -0.02 0.00 -1.56 0.00 0.00 34.95 32.44 1oh0 s ARG 87 CO 0.11 0.25 -0.26 0.14 -0.81 0.00 0.00 175.30 174.72 1oh0 s VAL 88 N -0.37 2.07 -0.10 7.11 -7.23 -0.32 -1.77 120.40 119.78 1oh0 s VAL 88 Ca 0.04 -1.14 0.03 0.00 -1.81 0.00 0.00 61.98 59.10 1oh0 s VAL 88 Cb -0.05 -1.72 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 1oh0 s VAL 88 CO -0.00 0.56 -0.20 -1.61 -0.31 0.00 0.00 175.10 173.54 1oh0 s GLU 89 N -0.68 3.09 0.00 4.82 2.02 0.53 -0.73 118.70 127.76 1oh0 s GLU 89 Ca 0.10 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.29 1oh0 s GLU 89 Cb -0.10 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.72 1oh0 s GLU 89 CO -0.01 0.24 0.00 0.00 0.02 0.00 0.00 175.26 175.51 1oh0 n MET 90 N 3.40 0.00 -4.88 1.61 0.00 -0.89 -1.41 117.12 114.95 1oh0 n MET 90 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 57.70 57.19 1oh0 n MET 90 Cb 0.53 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.60 1oh0 n MET 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1oh0 s VAL 91 N -1.69 2.90 -0.13 3.17 1.01 -1.26 -1.10 120.40 123.29 1oh0 s VAL 91 Ca 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1oh0 s VAL 91 Cb 0.00 -2.18 0.03 0.00 0.00 0.00 0.00 36.38 34.23 1oh0 s VAL 91 CO 0.00 0.55 -0.04 0.86 0.00 0.00 0.00 175.10 176.46 1oh0 s TRP 92 N 0.04 1.37 -1.39 5.22 -0.11 -0.16 -4.79 118.94 119.12 1oh0 s TRP 92 Ca -0.06 -0.76 -0.09 0.00 1.22 0.00 0.00 56.10 56.42 1oh0 s TRP 92 Cb -0.15 -1.16 0.03 0.00 -1.50 0.00 0.00 33.47 30.69 1oh0 s TRP 92 CO 0.05 -0.52 1.05 -1.71 -4.62 0.00 0.00 176.95 171.19 1oh0 n ASN 93 N 4.97 -4.81 -2.32 5.86 5.15 -1.26 -1.96 115.26 120.89 1oh0 n ASN 93 Ca -0.11 -0.66 -0.18 0.00 -0.60 0.00 0.00 54.58 53.04 1oh0 n ASN 93 Cb 0.49 -4.56 0.02 0.00 -0.53 0.00 0.00 39.78 35.19 1oh0 n ASN 93 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oh0 n GLY 94 N -1.76 -0.30 3.31 8.20 0.00 -1.26 -5.01 105.19 108.37 1oh0 n GLY 94 Ca -0.05 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 1oh0 n GLY 94 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1oh0 s GLN 95 N -5.30 0.47 -0.01 1.61 0.74 -0.83 -5.13 119.66 111.22 1oh0 s GLN 95 Ca 0.18 0.67 -0.36 0.00 0.05 0.00 0.00 55.36 55.89 1oh0 s GLN 95 Cb -0.08 0.15 -0.15 0.00 1.10 0.00 0.00 33.01 34.03 1oh0 s GLN 95 CO 0.22 -0.09 1.59 -2.30 -0.55 0.00 0.00 175.29 174.15 1oh0 n PRO 96 N 3.35 1.59 -4.31 1.67 -0.02 -1.26 -0.99 135.00 135.03 1oh0 n PRO 96 Ca -0.17 0.58 -0.16 0.00 -2.02 0.00 0.00 63.50 61.73 1oh0 n PRO 96 Cb 0.56 -2.30 -0.10 0.00 -0.02 0.00 0.00 33.50 31.65 1oh0 n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oh0 s ALA 98 N -3.68 0.41 -0.08 0.00 0.00 -0.38 -2.09 121.76 115.94 1oh0 s ALA 98 Ca 0.34 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1oh0 s ALA 98 Cb 0.07 -0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.19 1oh0 s ALA 98 CO 0.11 0.03 -0.08 -1.17 0.00 0.00 0.00 175.76 174.65 1oh0 s LEU 99 N -0.74 1.32 -0.09 0.00 2.96 0.09 -0.72 118.68 121.50 1oh0 s LEU 99 Ca -0.04 -0.24 -0.18 0.00 -0.22 0.00 0.00 54.13 53.44 1oh0 s LEU 99 Cb -0.05 -0.71 -0.04 0.00 0.50 0.00 0.00 46.19 45.88 1oh0 s LEU 99 CO -0.00 -0.06 0.50 -1.81 -1.32 0.00 0.00 176.35 173.66 1oh0 s ASP 100 N 1.18 6.74 0.06 3.68 1.01 -0.73 -1.17 116.67 127.44 1oh0 s ASP 100 Ca -0.06 0.89 0.01 0.00 0.71 0.00 0.00 52.55 54.10 1oh0 s ASP 100 Cb -0.14 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.46 1oh0 s ASP 100 CO -0.02 0.03 -0.06 -0.69 0.21 0.00 0.00 175.17 174.64 1oh0 s VAL 101 N 0.41 0.47 -0.09 -1.27 1.01 -0.24 -4.74 120.40 115.95 1oh0 s VAL 101 Ca 0.27 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.81 1oh0 s VAL 101 Cb -0.16 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1oh0 s VAL 101 CO 0.12 -0.66 -0.07 -0.63 0.00 0.00 0.00 175.10 173.86 1oh0 s ILE 102 N -2.51 0.91 -0.12 2.22 1.01 -0.91 -1.07 121.20 120.73 1oh0 s ILE 102 Ca -0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 60.65 60.33 1oh0 s ILE 102 Cb -0.02 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 1oh0 s ILE 102 CO -0.03 0.33 0.04 -1.81 0.00 0.00 0.00 174.94 173.48 1oh0 s ASP 103 N 1.38 5.55 -0.15 3.58 1.11 -0.70 -0.16 116.67 127.28 1oh0 s ASP 103 Ca -0.02 0.18 -0.01 0.00 0.18 0.00 0.00 52.55 52.89 1oh0 s ASP 103 Cb -0.14 -1.74 -0.01 0.00 1.07 0.00 0.00 42.92 42.11 1oh0 s ASP 103 CO -0.04 0.32 -0.13 -0.69 1.18 0.00 0.00 175.17 175.82 1oh0 s VAL 104 N -0.54 2.93 0.04 -1.27 1.01 0.10 -1.26 120.40 121.41 1oh0 s VAL 104 Ca 0.10 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1oh0 s VAL 104 Cb -0.12 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1oh0 s VAL 104 CO 0.02 0.51 -0.16 -0.04 0.00 0.00 0.00 175.10 175.43 1oh0 s MET 105 N 0.73 1.05 -0.11 2.72 -1.94 -0.09 -1.15 119.30 120.51 1oh0 s MET 105 Ca -0.06 -0.79 0.03 0.00 -1.71 0.00 0.00 55.69 53.17 1oh0 s MET 105 Cb -0.15 -1.08 0.00 0.00 2.01 0.00 0.00 34.83 35.61 1oh0 s MET 105 CO 0.02 0.27 -0.22 0.50 -0.01 0.00 0.00 175.02 175.57 1oh0 s ARG 106 N -1.11 3.08 0.06 2.03 3.52 -0.62 -1.20 118.95 124.70 1oh0 s ARG 106 Ca 0.03 -0.85 0.01 0.00 -0.13 0.00 0.00 55.73 54.78 1oh0 s ARG 106 Cb -0.08 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.90 1oh0 s ARG 106 CO 0.01 0.13 0.17 -0.06 -0.81 0.00 0.00 175.30 174.75 1oh0 s PHE 107 N 0.47 3.43 0.51 5.12 0.40 0.48 -0.06 117.98 128.33 1oh0 s PHE 107 Ca -0.15 0.21 0.01 0.00 -0.60 0.00 0.00 56.93 56.40 1oh0 s PHE 107 Cb -0.17 -1.73 0.10 0.00 0.51 0.00 0.00 43.02 41.73 1oh0 s PHE 107 CO 0.06 0.57 0.70 -0.40 0.70 0.00 0.00 175.22 176.86 1oh0 n ASP 108 N 0.37 1.07 0.00 1.36 3.85 0.37 -4.82 116.55 118.76 1oh0 n ASP 108 Ca -0.06 -1.88 0.06 0.00 -0.71 0.00 0.00 54.79 52.20 1oh0 n ASP 108 Cb 0.51 -0.44 0.30 0.00 -1.35 0.00 0.00 41.12 40.13 1oh0 n ASP 108 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1oh0 n GLU 109 N -2.27 0.21 -0.15 0.11 1.02 -1.26 -1.50 120.64 116.80 1oh0 n GLU 109 Ca 0.12 0.13 0.06 0.00 -0.02 0.00 0.00 57.16 57.45 1oh0 n GLU 109 Cb 0.43 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.49 1oh0 n GLU 109 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1oh0 n HIS 110 N -1.21 0.39 -1.06 -0.32 8.25 -1.26 -4.52 115.22 115.49 1oh0 n HIS 110 Ca 0.06 -0.40 -0.02 0.00 -0.26 0.00 0.00 57.72 57.10 1oh0 n HIS 110 Cb 0.07 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 1oh0 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1oh0 n GLY 111 N 0.60 0.56 3.83 -1.41 0.00 -0.56 -5.04 105.19 103.17 1oh0 n GLY 111 Ca 0.11 -0.55 -0.27 0.00 0.00 0.00 0.00 46.02 45.31 1oh0 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oh0 s ARG 112 N -1.52 3.02 -0.19 1.61 0.52 -1.26 -4.84 118.95 116.29 1oh0 s ARG 112 Ca 0.00 -0.79 -0.29 0.00 -0.52 0.00 0.00 55.73 54.13 1oh0 s ARG 112 Cb 0.00 -2.73 -0.02 0.00 0.52 0.00 0.00 34.95 32.73 1oh0 s ARG 112 CO 0.00 0.50 1.38 0.42 0.02 0.00 0.00 175.30 177.63 1oh0 s ILE 113 N -1.71 4.06 -0.08 1.52 1.01 0.47 -0.47 121.20 125.99 1oh0 s ILE 113 Ca 0.32 1.25 -0.09 0.00 0.00 0.00 0.00 60.65 62.12 1oh0 s ILE 113 Cb -0.11 -3.91 -0.29 0.00 0.01 0.00 0.00 42.46 38.17 1oh0 s ILE 113 CO 0.24 -0.22 0.52 -0.61 0.00 0.00 0.00 174.94 174.87 1oh0 h GLN 114 N 9.03 0.33 -3.58 2.79 5.75 -0.80 0.61 115.11 129.24 1oh0 h GLN 114 Ca -0.29 -0.57 -0.20 0.00 -0.15 0.00 0.00 58.65 57.44 1oh0 h GLN 114 Cb 1.12 0.21 -0.26 0.00 1.07 0.00 0.00 27.48 29.62 1oh0 h GLN 114 CO 0.99 1.27 -0.62 0.95 -2.65 0.00 0.00 178.83 178.77 1oh0 s THR 115 N -2.57 0.02 -0.02 2.39 -4.23 -1.12 -1.74 115.64 108.37 1oh0 s THR 115 Ca -0.19 -0.17 0.03 0.00 -1.18 0.00 0.00 61.69 60.18 1oh0 s THR 115 Cb 0.06 -0.17 -0.00 0.00 1.34 0.00 0.00 72.50 73.73 1oh0 s THR 115 CO 0.81 -0.09 -0.10 -0.32 -0.54 0.00 0.00 174.62 174.38 1oh0 s MET 116 N -0.26 0.97 -0.07 3.99 1.75 -0.61 -1.59 119.30 123.46 1oh0 s MET 116 Ca -0.03 -0.34 -0.01 0.00 -1.25 0.00 0.00 55.69 54.06 1oh0 s MET 116 Cb -0.02 -0.91 0.03 0.00 2.84 0.00 0.00 34.83 36.77 1oh0 s MET 116 CO 0.00 0.15 -0.02 -0.65 -0.65 0.00 0.00 175.02 173.85 1oh0 s GLN 117 N 0.06 0.81 -0.34 4.11 -0.21 -0.30 -1.18 119.66 122.62 1oh0 s GLN 117 Ca -0.01 -0.00 -0.09 0.00 0.02 0.00 0.00 55.36 55.28 1oh0 s GLN 117 Cb -0.07 -1.03 0.02 0.00 1.00 0.00 0.00 33.01 32.93 1oh0 s GLN 117 CO 0.00 -0.24 0.14 0.00 -2.12 0.00 0.00 175.29 173.08 1oh0 s ALA 118 N 1.65 3.17 -0.31 6.09 0.00 0.01 -0.72 121.76 131.66 1oh0 s ALA 118 Ca 0.01 -1.61 -0.21 0.00 0.00 0.00 0.00 51.96 50.14 1oh0 s ALA 118 Cb -0.13 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.61 1oh0 s ALA 118 CO -0.04 -1.19 0.67 0.71 0.00 0.00 0.00 175.76 175.91 1oh0 s TYR 119 N 1.51 3.21 -0.20 0.00 1.51 0.78 -0.13 117.35 124.03 1oh0 s TYR 119 Ca 0.02 0.64 -0.36 0.00 -1.01 0.00 0.00 57.07 56.36 1oh0 s TYR 119 Cb -0.18 -3.06 0.14 0.00 -0.11 0.00 0.00 41.96 38.75 1oh0 s TYR 119 CO 0.05 -0.50 1.27 1.67 -1.11 0.00 0.00 175.55 176.92 1oh0 s TRP 120 N 2.71 -0.08 0.19 2.71 1.48 -1.26 -2.14 118.94 122.54 1oh0 s TRP 120 Ca 0.27 0.04 -0.07 0.00 -1.06 0.00 0.00 56.10 55.28 1oh0 s TRP 120 Cb -0.15 0.51 0.03 0.00 -1.16 0.00 0.00 33.47 32.71 1oh0 s TRP 120 CO 0.12 -0.15 0.39 -1.13 -4.06 0.00 0.00 176.95 172.12 1oh0 n SER 121 N -0.12 -1.13 0.32 -2.66 3.41 -1.26 -4.75 113.62 107.43 1oh0 n SER 121 Ca 0.01 -1.78 0.20 0.00 -0.26 0.00 0.00 58.87 57.04 1oh0 n SER 121 Cb 0.58 1.88 1.09 0.00 -0.26 0.00 0.00 64.21 67.51 1oh0 n SER 121 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1oh0 h GLU 122 N 0.00 0.00 0.00 4.33 9.09 -2.00 -0.41 114.58 125.60 1oh0 h GLU 122 Ca -0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.24 1oh0 h GLU 122 Cb 0.61 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.71 1oh0 h GLU 122 CO 0.21 0.00 0.00 1.33 0.05 0.00 0.00 179.01 180.60 1oh0 n VAL 123 N -3.35 0.92 0.00 -1.06 0.24 -1.26 -2.06 118.33 111.76 1oh0 n VAL 123 Ca -0.03 0.27 0.10 0.00 -2.04 0.00 0.00 64.34 62.64 1oh0 n VAL 123 Cb 0.10 -1.16 0.21 0.00 -1.47 0.00 0.00 33.84 31.52 1oh0 n VAL 123 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1oh0 n ASN 124 N -2.02 3.32 -4.66 -1.34 4.13 -0.16 -4.93 115.26 109.59 1oh0 n ASN 124 Ca 0.02 -1.94 -0.37 0.00 1.68 0.00 0.00 54.58 53.97 1oh0 n ASN 124 Cb 0.20 -0.29 -0.09 0.00 -1.54 0.00 0.00 39.78 38.06 1oh0 n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1oh0 s LEU 125 N -1.17 4.13 0.09 3.41 2.96 -0.88 -1.77 118.68 125.45 1oh0 s LEU 125 Ca 0.35 0.20 0.09 0.00 -0.22 0.00 0.00 54.13 54.55 1oh0 s LEU 125 Cb 0.19 -2.19 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 1oh0 s LEU 125 CO 0.26 0.04 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.66 1oh0 s SER 126 N 1.04 2.82 0.00 3.68 0.01 0.10 -4.99 113.70 116.36 1oh0 s SER 126 Ca 0.10 -0.65 0.25 0.00 1.31 0.00 0.00 55.95 56.95 1oh0 s SER 126 Cb -0.14 -0.20 0.37 0.00 0.21 0.00 0.00 66.02 66.27 1oh0 s SER 126 CO 0.05 0.14 1.36 0.52 0.41 0.00 0.00 173.24 175.72