#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fpr s LYS 5 N 0.00 4.30 0.10 3.69 -2.85 -1.26 -0.51 119.74 123.21 2fpr s LYS 5 Ca 0.00 0.45 0.10 0.00 -1.00 0.00 0.00 55.97 55.51 2fpr s LYS 5 Cb 0.00 -3.41 -0.04 0.00 -2.06 0.00 0.00 37.83 32.32 2fpr s LYS 5 CO 0.00 0.21 -0.24 0.71 0.10 0.00 0.00 175.35 176.13 2fpr s TYR 6 N 0.44 2.08 -0.21 1.78 2.02 -1.26 -1.92 117.35 120.27 2fpr s TYR 6 Ca 0.26 -0.40 -0.03 0.00 -0.37 0.00 0.00 57.07 56.53 2fpr s TYR 6 Cb -0.15 -1.15 -0.00 0.00 -0.40 0.00 0.00 41.96 40.25 2fpr s TYR 6 CO 0.11 0.25 -0.08 -0.51 -1.57 0.00 0.00 175.55 173.75 2fpr s LEU 7 N -1.84 2.74 -0.41 -1.29 1.43 0.05 -1.49 118.68 117.87 2fpr s LEU 7 Ca 0.11 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 52.58 2fpr s LEU 7 Cb -0.10 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.46 2fpr s LEU 7 CO 0.05 -0.02 0.30 -0.36 0.23 0.00 0.00 176.35 176.54 2fpr s PHE 8 N 1.43 3.24 -0.14 0.29 0.08 0.53 -0.71 117.98 122.70 2fpr s PHE 8 Ca 0.05 -0.57 0.01 0.00 0.12 0.00 0.00 56.93 56.54 2fpr s PHE 8 Cb -0.14 -2.59 -0.00 0.00 -0.57 0.00 0.00 43.02 39.72 2fpr s PHE 8 CO -0.06 -0.58 -0.18 0.42 -0.10 0.00 0.00 175.22 174.73 2fpr s ILE 9 N 1.69 2.51 0.75 0.64 1.01 0.51 -0.50 121.20 127.81 2fpr s ILE 9 Ca 0.05 -0.83 -0.13 0.00 0.00 0.00 0.00 60.65 59.74 2fpr s ILE 9 Cb -0.19 -2.03 0.05 0.00 0.01 0.00 0.00 42.46 40.30 2fpr s ILE 9 CO 0.10 0.53 1.14 -0.62 0.00 0.00 0.00 174.94 176.10 2fpr s ASP 10 N 0.66 4.28 0.00 3.58 2.15 -0.22 -1.26 116.67 125.86 2fpr s ASP 10 Ca -0.09 2.12 0.00 0.00 0.43 0.00 0.00 52.55 55.01 2fpr s ASP 10 Cb -0.16 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 2fpr s ASP 10 CO 0.02 -2.19 0.00 -1.14 -0.17 0.00 0.00 175.17 171.69 2fpr n ARG 11 N -3.08 0.00 -2.07 4.34 0.63 -1.26 -3.65 116.66 111.57 2fpr n ARG 11 Ca 0.11 0.10 -0.42 0.00 -0.92 0.00 0.00 57.85 56.72 2fpr n ARG 11 Cb 0.52 -0.49 -0.03 0.00 0.45 0.00 0.00 32.46 32.91 2fpr n ARG 11 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2fpr s ASP 12 N -2.87 6.72 0.00 6.15 1.11 -1.26 -0.68 116.67 125.84 2fpr s ASP 12 Ca 0.00 2.30 0.00 0.00 0.18 0.00 0.00 52.55 55.03 2fpr s ASP 12 Cb 0.00 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 2fpr s ASP 12 CO 0.00 -0.81 0.00 0.61 1.18 0.00 0.00 175.17 176.15 2fpr n GLY 13 N 3.84 0.83 1.53 0.21 0.00 0.21 -4.80 105.19 107.02 2fpr n GLY 13 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2fpr n GLY 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fpr n THR 14 N -2.16 0.37 0.11 2.61 -1.04 -0.83 -4.57 114.28 108.76 2fpr n THR 14 Ca 0.00 0.12 -0.20 0.00 -2.04 0.00 0.00 64.05 61.93 2fpr n THR 14 Cb 0.00 -0.82 -0.15 0.00 -1.82 0.00 0.00 70.33 67.55 2fpr n THR 14 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2fpr h LEU 15 N 0.00 0.60 -8.52 -4.42 3.38 -0.97 -3.43 115.31 101.96 2fpr h LEU 15 Ca 0.00 -0.71 -0.26 0.00 0.09 0.00 0.00 57.88 57.00 2fpr h LEU 15 Cb 0.00 -0.20 -0.15 0.00 0.09 0.00 0.00 40.66 40.41 2fpr h LEU 15 CO 0.00 1.57 -0.70 0.27 0.09 0.00 0.00 178.44 179.67 2fpr s ILE 16 N -2.62 0.87 0.70 1.22 -4.36 -1.05 -1.51 121.20 114.45 2fpr s ILE 16 Ca -0.09 -1.97 -0.14 0.00 -0.26 0.00 0.00 60.65 58.20 2fpr s ILE 16 Cb 0.06 -1.73 0.02 0.00 1.25 0.00 0.00 42.46 42.06 2fpr s ILE 16 CO 0.90 -0.82 1.12 -0.94 0.24 0.00 0.00 174.94 175.44 2fpr s SER 17 N -3.06 4.80 -0.19 4.36 1.04 0.60 0.66 113.70 121.90 2fpr s SER 17 Ca 0.13 2.03 -0.04 0.00 0.48 0.00 0.00 55.95 58.55 2fpr s SER 17 Cb 0.04 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.59 2fpr s SER 17 CO -0.03 -1.84 -0.02 -0.70 0.98 0.00 0.00 173.24 171.63 2fpr s GLU 18 N -4.22 3.55 0.13 4.02 2.12 -1.26 -4.17 118.70 118.88 2fpr s GLU 18 Ca 0.67 -0.56 -0.31 0.00 0.36 0.00 0.00 54.97 55.13 2fpr s GLU 18 Cb -0.21 -3.01 -0.10 0.00 0.26 0.00 0.00 34.13 31.06 2fpr s GLU 18 CO 0.45 0.01 1.73 -2.14 -0.54 0.00 0.00 175.26 174.77 2fpr s PRO 19 N 0.99 4.16 0.00 4.30 0.02 -1.26 -4.90 135.00 138.31 2fpr s PRO 19 Ca 0.01 2.51 0.21 0.00 0.02 0.00 0.00 61.00 63.74 2fpr s PRO 19 Cb -0.14 -3.43 1.11 0.00 0.02 0.00 0.00 34.50 32.06 2fpr s PRO 19 CO 0.01 -0.77 1.65 -0.35 -0.33 0.00 0.00 177.00 177.21 2fpr n PRO 20 N 5.08 0.41 -0.01 5.54 -0.04 -1.26 -1.05 135.00 143.67 2fpr n PRO 20 Ca 0.16 0.06 -0.00 0.00 -0.04 0.00 0.00 63.50 63.69 2fpr n PRO 20 Cb 0.38 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2fpr n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2fpr h SER 21 N 0.00 0.00 -0.05 3.54 4.64 -1.99 -3.43 113.55 116.26 2fpr h SER 21 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fpr h SER 21 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2fpr h SER 21 CO 0.00 0.10 0.00 -0.90 -0.87 0.00 0.00 176.83 175.16 2fpr n ASP 22 N -2.55 1.71 -2.15 4.97 5.68 -1.25 -5.00 116.55 117.96 2fpr n ASP 22 Ca -0.00 -1.45 -0.21 0.00 -0.50 0.00 0.00 54.79 52.63 2fpr n ASP 22 Cb 0.01 -0.03 -0.03 0.00 -1.14 0.00 0.00 41.12 39.92 2fpr n ASP 22 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2fpr n PHE 23 N 0.16 -0.70 -4.02 2.11 3.72 -0.21 -4.97 117.46 113.54 2fpr n PHE 23 Ca 0.03 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.26 2fpr n PHE 23 Cb 0.18 -3.82 -0.16 0.00 -0.94 0.00 0.00 39.48 34.75 2fpr n PHE 23 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 2fpr s GLN 24 N -4.65 0.44 -1.07 -1.08 -2.07 -1.26 -4.74 119.66 105.23 2fpr s GLN 24 Ca 0.00 -0.01 -0.18 0.00 -1.82 0.00 0.00 55.36 53.34 2fpr s GLN 24 Cb 0.00 -0.54 0.12 0.00 -1.09 0.00 0.00 33.01 31.50 2fpr s GLN 24 CO 0.00 -0.08 1.35 0.08 -1.32 0.00 0.00 175.29 175.33 2fpr s VAL 25 N 0.77 4.58 -0.35 3.63 1.01 -1.26 -4.71 120.40 124.07 2fpr s VAL 25 Ca -0.08 -1.76 0.07 0.00 0.00 0.00 0.00 61.98 60.21 2fpr s VAL 25 Cb -0.12 -4.92 0.18 0.00 0.00 0.00 0.00 36.38 31.52 2fpr s VAL 25 CO -0.01 -1.69 1.14 -0.90 0.00 0.00 0.00 175.10 173.64 2fpr n ASP 26 N 6.98 2.52 -3.86 3.32 5.68 -1.26 -4.52 116.55 125.42 2fpr n ASP 26 Ca 0.32 -2.21 -0.11 0.00 -0.50 0.00 0.00 54.79 52.29 2fpr n ASP 26 Cb 0.47 -0.18 -0.09 0.00 -1.14 0.00 0.00 41.12 40.19 2fpr n ASP 26 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2fpr s ARG 27 N -1.37 0.58 0.48 0.11 0.52 -1.26 -4.67 118.95 113.35 2fpr s ARG 27 Ca 0.15 -0.50 0.21 0.00 -0.52 0.00 0.00 55.73 55.08 2fpr s ARG 27 Cb 0.10 0.24 1.24 0.00 0.52 0.00 0.00 34.95 37.05 2fpr s ARG 27 CO 0.07 -0.15 2.03 0.74 0.02 0.00 0.00 175.30 178.00 2fpr h PHE 28 N 3.89 0.00 0.00 -0.53 0.04 -1.93 -1.77 116.94 116.64 2fpr h PHE 28 Ca -0.31 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.46 2fpr h PHE 28 Cb 1.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.34 2fpr h PHE 28 CO 0.55 0.16 0.00 -0.40 -0.60 0.00 0.00 178.31 178.02 2fpr n ASP 29 N -3.95 0.00 -0.40 2.17 5.75 -1.26 -2.50 116.55 116.36 2fpr n ASP 29 Ca -0.02 -1.53 0.04 0.00 -0.01 0.00 0.00 54.79 53.28 2fpr n ASP 29 Cb 0.25 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.40 2fpr n ASP 29 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2fpr n LYS 30 N -0.68 1.19 -3.34 0.11 5.02 -0.67 -4.98 118.16 114.81 2fpr n LYS 30 Ca 0.08 -1.35 -0.39 0.00 -2.02 0.00 0.00 58.31 54.64 2fpr n LYS 30 Cb 0.04 -1.18 -0.08 0.00 -0.02 0.00 0.00 35.03 33.79 2fpr n LYS 30 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2fpr s LEU 31 N -0.82 4.12 -0.17 -0.35 2.96 -1.04 -4.77 118.68 118.62 2fpr s LEU 31 Ca 0.13 0.51 -0.06 0.00 -0.22 0.00 0.00 54.13 54.48 2fpr s LEU 31 Cb 0.08 -2.55 0.07 0.00 0.50 0.00 0.00 46.19 44.29 2fpr s LEU 31 CO 0.11 -0.14 0.36 0.00 -1.32 0.00 0.00 176.35 175.36 2fpr s ALA 32 N 1.62 -0.91 0.32 5.97 0.00 -1.26 -5.04 121.76 122.47 2fpr s ALA 32 Ca 0.19 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 53.17 2fpr s ALA 32 Cb -0.15 -1.12 -0.10 0.00 0.00 0.00 0.00 23.12 21.75 2fpr s ALA 32 CO 0.09 -0.61 1.21 -0.06 0.00 0.00 0.00 175.76 176.39 2fpr s PHE 33 N 2.28 3.25 0.57 0.00 0.08 -1.26 -0.29 117.98 122.60 2fpr s PHE 33 Ca -0.02 1.54 -0.19 0.00 0.12 0.00 0.00 56.93 58.37 2fpr s PHE 33 Cb -0.11 -3.50 -0.05 0.00 -0.57 0.00 0.00 43.02 38.79 2fpr s PHE 33 CO -0.11 -1.31 1.17 -1.21 -0.10 0.00 0.00 175.22 173.66 2fpr s GLU 34 N -1.73 3.18 0.18 0.44 0.41 -0.57 -4.76 118.70 115.84 2fpr s GLU 34 Ca 0.48 1.72 -0.32 0.00 -0.41 0.00 0.00 54.97 56.44 2fpr s GLU 34 Cb -0.36 -1.97 -0.11 0.00 -1.78 0.00 0.00 34.13 29.91 2fpr s GLU 34 CO 0.47 -1.02 1.70 -2.14 -0.49 0.00 0.00 175.26 173.78 2fpr s PRO 35 N -3.30 4.15 0.00 0.39 0.02 -1.26 -2.99 135.00 132.01 2fpr s PRO 35 Ca 0.75 2.54 0.00 0.00 0.02 0.00 0.00 61.00 64.31 2fpr s PRO 35 Cb -0.27 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.07 2fpr s PRO 35 CO 0.30 -0.73 0.00 0.41 -0.33 0.00 0.00 177.00 176.65 2fpr n GLY 36 N 3.96 0.58 0.36 0.52 0.00 -1.26 -4.38 105.19 104.96 2fpr n GLY 36 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 2fpr n GLY 36 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2fpr h VAL 37 N 0.00 1.03 0.57 1.61 3.04 -1.89 -1.33 116.25 119.28 2fpr h VAL 37 Ca 0.00 -0.37 -0.03 0.00 -1.01 0.00 0.00 66.70 65.29 2fpr h VAL 37 Cb 0.11 -0.15 0.01 0.00 -2.01 0.00 0.00 31.29 29.25 2fpr h VAL 37 CO 0.00 0.20 -0.28 0.40 -1.01 0.00 0.00 177.57 176.88 2fpr h ILE 38 N 1.08 0.12 -0.47 3.17 1.08 -1.90 -0.90 117.51 119.68 2fpr h ILE 38 Ca 0.44 -0.43 0.03 0.00 -0.39 0.00 0.00 64.86 64.51 2fpr h ILE 38 Cb 0.26 0.18 -0.03 0.00 -3.07 0.00 0.00 36.82 34.16 2fpr h ILE 38 CO -0.20 0.02 0.31 1.55 -0.69 0.00 0.00 178.15 179.14 2fpr h PRO 39 N -1.15 0.50 -0.15 2.37 0.13 -1.98 -1.66 132.00 130.07 2fpr h PRO 39 Ca -0.08 -0.03 -0.20 0.00 -0.87 0.00 0.00 66.00 64.82 2fpr h PRO 39 Cb 0.63 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.64 2fpr h PRO 39 CO 0.13 0.33 -0.71 1.96 -0.23 0.00 0.00 178.00 179.48 2fpr h GLN 40 N 0.52 0.64 -0.30 0.86 1.08 -1.23 -0.86 115.11 115.82 2fpr h GLN 40 Ca 0.19 -0.50 -0.09 0.00 -1.45 0.00 0.00 58.65 56.80 2fpr h GLN 40 Cb 0.12 0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2fpr h GLN 40 CO -0.05 1.12 -0.21 -0.07 -0.95 0.00 0.00 178.83 178.67 2fpr h LEU 41 N 0.45 0.55 -0.62 1.46 3.38 -0.92 -0.39 115.31 119.22 2fpr h LEU 41 Ca -0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2fpr h LEU 41 Cb 1.31 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2fpr h LEU 41 CO 0.14 0.76 0.28 -0.07 0.09 0.00 0.00 178.44 179.64 2fpr h LEU 42 N 0.49 0.83 -0.59 1.67 3.38 -1.15 0.02 115.31 119.96 2fpr h LEU 42 Ca 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2fpr h LEU 42 Cb 0.63 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2fpr h LEU 42 CO 0.04 0.75 0.34 0.50 0.09 0.00 0.00 178.44 180.16 2fpr h LYS 43 N 0.86 0.82 -0.58 1.13 3.64 -0.81 -1.28 116.57 120.35 2fpr h LYS 43 Ca 0.21 -0.09 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 2fpr h LYS 43 Cb 0.16 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2fpr h LYS 43 CO -0.02 0.62 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.66 2fpr h LEU 44 N 0.80 1.03 -0.54 5.20 3.38 -0.82 -2.29 115.31 122.08 2fpr h LEU 44 Ca 0.21 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2fpr h LEU 44 Cb 0.02 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 2fpr h LEU 44 CO -0.04 1.10 0.33 1.56 0.09 0.00 0.00 178.44 181.49 2fpr h GLN 45 N 0.95 0.73 0.00 1.13 4.20 -0.81 -2.42 115.11 118.89 2fpr h GLN 45 Ca 0.16 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 2fpr h GLN 45 Cb 0.60 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2fpr h GLN 45 CO 0.04 0.52 -0.10 0.87 -0.67 0.00 0.00 178.83 179.48 2fpr h LYS 46 N 0.73 0.00 -0.00 1.46 1.57 -0.96 -0.55 116.57 118.80 2fpr h LYS 46 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2fpr h LYS 46 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2fpr h LYS 46 CO -0.04 0.10 -0.03 0.00 -0.57 0.00 0.00 179.45 178.91 2fpr n ALA 47 N -2.32 2.66 0.00 3.86 0.00 -0.89 -4.92 120.51 118.90 2fpr n ALA 47 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2fpr n ALA 47 Cb 0.20 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.24 2fpr n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fpr n GLY 48 N 1.14 0.69 3.75 0.00 0.00 -0.22 -5.09 105.19 105.47 2fpr n GLY 48 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2fpr n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fpr s TYR 49 N -2.00 3.22 0.11 1.61 2.02 -0.95 -4.70 117.35 116.67 2fpr s TYR 49 Ca 0.00 1.37 -0.02 0.00 -0.37 0.00 0.00 57.07 58.05 2fpr s TYR 49 Cb 0.00 -3.58 -0.05 0.00 -0.40 0.00 0.00 41.96 37.93 2fpr s TYR 49 CO 0.00 -1.66 0.30 0.15 -1.57 0.00 0.00 175.55 172.77 2fpr s LYS 50 N -1.01 3.52 -0.06 -0.62 1.02 -0.81 -4.28 119.74 117.51 2fpr s LYS 50 Ca 0.52 -0.29 0.04 0.00 0.02 0.00 0.00 55.97 56.26 2fpr s LYS 50 Cb -0.37 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 33.98 2fpr s LYS 50 CO 0.45 0.53 -0.19 -0.51 -0.92 0.00 0.00 175.35 174.71 2fpr s LEU 51 N -2.68 2.46 -0.06 3.17 1.43 -1.26 -0.77 118.68 120.96 2fpr s LEU 51 Ca 0.38 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2fpr s LEU 51 Cb -0.12 -1.48 0.02 0.00 0.03 0.00 0.00 46.19 44.63 2fpr s LEU 51 CO 0.27 0.28 -0.05 -0.69 0.23 0.00 0.00 176.35 176.39 2fpr s VAL 52 N -0.38 0.62 -0.01 -1.59 1.01 0.11 -0.03 120.40 120.12 2fpr s VAL 52 Ca 0.03 -0.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 2fpr s VAL 52 Cb -0.12 -0.65 -0.06 0.00 0.00 0.00 0.00 36.38 35.55 2fpr s VAL 52 CO 0.02 0.26 0.48 -0.32 0.00 0.00 0.00 175.10 175.54 2fpr s MET 53 N 1.15 4.14 -0.04 2.72 1.75 -0.38 -0.36 119.30 128.27 2fpr s MET 53 Ca -0.07 0.54 -0.02 0.00 -1.25 0.00 0.00 55.69 54.88 2fpr s MET 53 Cb -0.14 -3.29 0.03 0.00 2.84 0.00 0.00 34.83 34.27 2fpr s MET 53 CO -0.01 0.51 0.07 -1.50 -0.65 0.00 0.00 175.02 173.43 2fpr s ILE 54 N -0.56 -0.12 -0.15 10.11 1.10 -0.39 -0.16 121.20 131.03 2fpr s ILE 54 Ca 0.26 0.40 -0.12 0.00 -0.51 0.00 0.00 60.65 60.68 2fpr s ILE 54 Cb -0.17 -0.16 0.04 0.00 0.15 0.00 0.00 42.46 42.33 2fpr s ILE 54 CO 0.14 0.17 0.39 0.28 -2.11 0.00 0.00 174.94 173.81 2fpr s THR 55 N 2.04 -0.01 -0.22 4.00 -1.32 -0.32 -3.92 115.64 115.91 2fpr s THR 55 Ca 0.03 0.03 -0.22 0.00 -1.21 0.00 0.00 61.69 60.32 2fpr s THR 55 Cb -0.12 -0.55 -0.02 0.00 -1.51 0.00 0.00 72.50 70.30 2fpr s THR 55 CO -0.03 0.01 0.68 0.20 -2.21 0.00 0.00 174.62 173.27 2fpr s ASN 56 N 0.50 6.71 -0.72 8.08 0.01 -1.26 -1.23 114.94 127.03 2fpr s ASN 56 Ca -0.02 0.87 0.04 0.00 -0.71 0.00 0.00 52.86 53.03 2fpr s ASN 56 Cb -0.04 -2.37 0.17 0.00 0.41 0.00 0.00 41.25 39.42 2fpr s ASN 56 CO -0.03 -0.35 0.52 -1.10 -1.51 0.00 0.00 177.10 174.63 2fpr s GLN 57 N 2.25 2.57 -0.16 -0.60 -1.52 0.12 -4.95 119.66 117.37 2fpr s GLN 57 Ca 0.30 -3.26 -0.35 0.00 -1.95 0.00 0.00 55.36 50.10 2fpr s GLN 57 Cb -0.16 -3.52 -0.12 0.00 -0.22 0.00 0.00 33.01 29.00 2fpr s GLN 57 CO 0.10 -1.26 1.92 -0.25 -0.25 0.00 0.00 175.29 175.55 2fpr n ASP 58 N 2.17 3.12 0.00 5.90 9.92 -1.26 -1.62 116.55 134.77 2fpr n ASP 58 Ca 0.18 0.87 0.00 0.00 -0.53 0.00 0.00 54.79 55.32 2fpr n ASP 58 Cb 0.35 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.50 2fpr n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2fpr n GLY 59 N 4.74 0.51 3.68 0.44 0.00 -0.07 -4.80 105.19 109.69 2fpr n GLY 59 Ca 0.26 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.83 2fpr n GLY 59 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2fpr n LEU 60 N 0.00 3.27 0.00 0.99 7.94 -0.64 -1.88 117.00 126.68 2fpr n LEU 60 Ca 0.00 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 2fpr n LEU 60 Cb 0.01 -1.45 0.00 0.00 0.53 0.00 0.00 43.42 42.51 2fpr n LEU 60 CO 0.00 -0.30 0.00 0.61 -1.11 0.00 0.00 177.39 176.59 2fpr n GLY 61 N 2.82 0.72 3.78 -3.96 0.00 -0.01 -4.87 105.19 103.66 2fpr n GLY 61 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2fpr n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fpr s THR 62 N -2.77 1.78 0.60 2.61 -4.23 -0.79 -4.64 115.64 108.21 2fpr s THR 62 Ca 0.00 -1.76 0.38 0.00 -1.18 0.00 0.00 61.69 59.13 2fpr s THR 62 Cb 0.00 -2.54 0.40 0.00 1.34 0.00 0.00 72.50 71.70 2fpr s THR 62 CO 0.00 0.00 2.30 0.06 -0.54 0.00 0.00 174.62 176.44 2fpr h GLN 63 N 1.27 0.00 0.00 3.99 -0.00 -1.97 -0.60 115.11 117.80 2fpr h GLN 63 Ca -0.42 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.20 2fpr h GLN 63 Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.76 2fpr h GLN 63 CO 0.69 0.01 -0.18 0.66 -0.00 0.00 0.00 178.83 180.01 2fpr h SER 64 N 0.00 0.00 -0.68 0.06 4.64 -1.96 -3.38 113.55 112.23 2fpr h SER 64 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2fpr h SER 64 Cb 0.05 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 61.96 2fpr h SER 64 CO 0.00 0.18 -0.55 0.33 -0.87 0.00 0.00 176.83 175.92 2fpr n PHE 65 N -3.27 -3.28 -1.66 4.77 7.35 -0.34 -5.00 117.46 116.02 2fpr n PHE 65 Ca 0.01 -1.76 -0.43 0.00 -0.76 0.00 0.00 57.45 54.51 2fpr n PHE 65 Cb 0.45 1.36 -0.01 0.00 0.35 0.00 0.00 39.48 41.63 2fpr n PHE 65 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2fpr n PRO 66 N 2.27 1.85 -0.28 -7.13 -0.02 -0.57 -0.83 135.00 130.30 2fpr n PRO 66 Ca 0.15 0.65 0.07 0.00 -2.02 0.00 0.00 63.50 62.35 2fpr n PRO 66 Cb 0.59 -2.18 0.22 0.00 -0.02 0.00 0.00 33.50 32.11 2fpr n PRO 66 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2fpr h GLN 67 N 2.30 0.46 -0.30 -0.52 5.75 -1.82 -1.35 115.11 119.63 2fpr h GLN 67 Ca -0.44 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 57.99 2fpr h GLN 67 Cb 1.30 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 2fpr h GLN 67 CO 0.61 0.30 0.03 0.00 -2.65 0.00 0.00 178.83 177.12 2fpr h ALA 68 N 1.59 1.50 -0.23 3.38 0.00 -1.98 -0.35 119.26 123.15 2fpr h ALA 68 Ca 0.45 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 2fpr h ALA 68 Cb 0.72 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2fpr h ALA 68 CO -0.42 0.37 -0.58 -0.44 0.00 0.00 0.00 179.25 178.18 2fpr h ASP 69 N 0.43 0.83 -0.35 0.00 5.19 -1.57 -3.07 116.42 117.88 2fpr h ASP 69 Ca 0.10 -0.46 -0.14 0.00 -0.62 0.00 0.00 57.03 55.91 2fpr h ASP 69 Cb 0.24 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 2fpr h ASP 69 CO 0.00 1.22 -0.34 0.15 -3.12 0.00 0.00 179.24 177.16 2fpr h PHE 70 N 0.56 1.01 -0.68 4.55 3.57 -1.12 -3.37 116.94 121.46 2fpr h PHE 70 Ca 0.00 -0.30 -0.02 0.00 3.53 0.00 0.00 57.97 61.18 2fpr h PHE 70 Cb 1.16 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 2fpr h PHE 70 CO 0.06 1.10 0.35 -0.44 -2.23 0.00 0.00 178.31 177.15 2fpr h ASP 71 N 0.64 0.87 0.23 0.41 3.32 -0.98 -1.49 116.42 119.42 2fpr h ASP 71 Ca 0.06 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2fpr h ASP 71 Cb 0.92 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 2fpr h ASP 71 CO 0.08 0.74 -0.21 1.23 -1.72 0.00 0.00 179.24 179.36 2fpr h GLY 72 N 0.93 -0.90 1.29 2.75 0.00 -1.70 0.15 103.07 105.60 2fpr h GLY 72 Ca 0.24 0.40 0.01 0.00 0.00 0.00 0.00 47.33 47.97 2fpr h GLY 72 CO -0.03 -0.30 0.48 -2.55 0.00 0.00 0.00 176.54 174.13 2fpr h PRO 73 N -0.43 0.95 -0.31 4.80 0.11 -1.76 -1.84 132.00 133.52 2fpr h PRO 73 Ca -0.03 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 2fpr h PRO 73 Cb 0.37 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 2fpr h PRO 73 CO -0.01 0.63 -0.16 1.25 -0.21 0.00 0.00 178.00 179.50 2fpr h HIS 74 N 0.98 0.77 -0.41 0.65 2.76 -1.19 -0.62 115.15 118.09 2fpr h HIS 74 Ca 0.26 -0.19 -0.11 0.00 -2.20 0.00 0.00 60.37 58.13 2fpr h HIS 74 Cb -0.11 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 28.66 2fpr h HIS 74 CO 0.00 0.89 -0.18 -0.91 -1.30 0.00 0.00 177.93 176.43 2fpr h ASN 75 N 0.42 0.79 -0.13 3.26 2.35 -0.58 0.06 115.58 121.76 2fpr h ASN 75 Ca 0.07 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2fpr h ASN 75 Cb 0.69 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 2fpr h ASN 75 CO 0.05 0.96 0.08 0.25 -1.65 0.00 0.00 177.43 177.12 2fpr h LEU 76 N 0.70 0.16 -0.51 1.61 5.85 -1.27 0.84 115.31 122.69 2fpr h LEU 76 Ca 0.11 -0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.86 2fpr h LEU 76 Cb 0.68 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2fpr h LEU 76 CO 0.05 0.15 0.16 -0.03 -0.34 0.00 0.00 178.44 178.43 2fpr h MET 77 N 0.15 0.32 -0.62 1.25 4.05 -0.70 -0.15 114.93 119.24 2fpr h MET 77 Ca 0.05 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.38 2fpr h MET 77 Cb 0.02 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.72 2fpr h MET 77 CO -0.01 0.21 0.10 0.52 0.23 0.00 0.00 176.91 177.97 2fpr h MET 78 N 0.33 1.00 -0.78 0.39 2.86 -0.79 -1.29 114.93 116.65 2fpr h MET 78 Ca 0.25 -0.25 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2fpr h MET 78 Cb 0.29 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.79 2fpr h MET 78 CO -0.27 0.92 0.39 0.37 1.06 0.00 0.00 176.91 179.37 2fpr h GLN 79 N 0.94 1.10 0.00 1.72 -0.00 0.03 0.33 115.11 119.24 2fpr h GLN 79 Ca 0.19 -0.15 -0.00 0.00 -0.00 0.00 0.00 58.65 58.70 2fpr h GLN 79 Cb 0.40 -0.21 0.00 0.00 0.00 0.00 0.00 27.48 27.68 2fpr h GLN 79 CO 0.01 0.84 -0.00 0.82 0.00 0.00 0.00 178.83 180.49 2fpr h ILE 80 N 1.10 1.23 0.53 2.39 1.08 -0.61 -0.49 117.51 122.74 2fpr h ILE 80 Ca 0.27 -0.69 -0.02 0.00 -0.39 0.00 0.00 64.86 64.04 2fpr h ILE 80 Cb 0.09 1.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.51 2fpr h ILE 80 CO -0.04 0.18 -0.47 -0.26 -0.69 0.00 0.00 178.15 176.87 2fpr h PHE 81 N -0.30 -1.30 -0.24 1.37 0.04 -0.96 -1.66 116.94 113.89 2fpr h PHE 81 Ca -0.00 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.83 2fpr h PHE 81 Cb 0.30 0.50 -0.06 0.00 2.20 0.00 0.00 35.95 38.88 2fpr h PHE 81 CO 0.03 -0.65 -0.15 1.15 -0.60 0.00 0.00 178.31 178.09 2fpr h THR 82 N -0.99 0.57 -0.05 -1.55 2.02 -0.85 0.34 112.91 112.38 2fpr h THR 82 Ca -0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2fpr h THR 82 Cb 0.85 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2fpr h THR 82 CO -0.03 0.00 -0.04 0.77 0.37 0.00 0.00 175.52 176.59 2fpr h SER 83 N -0.13 0.07 0.23 4.18 4.64 -1.03 -1.66 113.55 119.85 2fpr h SER 83 Ca 0.13 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2fpr h SER 83 Cb 0.33 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2fpr h SER 83 CO -0.32 0.12 -0.16 0.00 -0.87 0.00 0.00 176.83 175.60 2fpr n GLN 84 N -4.44 0.92 0.00 4.77 1.13 -0.63 -4.93 117.38 114.20 2fpr n GLN 84 Ca -0.02 -0.47 0.00 0.00 -1.94 0.00 0.00 57.00 54.57 2fpr n GLN 84 Cb 0.15 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.01 2fpr n GLN 84 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2fpr n GLY 85 N 1.29 0.71 3.63 1.08 0.00 -0.62 -5.04 105.19 106.24 2fpr n GLY 85 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2fpr n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fpr s VAL 86 N -2.00 4.88 -0.18 1.61 1.01 0.01 -4.97 120.40 120.76 2fpr s VAL 86 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.31 2fpr s VAL 86 Cb 0.00 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.33 2fpr s VAL 86 CO 0.00 -0.08 -0.17 -1.10 0.00 0.00 0.00 175.10 173.76 2fpr s GLN 87 N 2.75 3.09 -0.20 2.72 -1.52 -1.26 -3.05 119.66 122.19 2fpr s GLN 87 Ca 0.31 -0.78 -0.17 0.00 -1.95 0.00 0.00 55.36 52.76 2fpr s GLN 87 Cb -0.15 -2.65 -0.04 0.00 -0.22 0.00 0.00 33.01 29.95 2fpr s GLN 87 CO 0.09 -0.17 0.46 -0.06 -0.25 0.00 0.00 175.29 175.36 2fpr s PHE 88 N 1.25 3.38 0.20 0.91 0.08 -1.26 -4.29 117.98 118.24 2fpr s PHE 88 Ca 0.03 0.71 -0.11 0.00 0.12 0.00 0.00 56.93 57.68 2fpr s PHE 88 Cb -0.14 -2.60 0.16 0.00 -0.57 0.00 0.00 43.02 39.88 2fpr s PHE 88 CO -0.09 -0.04 1.84 -0.44 -0.10 0.00 0.00 175.22 176.38 2fpr h ASP 89 N 7.38 0.65 -5.10 1.36 5.19 -0.85 -3.44 116.42 121.60 2fpr h ASP 89 Ca -0.35 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.94 2fpr h ASP 89 Cb 1.16 -0.14 -0.17 0.00 0.18 0.00 0.00 39.33 40.36 2fpr h ASP 89 CO 0.73 0.45 -0.51 -1.61 -3.12 0.00 0.00 179.24 175.18 2fpr s GLU 90 N -6.12 0.62 -0.28 3.56 2.02 -1.26 -5.08 118.70 112.16 2fpr s GLU 90 Ca -0.13 -0.79 0.02 0.00 0.02 0.00 0.00 54.97 54.09 2fpr s GLU 90 Cb 0.15 0.24 0.06 0.00 0.10 0.00 0.00 34.13 34.68 2fpr s GLU 90 CO 0.76 -0.16 -0.07 0.08 0.02 0.00 0.00 175.26 175.89 2fpr s VAL 91 N -2.79 2.44 -0.25 2.63 1.01 -1.26 -1.25 120.40 120.93 2fpr s VAL 91 Ca -0.03 -1.60 -0.08 0.00 0.00 0.00 0.00 61.98 60.27 2fpr s VAL 91 Cb -0.00 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2fpr s VAL 91 CO -0.05 -0.09 0.09 -0.76 0.00 0.00 0.00 175.10 174.29 2fpr s LEU 92 N 1.14 3.59 -0.10 3.92 1.43 0.78 -4.99 118.68 124.45 2fpr s LEU 92 Ca -0.07 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 2fpr s LEU 92 Cb -0.20 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.07 2fpr s LEU 92 CO -0.04 -0.01 -0.18 -0.63 0.23 0.00 0.00 176.35 175.71 2fpr s ILE 93 N 1.49 1.67 -0.32 -0.59 1.01 -1.26 -1.17 121.20 122.03 2fpr s ILE 93 Ca 0.06 -0.77 -0.11 0.00 0.00 0.00 0.00 60.65 59.82 2fpr s ILE 93 Cb -0.15 -1.48 -0.02 0.00 0.01 0.00 0.00 42.46 40.82 2fpr s ILE 93 CO 0.05 0.47 0.20 0.00 0.00 0.00 0.00 174.94 175.66 2fpr n PRO 95 N 5.06 2.09 -2.52 0.00 -0.04 -1.26 0.16 135.00 138.48 2fpr n PRO 95 Ca -0.13 -1.68 -0.30 0.00 -0.04 0.00 0.00 63.50 61.35 2fpr n PRO 95 Cb 0.50 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.54 2fpr n PRO 95 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2fpr s HIS 96 N -1.46 3.52 0.46 0.54 3.76 -1.26 -0.89 115.29 119.96 2fpr s HIS 96 Ca 0.33 1.10 -0.18 0.00 -0.15 0.00 0.00 55.06 56.16 2fpr s HIS 96 Cb 0.18 -2.52 -0.09 0.00 1.11 0.00 0.00 32.58 31.25 2fpr s HIS 96 CO 0.24 -0.31 0.94 -0.51 -0.85 0.00 0.00 174.74 174.25 2fpr s LEU 97 N -4.39 3.82 0.28 0.89 1.43 -1.26 -3.85 118.68 115.59 2fpr s LEU 97 Ca 0.52 1.59 0.02 0.00 -1.03 0.00 0.00 54.13 55.23 2fpr s LEU 97 Cb -0.10 -4.48 0.62 0.00 0.03 0.00 0.00 46.19 42.26 2fpr s LEU 97 CO 0.40 -0.44 1.76 -0.65 0.23 0.00 0.00 176.35 177.64 2fpr h PRO 98 N 1.52 0.62 0.00 1.29 0.11 -2.00 -0.86 132.00 132.68 2fpr h PRO 98 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2fpr h PRO 98 Cb 1.18 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2fpr h PRO 98 CO 0.62 0.41 0.00 0.00 -0.21 0.00 0.00 178.00 178.81 2fpr h ALA 99 N 1.60 1.00 0.00 -0.75 0.00 -2.04 -2.47 119.26 116.61 2fpr h ALA 99 Ca 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 2fpr h ALA 99 Cb 0.78 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2fpr h ALA 99 CO -0.39 0.00 -0.13 -0.44 0.00 0.00 0.00 179.25 178.29 2fpr h ASP 100 N 0.00 0.00 -6.47 0.00 3.32 -1.53 -3.47 116.42 108.26 2fpr h ASP 100 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 2fpr h ASP 100 Cb 0.11 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 2fpr h ASP 100 CO 0.00 0.13 -0.88 -0.62 -1.72 0.00 0.00 179.24 176.15 2fpr n GLU 101 N -3.36 -3.37 -1.62 3.56 1.02 -0.93 -4.96 120.64 110.98 2fpr n GLU 101 Ca -0.00 0.42 -0.29 0.00 -0.02 0.00 0.00 57.16 57.26 2fpr n GLU 101 Cb 0.33 -4.56 0.12 0.00 -0.02 0.00 0.00 31.44 27.31 2fpr n GLU 101 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fpr h ASP 103 N -1.39 0.00 -0.00 0.00 3.32 -2.02 -3.38 116.42 112.95 2fpr h ASP 103 Ca -0.49 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2fpr h ASP 103 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 2fpr h ASP 103 CO 0.63 0.02 -0.64 0.00 -1.72 0.00 0.00 179.24 177.53 2fpr s ARG 105 N -2.29 4.24 0.35 0.00 3.52 -1.26 -4.62 118.95 118.88 2fpr s ARG 105 Ca 0.06 2.15 -0.28 0.00 -0.13 0.00 0.00 55.73 57.54 2fpr s ARG 105 Cb 0.11 -3.58 -0.12 0.00 -1.56 0.00 0.00 34.95 29.80 2fpr s ARG 105 CO 0.56 -0.65 1.25 1.63 -0.81 0.00 0.00 175.30 177.28 2fpr n LYS 106 N 5.46 2.01 -0.17 5.12 5.02 -1.26 -1.04 118.16 133.30 2fpr n LYS 106 Ca 0.14 0.71 0.04 0.00 -2.02 0.00 0.00 58.31 57.18 2fpr n LYS 106 Cb 0.42 -2.28 0.12 0.00 -0.02 0.00 0.00 35.03 33.27 2fpr n LYS 106 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2fpr n PRO 107 N 0.51 1.78 -1.54 1.97 -0.04 -1.26 -5.03 135.00 131.38 2fpr n PRO 107 Ca 0.05 -0.99 -0.34 0.00 -0.04 0.00 0.00 63.50 62.18 2fpr n PRO 107 Cb 0.36 -1.32 0.08 0.00 -0.04 0.00 0.00 33.50 32.58 2fpr n PRO 107 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2fpr s LYS 108 N -1.64 2.31 0.00 0.54 1.02 -0.21 -4.35 119.74 117.41 2fpr s LYS 108 Ca 0.18 1.74 0.18 0.00 0.02 0.00 0.00 55.97 58.09 2fpr s LYS 108 Cb 0.10 -1.86 0.30 0.00 -0.52 0.00 0.00 37.83 35.86 2fpr s LYS 108 CO 0.11 -1.70 1.22 1.33 -0.92 0.00 0.00 175.35 175.39 2fpr n VAL 109 N -2.53 0.44 -0.25 3.17 0.24 -1.26 -4.64 118.33 113.50 2fpr n VAL 109 Ca 0.13 -0.72 0.05 0.00 -2.04 0.00 0.00 64.34 61.76 2fpr n VAL 109 Cb 0.50 0.99 0.18 0.00 -1.47 0.00 0.00 33.84 34.05 2fpr n VAL 109 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2fpr h LYS 110 N 3.43 0.37 0.00 7.34 1.63 -1.87 -0.53 116.57 126.94 2fpr h LYS 110 Ca 0.00 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 2fpr h LYS 110 Cb 0.81 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.35 2fpr h LYS 110 CO 0.00 0.25 -0.09 -0.07 -3.45 0.00 0.00 179.45 176.09 2fpr h LEU 111 N 0.38 0.00 -3.24 5.20 3.38 -1.82 -2.41 115.31 116.80 2fpr h LEU 111 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2fpr h LEU 111 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2fpr h LEU 111 CO -0.43 0.09 0.00 1.33 0.09 0.00 0.00 178.44 179.51 2fpr n VAL 112 N -4.18 2.13 -0.36 1.22 0.24 -0.26 -4.73 118.33 112.39 2fpr n VAL 112 Ca -0.03 -1.61 0.11 0.00 -2.04 0.00 0.00 64.34 60.77 2fpr n VAL 112 Cb 0.17 -0.11 0.29 0.00 -1.47 0.00 0.00 33.84 32.72 2fpr n VAL 112 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2fpr h GLU 113 N 2.43 0.84 -0.45 7.34 4.11 -0.89 -1.17 114.58 126.79 2fpr h GLU 113 Ca 0.00 -0.05 0.01 0.00 0.07 0.00 0.00 59.36 59.39 2fpr h GLU 113 Cb 1.43 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 2fpr h GLU 113 CO 0.24 0.55 0.30 -0.09 0.07 0.00 0.00 179.01 180.08 2fpr h ARG 114 N 0.86 0.56 0.00 1.06 2.43 -1.85 -1.71 114.38 115.73 2fpr h ARG 114 Ca 0.55 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.68 2fpr h ARG 114 Cb 0.73 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2fpr h ARG 114 CO -0.33 0.37 0.00 0.66 -1.51 0.00 0.00 179.97 179.16 2fpr n TYR 115 N -4.47 0.54 -2.69 2.20 4.01 -0.45 -4.84 117.16 111.46 2fpr n TYR 115 Ca 0.04 0.18 -0.40 0.00 -0.16 0.00 0.00 57.90 57.56 2fpr n TYR 115 Cb 0.09 -0.79 0.01 0.00 -0.31 0.00 0.00 39.34 38.34 2fpr n TYR 115 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2fpr n LEU 116 N -1.96 7.02 0.00 7.72 4.77 -0.65 -4.09 117.00 129.81 2fpr n LEU 116 Ca 0.05 -5.42 0.00 0.00 -0.03 0.00 0.00 56.01 50.61 2fpr n LEU 116 Cb 0.31 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 2fpr n LEU 116 CO 0.24 2.07 0.00 0.00 -1.33 0.00 0.00 177.39 178.37 2fpr n ALA 120 N -0.02 0.00 -2.50 -1.18 0.00 -1.26 -5.12 120.51 110.43 2fpr n ALA 120 Ca 0.44 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.80 2fpr n ALA 120 Cb 0.28 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.65 2fpr n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fpr s MET 121 N 0.00 0.82 -0.78 0.00 0.23 -1.26 -4.48 119.30 113.83 2fpr s MET 121 Ca 0.00 -0.99 -0.24 0.00 -1.03 0.00 0.00 55.69 53.43 2fpr s MET 121 Cb 0.00 0.33 0.06 0.00 -1.53 0.00 0.00 34.83 33.69 2fpr s MET 121 CO 0.00 -0.25 1.18 0.34 -2.03 0.00 0.00 175.02 174.26 2fpr s ASP 122 N -2.87 6.27 0.39 -1.18 2.15 0.33 -4.75 116.67 117.02 2fpr s ASP 122 Ca 0.05 -0.98 0.13 0.00 0.43 0.00 0.00 52.55 52.18 2fpr s ASP 122 Cb 0.05 -2.49 0.79 0.00 -0.30 0.00 0.00 42.92 40.97 2fpr s ASP 122 CO -0.11 -1.56 1.87 0.03 -0.17 0.00 0.00 175.17 175.23 2fpr h ARG 123 N 9.69 0.00 0.00 4.34 3.08 -1.92 -1.89 114.38 127.69 2fpr h ARG 123 Ca -0.16 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 2fpr h ARG 123 Cb 1.05 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2fpr h ARG 123 CO 1.25 0.32 -0.25 0.00 -1.07 0.00 0.00 179.97 180.22 2fpr h ALA 124 N 1.68 1.07 -0.13 0.04 0.00 -1.90 -3.22 119.26 116.80 2fpr h ALA 124 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2fpr h ALA 124 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2fpr h ALA 124 CO 0.04 0.32 0.00 0.09 0.00 0.00 0.00 179.25 179.70 2fpr n ASN 125 N -3.50 2.65 -4.72 0.00 5.03 -0.89 -4.95 115.26 108.87 2fpr n ASN 125 Ca -0.00 -2.43 -0.29 0.00 0.87 0.00 0.00 54.58 52.73 2fpr n ASN 125 Cb 0.42 -0.25 -0.07 0.00 -1.02 0.00 0.00 39.78 38.85 2fpr n ASN 125 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2fpr s SER 126 N -1.59 5.15 -0.01 6.41 0.01 -0.76 -4.42 113.70 118.48 2fpr s SER 126 Ca 0.21 -0.19 -0.08 0.00 1.31 0.00 0.00 55.95 57.19 2fpr s SER 126 Cb 0.15 -1.25 0.01 0.00 0.21 0.00 0.00 66.02 65.14 2fpr s SER 126 CO 0.06 0.13 0.16 -0.31 0.41 0.00 0.00 173.24 173.69 2fpr s TYR 127 N -1.51 -0.02 -0.08 2.43 2.02 -0.55 -3.29 117.35 116.35 2fpr s TYR 127 Ca 0.28 -0.00 -0.14 0.00 -0.37 0.00 0.00 57.07 56.84 2fpr s TYR 127 Cb -0.11 -0.02 -0.05 0.00 -0.40 0.00 0.00 41.96 41.39 2fpr s TYR 127 CO 0.20 -0.27 0.35 0.08 -1.57 0.00 0.00 175.55 174.34 2fpr s VAL 128 N -1.16 5.20 -0.18 0.71 1.01 -0.24 -0.34 120.40 125.39 2fpr s VAL 128 Ca -0.12 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.55 2fpr s VAL 128 Cb -0.06 -3.66 0.03 0.00 0.00 0.00 0.00 36.38 32.68 2fpr s VAL 128 CO 0.02 0.49 -0.17 -0.63 0.00 0.00 0.00 175.10 174.80 2fpr s ILE 129 N -0.33 1.95 0.17 2.22 1.01 0.34 -0.58 121.20 125.99 2fpr s ILE 129 Ca 0.21 -0.96 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 2fpr s ILE 129 Cb -0.15 -1.82 0.06 0.00 0.01 0.00 0.00 42.46 40.56 2fpr s ILE 129 CO 0.09 0.44 0.77 -0.83 0.00 0.00 0.00 174.94 175.40 2fpr s GLY 130 N 1.31 -0.33 0.00 6.18 0.00 -0.90 -1.05 107.32 112.53 2fpr s GLY 130 Ca 0.03 0.22 0.24 0.00 0.00 0.00 0.00 44.72 45.22 2fpr s GLY 130 CO -0.11 0.07 1.34 2.09 0.00 0.00 0.00 173.10 176.48 2fpr n ASP 131 N -0.41 0.69 -4.65 1.64 5.75 -1.26 -0.86 116.55 117.45 2fpr n ASP 131 Ca -0.09 -0.49 -0.23 0.00 -0.01 0.00 0.00 54.79 53.97 2fpr n ASP 131 Cb 0.62 0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 41.01 2fpr n ASP 131 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2fpr s ARG 132 N -2.93 2.29 0.40 0.11 0.52 -1.26 -4.78 118.95 113.30 2fpr s ARG 132 Ca 0.12 -1.45 0.15 0.00 -0.52 0.00 0.00 55.73 54.03 2fpr s ARG 132 Cb 0.17 -2.15 1.00 0.00 0.52 0.00 0.00 34.95 34.50 2fpr s ARG 132 CO 0.70 0.32 1.87 0.00 0.02 0.00 0.00 175.30 178.22 2fpr h ALA 133 N 1.85 2.08 -0.73 2.13 0.00 -2.00 -1.17 119.26 121.42 2fpr h ALA 133 Ca -0.44 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.55 2fpr h ALA 133 Cb 1.25 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2fpr h ALA 133 CO 0.61 -0.34 0.48 1.79 0.00 0.00 0.00 179.25 181.78 2fpr h THR 134 N 0.49 1.01 -0.31 0.00 1.35 -1.96 0.21 112.91 113.70 2fpr h THR 134 Ca 0.45 -0.25 -0.15 0.00 -0.55 0.00 0.00 66.41 65.90 2fpr h THR 134 Cb 0.99 0.20 -0.00 0.00 -1.73 0.00 0.00 68.15 67.61 2fpr h THR 134 CO -0.18 0.14 -0.39 0.44 -0.25 0.00 0.00 175.52 175.28 2fpr h ASP 135 N 0.74 0.89 -0.57 5.36 3.32 -1.56 -0.75 116.42 123.83 2fpr h ASP 135 Ca 0.32 -0.49 -0.09 0.00 0.02 0.00 0.00 57.03 56.78 2fpr h ASP 135 Cb 0.28 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2fpr h ASP 135 CO -0.11 1.20 0.00 0.40 -1.72 0.00 0.00 179.24 179.02 2fpr h ILE 136 N 0.59 1.26 -0.43 0.35 1.08 -1.23 -2.17 117.51 116.97 2fpr h ILE 136 Ca 0.04 -1.13 -0.12 0.00 -0.39 0.00 0.00 64.86 63.26 2fpr h ILE 136 Cb 0.98 0.80 -0.01 0.00 -3.07 0.00 0.00 36.82 35.51 2fpr h ILE 136 CO 0.09 0.41 -0.20 -0.61 -0.69 0.00 0.00 178.15 177.15 2fpr h GLN 137 N 0.94 0.85 -0.49 2.37 5.75 -0.91 -2.20 115.11 121.43 2fpr h GLN 137 Ca 0.17 -0.34 0.07 0.00 -0.15 0.00 0.00 58.65 58.40 2fpr h GLN 137 Cb 0.54 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.99 2fpr h GLN 137 CO 0.03 0.98 0.16 1.25 -2.65 0.00 0.00 178.83 178.59 2fpr h LEU 138 N 0.75 0.14 -0.22 -2.39 5.85 -0.85 -0.23 115.31 118.36 2fpr h LEU 138 Ca 0.11 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.93 2fpr h LEU 138 Cb 0.73 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 2fpr h LEU 138 CO 0.06 0.11 0.01 0.00 -0.34 0.00 0.00 178.44 178.28 2fpr h ALA 139 N 1.34 0.20 -0.46 1.25 0.00 -1.05 0.27 119.26 120.80 2fpr h ALA 139 Ca 0.24 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2fpr h ALA 139 Cb 0.27 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2fpr h ALA 139 CO -0.26 -0.42 0.24 1.49 0.00 0.00 0.00 179.25 180.31 2fpr h GLU 140 N 0.08 0.47 0.00 0.00 4.81 -1.08 -0.71 114.58 118.16 2fpr h GLU 140 Ca 0.10 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2fpr h GLU 140 Cb 0.12 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2fpr h GLU 140 CO -0.17 0.31 -0.10 -0.91 -0.73 0.00 0.00 179.01 177.41 2fpr h ASN 141 N 0.49 0.00 0.44 1.04 2.35 -0.47 -2.04 115.58 117.38 2fpr h ASN 141 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2fpr h ASN 141 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2fpr h ASN 141 CO -0.13 0.10 -0.41 0.23 -1.65 0.00 0.00 177.43 175.58 2fpr n MET 142 N -3.95 0.25 -2.29 0.81 2.81 0.03 -4.96 117.12 109.82 2fpr n MET 142 Ca -0.02 -0.14 -0.11 0.00 -1.81 0.00 0.00 57.70 55.62 2fpr n MET 142 Cb 0.19 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.21 2fpr n MET 142 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2fpr n GLY 143 N 1.45 -0.04 3.41 3.03 0.00 -0.39 -5.03 105.19 107.63 2fpr n GLY 143 Ca 0.08 -0.42 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 2fpr n GLY 143 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2fpr s ILE 144 N -2.59 0.78 0.51 -0.61 -4.36 -0.53 -4.87 121.20 109.53 2fpr s ILE 144 Ca 0.03 -2.00 -0.20 0.00 -0.26 0.00 0.00 60.65 58.22 2fpr s ILE 144 Cb -0.01 -2.63 -0.08 0.00 1.25 0.00 0.00 42.46 40.99 2fpr s ILE 144 CO 0.04 0.00 1.06 0.20 0.24 0.00 0.00 174.94 176.48 2fpr s ASN 145 N -3.44 6.17 -0.04 4.36 0.01 -1.21 -3.98 114.94 116.81 2fpr s ASN 145 Ca 0.34 1.98 0.07 0.00 -0.71 0.00 0.00 52.86 54.54 2fpr s ASN 145 Cb 0.07 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.15 2fpr s ASN 145 CO 0.15 -0.90 -0.24 -0.83 -1.51 0.00 0.00 177.10 173.77 2fpr s GLY 146 N -1.98 1.20 -0.18 0.66 0.00 -1.26 -1.08 107.32 104.68 2fpr s GLY 146 Ca 0.68 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 44.40 2fpr s GLY 146 CO 0.22 -0.73 -0.18 1.08 0.00 0.00 0.00 173.10 173.50 2fpr s LEU 147 N -0.34 2.26 -0.71 0.66 1.02 0.25 -4.95 118.68 116.87 2fpr s LEU 147 Ca 0.03 -0.59 -0.23 0.00 0.02 0.00 0.00 54.13 53.36 2fpr s LEU 147 Cb -0.11 -1.52 0.07 0.00 0.02 0.00 0.00 46.19 44.65 2fpr s LEU 147 CO 0.01 0.02 1.03 -0.60 0.02 0.00 0.00 176.35 176.83 2fpr s ARG 148 N 1.20 3.19 0.17 1.70 3.52 -1.26 -2.12 118.95 125.35 2fpr s ARG 148 Ca 0.02 -0.89 -0.33 0.00 -0.13 0.00 0.00 55.73 54.40 2fpr s ARG 148 Cb -0.14 -4.34 -0.13 0.00 -1.56 0.00 0.00 34.95 28.79 2fpr s ARG 148 CO -0.09 -1.86 1.65 0.98 -0.81 0.00 0.00 175.30 175.17 2fpr n TYR 149 N 7.78 2.46 -3.76 5.12 9.36 -0.04 -4.68 117.16 133.41 2fpr n TYR 149 Ca 0.01 0.17 -0.13 0.00 3.32 0.00 0.00 57.90 61.26 2fpr n TYR 149 Cb 0.46 -2.60 -0.14 0.00 -0.63 0.00 0.00 39.34 36.43 2fpr n TYR 149 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2fpr s ASP 150 N 1.14 -0.10 0.60 2.98 2.15 -0.57 -4.34 116.67 118.52 2fpr s ASP 150 Ca 0.78 0.28 0.29 0.00 0.43 0.00 0.00 52.55 54.33 2fpr s ASP 150 Cb -0.61 0.18 1.56 0.00 -0.30 0.00 0.00 42.92 43.76 2fpr s ASP 150 CO 0.36 -0.13 1.97 -0.09 -0.17 0.00 0.00 175.17 177.10 2fpr h ARG 151 N 7.08 0.00 0.00 4.34 2.43 -1.93 -1.72 114.38 124.58 2fpr h ARG 151 Ca -0.41 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.48 2fpr h ARG 151 Cb 1.15 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.65 2fpr h ARG 151 CO 0.43 0.00 -1.95 -1.91 -1.51 0.00 0.00 179.97 175.03 2fpr n GLU 152 N -3.61 0.37 0.04 0.20 2.13 -1.26 -4.55 120.64 113.95 2fpr n GLU 152 Ca 0.05 0.15 0.11 0.00 0.66 0.00 0.00 57.16 58.12 2fpr n GLU 152 Cb 0.51 -1.15 -0.00 0.00 0.27 0.00 0.00 31.44 31.07 2fpr n GLU 152 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2fpr n THR 153 N -3.60 0.22 -2.81 6.31 -2.24 -1.19 -4.56 114.28 106.43 2fpr n THR 153 Ca -0.33 -0.32 -0.08 0.00 -2.27 0.00 0.00 64.05 61.05 2fpr n THR 153 Cb 0.75 0.10 0.02 0.00 -2.10 0.00 0.00 70.33 69.10 2fpr n THR 153 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2fpr n LEU 154 N -2.11 -2.90 0.00 3.22 7.94 -0.69 -4.93 117.00 117.52 2fpr n LEU 154 Ca 0.01 -3.25 -0.21 0.00 -1.11 0.00 0.00 56.01 51.46 2fpr n LEU 154 Cb 0.47 0.78 0.10 0.00 0.53 0.00 0.00 43.42 45.30 2fpr n LEU 154 CO 0.41 1.97 0.48 -0.46 -1.11 0.00 0.00 177.39 178.68 2fpr n ASN 155 N 2.31 1.41 0.00 1.96 0.23 -0.92 -1.51 115.26 118.74 2fpr n ASN 155 Ca 0.15 -2.14 -0.11 0.00 -0.53 0.00 0.00 54.58 51.95 2fpr n ASN 155 Cb 0.58 -0.56 -0.05 0.00 -2.08 0.00 0.00 39.78 37.67 2fpr n ASN 155 CO 0.00 0.00 0.00 -0.50 -0.93 0.00 0.00 177.26 175.83 2fpr h TRP 156 N -0.44 0.10 -0.78 -2.53 4.06 -1.87 -0.56 115.95 113.93 2fpr h TRP 156 Ca -0.29 0.00 0.10 0.00 2.06 0.00 0.00 58.89 60.76 2fpr h TRP 156 Cb 1.14 -0.03 -0.07 0.00 -1.00 0.00 0.00 29.16 29.19 2fpr h TRP 156 CO 0.00 0.06 0.41 -1.35 -3.56 0.00 0.00 178.44 174.01 2fpr h PRO 157 N 0.11 0.66 -0.56 0.49 0.11 -1.85 0.11 132.00 131.07 2fpr h PRO 157 Ca 0.03 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2fpr h PRO 157 Cb -0.01 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 30.92 2fpr h PRO 157 CO -0.01 0.44 0.29 0.52 -0.21 0.00 0.00 178.00 179.02 2fpr h MET 158 N 0.68 0.79 -0.39 1.05 2.86 -1.82 -1.70 114.93 116.40 2fpr h MET 158 Ca 0.38 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.90 2fpr h MET 158 Cb 0.40 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 2fpr h MET 158 CO -0.27 0.63 0.17 0.82 1.06 0.00 0.00 176.91 179.32 2fpr h ILE 159 N 0.75 1.18 -0.88 -1.22 2.04 -0.65 0.12 117.51 118.85 2fpr h ILE 159 Ca 0.19 -0.53 0.08 0.00 1.00 0.00 0.00 64.86 65.61 2fpr h ILE 159 Cb 0.08 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 36.90 2fpr h ILE 159 CO -0.03 0.20 0.53 1.23 0.00 0.00 0.00 178.15 180.08 2fpr h GLY 160 N 0.49 1.36 0.59 5.37 0.00 -0.56 -0.70 103.07 109.62 2fpr h GLY 160 Ca 0.13 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 2fpr h GLY 160 CO -0.01 0.20 -0.12 -2.09 0.00 0.00 0.00 176.54 174.52 2fpr h GLU 161 N 0.92 0.19 -0.59 4.80 4.81 -1.07 -3.19 114.58 120.45 2fpr h GLU 161 Ca 0.41 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2fpr h GLU 161 Cb 0.30 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2fpr h GLU 161 CO -0.22 0.70 0.38 0.37 -0.73 0.00 0.00 179.01 179.51 2fpr h GLN 162 N -0.29 0.79 -0.00 1.92 4.15 -0.37 -2.20 115.11 119.09 2fpr h GLN 162 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2fpr h GLN 162 Cb 0.69 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.21 2fpr h GLN 162 CO 0.03 0.54 -0.06 1.28 -1.93 0.00 0.00 178.83 178.68 2fpr n LEU 163 N -4.66 0.46 -0.38 -2.39 4.77 -0.30 -3.08 117.00 111.42 2fpr n LEU 163 Ca 0.04 -0.03 0.04 0.00 -0.03 0.00 0.00 56.01 56.03 2fpr n LEU 163 Cb 0.03 -0.13 0.06 0.00 -2.33 0.00 0.00 43.42 41.06 2fpr n LEU 163 CO 0.36 0.08 0.46 0.35 -1.33 0.00 0.00 177.39 177.31 2fpr n THR 164 N -0.85 0.39 -1.83 -5.08 -2.24 -1.03 -5.02 114.28 98.61 2fpr n THR 164 Ca 0.17 -0.69 -0.42 0.00 -2.27 0.00 0.00 64.05 60.84 2fpr n THR 164 Cb 0.25 0.91 -0.02 0.00 -2.10 0.00 0.00 70.33 69.37 2fpr n THR 164 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2fpr s ARG 165 N -0.80 4.16 0.00 -0.78 3.52 -0.86 -5.06 118.95 119.12 2fpr s ARG 165 Ca 0.12 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.24 2fpr s ARG 165 Cb 0.08 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.41 2fpr s ARG 165 CO 0.11 -0.60 0.42 0.54 -0.81 0.00 0.00 175.30 174.96