#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dft s PRO 3 N 0.00 4.31 0.16 0.00 0.02 -0.45 -3.83 135.00 135.22 2dft s PRO 3 Ca 0.00 2.06 -0.22 0.00 0.02 0.00 0.00 61.00 62.87 2dft s PRO 3 Cb 0.00 -3.30 0.05 0.00 0.02 0.00 0.00 34.50 31.27 2dft s PRO 3 CO 0.00 -0.46 1.31 1.63 -0.33 0.00 0.00 177.00 179.15 2dft n LYS 4 N 4.18 -0.30 -3.87 5.54 4.76 -0.10 -4.66 118.16 123.71 2dft n LYS 4 Ca 0.12 1.29 -0.11 0.00 -2.87 0.00 0.00 58.31 56.73 2dft n LYS 4 Cb 0.42 -1.90 -0.10 0.00 -1.84 0.00 0.00 35.03 31.61 2dft n LYS 4 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dft s ALA 5 N -5.58 -0.30 -0.33 7.82 0.00 -1.24 -4.71 121.76 117.42 2dft s ALA 5 Ca -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 51.96 51.77 2dft s ALA 5 Cb 0.13 0.05 0.07 0.00 0.00 0.00 0.00 23.12 23.37 2dft s ALA 5 CO 0.56 -0.18 0.06 0.08 0.00 0.00 0.00 175.76 176.28 2dft s VAL 6 N -1.13 2.99 0.12 0.00 1.01 -0.82 -0.03 120.40 122.54 2dft s VAL 6 Ca -0.12 -1.68 -0.27 0.00 0.00 0.00 0.00 61.98 59.91 2dft s VAL 6 Cb -0.07 -2.86 -0.07 0.00 0.00 0.00 0.00 36.38 33.38 2dft s VAL 6 CO 0.01 -0.32 0.85 -0.76 0.00 0.00 0.00 175.10 174.88 2dft s LEU 7 N 1.18 4.53 0.21 3.92 1.43 0.95 -0.51 118.68 130.39 2dft s LEU 7 Ca 0.00 1.67 0.03 0.00 -1.03 0.00 0.00 54.13 54.79 2dft s LEU 7 Cb -0.21 -3.40 -0.05 0.00 0.03 0.00 0.00 46.19 42.56 2dft s LEU 7 CO -0.03 0.06 0.01 0.68 0.23 0.00 0.00 176.35 177.30 2dft s VAL 8 N -0.48 0.84 0.00 -1.59 -7.23 -0.66 -1.30 120.40 109.98 2dft s VAL 8 Ca 0.41 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 2dft s VAL 8 Cb -0.23 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.44 2dft s VAL 8 CO 0.27 -0.36 0.00 0.61 -0.31 0.00 0.00 175.10 175.31 2dft n GLY 9 N -0.35 1.51 3.77 2.32 0.00 -1.26 0.43 105.19 111.61 2dft n GLY 9 Ca -0.05 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 2dft n GLY 9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dft s LEU 10 N 0.00 2.17 0.23 0.99 1.43 -1.25 -4.83 118.68 117.41 2dft s LEU 10 Ca 0.00 1.15 -0.31 0.00 -1.03 0.00 0.00 54.13 53.94 2dft s LEU 10 Cb 0.00 -3.56 -0.11 0.00 0.03 0.00 0.00 46.19 42.55 2dft s LEU 10 CO 0.00 -2.44 1.61 -2.16 0.23 0.00 0.00 176.35 173.59 2dft s PRO 11 N -5.17 4.16 0.00 1.29 0.04 -1.26 -0.64 135.00 133.42 2dft s PRO 11 Ca 0.63 2.50 0.00 0.00 0.04 0.00 0.00 61.00 64.17 2dft s PRO 11 Cb -0.15 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2dft s PRO 11 CO 0.54 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.35 2dft n GLY 12 N 3.18 1.64 0.19 0.56 0.00 -1.26 -4.70 105.19 104.80 2dft n GLY 12 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 2dft n GLY 12 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dft h SER 13 N 0.00 0.00 0.00 1.61 4.64 -1.22 -3.45 113.55 115.14 2dft h SER 13 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dft h SER 13 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2dft h SER 13 CO 0.00 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2dft n GLY 14 N 1.14 0.41 0.20 -0.77 0.00 -1.26 -4.84 105.19 100.07 2dft n GLY 14 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 2dft n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dft h LYS 15 N 0.00 0.21 0.14 1.61 1.57 -1.90 0.66 116.57 118.85 2dft h LYS 15 Ca 0.00 -0.01 -0.30 0.00 -1.87 0.00 0.00 60.65 58.46 2dft h LYS 15 Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2dft h LYS 15 CO 0.00 0.14 -1.46 0.77 -0.57 0.00 0.00 179.45 178.33 2dft h SER 16 N 0.21 0.47 0.00 0.86 0.02 -1.95 -2.41 113.55 110.75 2dft h SER 16 Ca 0.25 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2dft h SER 16 Cb 0.35 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2dft h SER 16 CO -0.35 1.47 0.00 0.41 -1.14 0.00 0.00 176.83 177.23 2dft n THR 17 N -3.51 0.00 -0.18 -2.27 -1.04 0.08 -2.13 114.28 105.23 2dft n THR 17 Ca -0.15 0.85 0.15 0.00 -2.04 0.00 0.00 64.05 62.87 2dft n THR 17 Cb 1.05 -1.69 0.28 0.00 -1.82 0.00 0.00 70.33 68.15 2dft n THR 17 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2dft n ILE 18 N -1.50 -0.23 0.09 12.58 2.08 -0.35 -0.50 119.36 131.54 2dft n ILE 18 Ca 0.00 1.12 -0.12 0.00 0.56 0.00 0.00 62.75 64.31 2dft n ILE 18 Cb 0.00 -1.78 -0.05 0.00 -0.75 0.00 0.00 39.64 37.06 2dft n ILE 18 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2dft h GLY 19 N 0.00 -0.33 0.98 7.39 0.00 -1.15 0.42 103.07 110.38 2dft h GLY 19 Ca 0.43 0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.98 2dft h GLY 19 CO -0.44 -0.18 0.28 3.21 0.00 0.00 0.00 176.54 179.41 2dft h ARG 20 N -0.36 0.67 0.00 4.80 3.08 -0.25 -2.55 114.38 119.77 2dft h ARG 20 Ca 0.03 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 2dft h ARG 20 Cb 0.39 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2dft h ARG 20 CO -0.12 0.50 -0.65 0.00 -1.07 0.00 0.00 179.97 178.63 2dft h ARG 21 N 0.65 0.00 0.00 0.04 2.47 -1.29 -1.58 114.38 114.67 2dft h ARG 21 Ca 0.17 0.00 -0.24 0.00 -1.26 0.00 0.00 59.98 58.65 2dft h ARG 21 Cb 0.02 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.35 2dft h ARG 21 CO -0.03 0.65 -0.94 1.25 0.56 0.00 0.00 179.97 181.46 2dft h LEU 22 N 0.00 0.82 -0.55 3.04 5.85 -0.16 0.15 115.31 124.46 2dft h LEU 22 Ca -0.01 -0.75 -0.05 0.00 0.84 0.00 0.00 57.88 57.91 2dft h LEU 22 Cb 1.33 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 2dft h LEU 22 CO 0.08 1.46 0.13 0.00 -0.34 0.00 0.00 178.44 179.77 2dft h ALA 23 N 0.37 0.72 -1.01 1.25 0.00 -1.34 -1.69 119.26 117.57 2dft h ALA 23 Ca -0.12 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.67 2dft h ALA 23 Cb 1.61 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 2dft h ALA 23 CO 0.18 0.43 0.64 0.87 0.00 0.00 0.00 179.25 181.37 2dft h LYS 24 N 0.78 1.04 0.00 0.00 1.57 -1.02 0.32 116.57 119.27 2dft h LYS 24 Ca 0.17 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2dft h LYS 24 Cb 0.35 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2dft h LYS 24 CO 0.00 0.69 -0.34 0.00 -0.57 0.00 0.00 179.45 179.24 2dft h ALA 25 N 1.50 1.43 -0.02 3.86 0.00 -0.42 -0.87 119.26 124.74 2dft h ALA 25 Ca 0.47 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2dft h ALA 25 Cb 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2dft h ALA 25 CO -0.23 0.42 -0.27 1.28 0.00 0.00 0.00 179.25 180.46 2dft n LEU 26 N -4.11 1.98 -2.97 0.00 4.77 -0.66 -4.92 117.00 111.09 2dft n LEU 26 Ca -0.02 -0.83 -0.19 0.00 -0.03 0.00 0.00 56.01 54.94 2dft n LEU 26 Cb 0.38 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.53 2dft n LEU 26 CO 0.38 0.36 0.19 0.61 -1.33 0.00 0.00 177.39 177.60 2dft n GLY 27 N 1.18 -0.26 3.44 -0.72 0.00 0.10 -4.98 105.19 103.95 2dft n GLY 27 Ca 0.08 0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2dft n GLY 27 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dft s VAL 28 N -3.25 0.47 0.63 1.61 -7.23 -0.53 -5.03 120.40 107.09 2dft s VAL 28 Ca 0.46 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.46 2dft s VAL 28 Cb -0.20 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.31 2dft s VAL 28 CO 0.57 0.00 1.18 -0.83 -0.31 0.00 0.00 175.10 175.71 2dft s GLY 29 N -3.52 2.52 -0.03 2.32 0.00 -1.26 -4.35 107.32 102.99 2dft s GLY 29 Ca 0.29 0.87 -0.11 0.00 0.00 0.00 0.00 44.72 45.77 2dft s GLY 29 CO 0.17 1.25 0.31 -2.27 0.00 0.00 0.00 173.10 172.57 2dft s LEU 30 N -4.45 4.43 -0.37 0.66 2.96 -1.26 -1.29 118.68 119.36 2dft s LEU 30 Ca 0.74 0.76 0.01 0.00 -0.22 0.00 0.00 54.13 55.42 2dft s LEU 30 Cb -0.27 -2.46 0.12 0.00 0.50 0.00 0.00 46.19 44.08 2dft s LEU 30 CO 0.37 0.34 0.16 -0.22 -1.32 0.00 0.00 176.35 175.68 2dft s LEU 31 N -1.17 2.34 -0.26 -0.68 0.20 -0.86 -4.98 118.68 113.27 2dft s LEU 31 Ca 0.22 -2.10 -0.29 0.00 0.69 0.00 0.00 54.13 52.65 2dft s LEU 31 Cb -0.15 -0.90 -0.00 0.00 -0.43 0.00 0.00 46.19 44.71 2dft s LEU 31 CO 0.11 -0.34 1.24 -0.62 -0.29 0.00 0.00 176.35 176.44 2dft s ASP 32 N 1.04 6.83 0.18 3.68 -1.08 -1.26 -2.70 116.67 123.35 2dft s ASP 32 Ca 0.14 1.34 -0.05 0.00 -0.52 0.00 0.00 52.55 53.47 2dft s ASP 32 Cb -0.21 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 38.78 2dft s ASP 32 CO -0.12 -0.92 1.48 0.71 0.52 0.00 0.00 175.17 176.84 2dft h THR 33 N 5.75 1.31 -0.93 1.71 1.35 -1.87 0.37 112.91 120.61 2dft h THR 33 Ca -0.25 -1.81 0.22 0.00 -0.55 0.00 0.00 66.41 64.02 2dft h THR 33 Cb 1.09 1.77 -0.12 0.00 -1.73 0.00 0.00 68.15 69.16 2dft h THR 33 CO 1.01 0.57 0.46 0.44 -0.25 0.00 0.00 175.52 177.75 2dft h ASP 34 N 0.46 0.46 0.31 5.36 3.32 -1.93 0.10 116.42 124.51 2dft h ASP 34 Ca 0.01 0.14 -0.24 0.00 0.02 0.00 0.00 57.03 56.96 2dft h ASP 34 Cb 1.12 0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.77 2dft h ASP 34 CO 0.11 0.06 -1.01 0.58 -1.72 0.00 0.00 179.24 177.26 2dft h VAL 35 N 0.48 1.39 -0.15 -1.35 2.07 -1.62 -3.04 116.25 114.03 2dft h VAL 35 Ca 0.58 -2.48 -0.11 0.00 0.82 0.00 0.00 66.70 65.51 2dft h VAL 35 Cb 1.07 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 33.31 2dft h VAL 35 CO -0.49 0.74 -0.39 0.00 0.02 0.00 0.00 177.57 177.45 2dft h ALA 36 N 0.65 1.05 -0.49 1.67 0.00 0.20 -2.33 119.26 120.01 2dft h ALA 36 Ca -0.10 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2dft h ALA 36 Cb 1.65 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 2dft h ALA 36 CO 0.18 0.60 0.25 0.82 0.00 0.00 0.00 179.25 181.10 2dft h ILE 37 N 0.28 1.18 -0.95 0.00 2.04 -1.05 0.34 117.51 119.36 2dft h ILE 37 Ca 0.03 -0.49 0.15 0.00 1.00 0.00 0.00 64.86 65.54 2dft h ILE 37 Cb 0.82 0.61 -0.08 0.00 -0.74 0.00 0.00 36.82 37.42 2dft h ILE 37 CO 0.07 0.20 0.60 -0.33 0.00 0.00 0.00 178.15 178.69 2dft h GLU 38 N 0.65 0.76 0.18 2.37 5.08 -1.31 -1.11 114.58 121.20 2dft h GLU 38 Ca 0.17 -0.05 -0.23 0.00 -1.00 0.00 0.00 59.36 58.25 2dft h GLU 38 Cb 0.09 -0.17 0.03 0.00 0.50 0.00 0.00 28.75 29.19 2dft h GLU 38 CO -0.02 0.50 -1.03 1.96 -1.00 0.00 0.00 179.01 179.42 2dft h GLN 39 N 0.78 0.38 -0.22 2.33 4.20 -1.29 -2.48 115.11 118.81 2dft h GLN 39 Ca 0.49 -0.64 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 2dft h GLN 39 Cb 0.71 0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 2dft h GLN 39 CO -0.26 1.31 0.13 -0.09 -0.67 0.00 0.00 178.83 179.26 2dft h ARG 40 N -0.21 0.30 0.00 1.46 9.65 0.41 -3.04 114.38 122.95 2dft h ARG 40 Ca -0.18 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.67 2dft h ARG 40 Cb 1.81 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 30.33 2dft h ARG 40 CO 0.19 0.24 -0.41 0.25 2.80 0.00 0.00 179.97 183.04 2dft n THR 41 N -4.91 0.29 -0.07 0.20 -2.24 -0.49 -4.92 114.28 102.14 2dft n THR 41 Ca -0.03 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2dft n THR 41 Cb 0.05 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2dft n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dft n GLY 42 N 1.38 1.95 3.70 3.38 0.00 -0.94 -4.98 105.19 109.69 2dft n GLY 42 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2dft n GLY 42 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dft s ARG 43 N -0.03 2.22 0.84 1.61 1.70 -1.18 -4.91 118.95 119.20 2dft s ARG 43 Ca 0.00 -1.73 -0.10 0.00 -0.47 0.00 0.00 55.73 53.43 2dft s ARG 43 Cb 0.00 -2.02 0.18 0.00 -0.57 0.00 0.00 34.95 32.55 2dft s ARG 43 CO 0.00 0.03 1.14 -1.13 -1.08 0.00 0.00 175.30 174.26 2dft n SER 44 N -1.12 0.54 -0.03 -2.89 3.41 -1.26 -4.22 113.62 108.05 2dft n SER 44 Ca -0.03 -1.69 -0.00 0.00 -0.26 0.00 0.00 58.87 56.89 2dft n SER 44 Cb 0.63 -0.83 -0.00 0.00 -0.26 0.00 0.00 64.21 63.75 2dft n SER 44 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2dft h ILE 45 N -1.31 0.00 -0.00 -1.33 1.08 -1.96 -0.69 117.51 113.30 2dft h ILE 45 Ca -0.37 -0.52 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 2dft h ILE 45 Cb 1.14 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 2dft h ILE 45 CO 0.31 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.77 2dft n ALA 46 N -2.46 0.00 -0.03 1.87 0.00 -1.26 -1.98 120.51 116.65 2dft n ALA 46 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 2dft n ALA 46 Cb 0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.32 2dft n ALA 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2dft n ASP 47 N -3.39 1.88 0.14 0.00 -0.08 -1.05 -2.51 116.55 111.55 2dft n ASP 47 Ca 0.00 0.14 -0.13 0.00 -1.51 0.00 0.00 54.79 53.28 2dft n ASP 47 Cb 0.00 -0.59 -0.06 0.00 2.34 0.00 0.00 41.12 42.81 2dft n ASP 47 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2dft h ILE 48 N 0.04 0.45 -0.99 5.18 2.04 -0.47 -2.96 117.51 120.80 2dft h ILE 48 Ca -0.45 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.50 2dft h ILE 48 Cb 2.01 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 38.46 2dft h ILE 48 CO 0.04 0.00 0.63 -0.26 0.00 0.00 0.00 178.15 178.56 2dft h PHE 49 N -0.50 1.16 -0.62 1.37 0.04 -1.49 -1.25 116.94 115.66 2dft h PHE 49 Ca 0.01 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 2dft h PHE 49 Cb 0.49 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 2dft h PHE 49 CO -0.20 0.54 0.32 0.00 -0.60 0.00 0.00 178.31 178.36 2dft h ALA 50 N 1.49 0.80 0.06 2.45 0.00 -1.48 -2.45 119.26 120.13 2dft h ALA 50 Ca 0.46 -0.12 -0.38 0.00 0.00 0.00 0.00 54.91 54.87 2dft h ALA 50 Cb 0.31 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2dft h ALA 50 CO -0.22 0.34 -2.24 2.41 0.00 0.00 0.00 179.25 179.55 2dft n THR 51 N -4.53 1.63 0.14 0.00 -1.04 -1.10 -4.63 114.28 104.76 2dft n THR 51 Ca 0.04 -0.60 0.07 0.00 -2.04 0.00 0.00 64.05 61.52 2dft n THR 51 Cb 0.11 -1.58 -0.10 0.00 -1.82 0.00 0.00 70.33 66.93 2dft n THR 51 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2dft n ASP 52 N -3.39 1.49 0.00 8.00 10.43 -0.49 -5.11 116.55 127.48 2dft n ASP 52 Ca -0.39 -0.18 0.00 0.00 2.57 0.00 0.00 54.79 56.79 2dft n ASP 52 Cb 1.01 1.51 0.00 0.00 1.84 0.00 0.00 41.12 45.49 2dft n ASP 52 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2dft n GLY 53 N 1.61 -0.94 0.41 0.44 0.00 -0.92 -4.65 105.19 101.13 2dft n GLY 53 Ca -0.01 -1.60 -0.14 0.00 0.00 0.00 0.00 46.02 44.26 2dft n GLY 53 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dft h GLU 54 N 0.00 -0.64 -1.95 1.61 4.81 -1.90 -2.06 114.58 114.46 2dft h GLU 54 Ca 0.00 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2dft h GLU 54 Cb 0.00 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2dft h GLU 54 CO 0.00 -0.42 0.00 0.00 -0.73 0.00 0.00 179.01 177.86 2dft n GLN 55 N -5.46 0.00 0.00 1.92 0.00 -1.26 -0.39 117.38 112.18 2dft n GLN 55 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.93 2dft n GLN 55 Cb 0.38 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.13 2dft n GLN 55 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2dft n GLU 56 N 0.99 0.00 0.26 2.61 0.00 -1.09 -4.73 120.64 118.68 2dft n GLU 56 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.29 2dft n GLU 56 Cb 0.00 0.00 0.68 0.00 0.00 0.00 0.00 31.44 32.12 2dft n GLU 56 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2dft h PHE 57 N 0.00 0.00 -0.76 4.31 3.57 0.00 -2.76 116.94 121.31 2dft h PHE 57 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2dft h PHE 57 Cb 0.00 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 2dft h PHE 57 CO 0.00 0.13 0.42 0.00 -2.23 0.00 0.00 178.31 176.62 2dft h ARG 58 N 0.00 1.05 0.16 1.11 2.47 -1.37 0.41 114.38 118.20 2dft h ARG 58 Ca -0.00 -0.11 -0.25 0.00 -1.26 0.00 0.00 59.98 58.36 2dft h ARG 58 Cb 0.45 -0.21 0.03 0.00 -1.65 0.00 0.00 29.97 28.59 2dft h ARG 58 CO 0.02 0.76 -1.08 -0.09 0.56 0.00 0.00 179.97 180.14 2dft h ARG 59 N 1.05 0.45 -0.04 0.04 2.43 -1.83 0.42 114.38 116.91 2dft h ARG 59 Ca 0.27 -0.70 0.02 0.00 -0.81 0.00 0.00 59.98 58.76 2dft h ARG 59 Cb 0.02 0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 2dft h ARG 59 CO -0.04 1.32 -0.08 0.82 -1.51 0.00 0.00 179.97 180.47 2dft h ILE 60 N -0.06 0.78 -0.52 1.20 2.04 -1.47 -2.94 117.51 116.54 2dft h ILE 60 Ca -0.18 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2dft h ILE 60 Cb 1.82 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.66 2dft h ILE 60 CO 0.20 0.00 0.22 -0.08 0.00 0.00 0.00 178.15 178.49 2dft h GLU 61 N -0.12 0.78 -0.38 2.37 4.81 0.74 -2.53 114.58 120.24 2dft h GLU 61 Ca 0.05 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.07 2dft h GLU 61 Cb 0.18 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2dft h GLU 61 CO -0.11 0.67 -0.05 1.49 -0.73 0.00 0.00 179.01 180.28 2dft h GLU 62 N 0.71 0.64 0.16 1.92 4.81 -0.20 -0.66 114.58 121.96 2dft h GLU 62 Ca 0.18 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2dft h GLU 62 Cb 0.18 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2dft h GLU 62 CO -0.02 0.69 -0.14 0.22 -0.73 0.00 0.00 179.01 179.04 2dft h ASP 63 N 0.60 -0.36 -0.65 1.04 3.58 -1.32 -0.79 116.42 118.51 2dft h ASP 63 Ca 0.12 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 2dft h ASP 63 Cb 0.45 0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.59 2dft h ASP 63 CO 0.02 -0.22 0.35 0.58 -2.88 0.00 0.00 179.24 177.10 2dft h VAL 64 N -0.32 1.21 -0.10 2.25 2.07 -1.02 -2.87 116.25 117.47 2dft h VAL 64 Ca -0.00 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.02 2dft h VAL 64 Cb 0.29 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 2dft h VAL 64 CO -0.02 0.23 -0.12 0.58 0.02 0.00 0.00 177.57 178.26 2dft h VAL 65 N 0.89 0.67 -0.93 2.57 2.07 -0.72 -2.29 116.25 118.50 2dft h VAL 65 Ca 0.23 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.94 2dft h VAL 65 Cb 0.05 0.67 -0.11 0.00 -1.52 0.00 0.00 31.29 30.38 2dft h VAL 65 CO -0.04 0.00 0.50 0.03 0.02 0.00 0.00 177.57 178.09 2dft h ARG 66 N -0.15 0.58 -0.96 1.57 2.47 -1.19 0.33 114.38 117.02 2dft h ARG 66 Ca 0.08 -0.04 0.04 0.00 -1.26 0.00 0.00 59.98 58.81 2dft h ARG 66 Cb 0.26 -0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 28.40 2dft h ARG 66 CO -0.19 0.39 0.63 0.00 0.56 0.00 0.00 179.97 181.35 2dft h ALA 67 N 1.65 1.39 0.02 0.04 0.00 -1.22 -3.18 119.26 117.97 2dft h ALA 67 Ca 0.55 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 55.27 2dft h ALA 67 Cb 0.93 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2dft h ALA 67 CO -0.43 0.50 -0.78 0.00 0.00 0.00 0.00 179.25 178.54 2dft h ALA 68 N 1.45 0.14 -0.21 0.00 0.00 -0.42 0.23 119.26 120.44 2dft h ALA 68 Ca 0.39 -0.90 0.06 0.00 0.00 0.00 0.00 54.91 54.46 2dft h ALA 68 Cb 0.05 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2dft h ALA 68 CO -0.13 0.44 0.57 -0.07 0.00 0.00 0.00 179.25 180.07 2dft h LEU 69 N -0.87 0.00 0.00 0.00 3.38 -1.49 -0.46 115.31 115.87 2dft h LEU 69 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2dft h LEU 69 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2dft h LEU 69 CO -0.07 0.00 -0.19 0.00 0.09 0.00 0.00 178.44 178.27 2dft h ALA 70 N 1.05 0.00 -0.00 1.53 0.00 -1.40 -3.40 119.26 117.04 2dft h ALA 70 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2dft h ALA 70 Cb 1.25 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2dft h ALA 70 CO -0.00 0.19 -0.08 -0.25 0.00 0.00 0.00 179.25 179.11 2dft n ASP 71 N -3.34 0.43 -4.15 0.00 8.00 0.75 -4.27 116.55 113.96 2dft n ASP 71 Ca -0.03 -0.64 -0.22 0.00 0.71 0.00 0.00 54.79 54.62 2dft n ASP 71 Cb 0.10 -0.08 -0.14 0.00 -0.02 0.00 0.00 41.12 40.98 2dft n ASP 71 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2dft s HIS 72 N -2.39 1.35 0.00 1.24 2.46 -0.32 -4.98 115.29 112.65 2dft s HIS 72 Ca 0.32 -0.33 0.00 0.00 0.47 0.00 0.00 55.06 55.52 2dft s HIS 72 Cb 0.20 -0.82 0.00 0.00 -0.13 0.00 0.00 32.58 31.83 2dft s HIS 72 CO 0.45 0.03 0.50 -0.25 -2.47 0.00 0.00 174.74 173.00 2dft n ASP 73 N 2.12 0.23 -1.10 9.88 8.00 -1.25 -1.34 116.55 133.10 2dft n ASP 73 Ca -0.17 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.23 2dft n ASP 73 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 2dft n ASP 73 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dft n GLY 74 N -0.05 1.40 3.69 0.44 0.00 -1.26 -3.43 105.19 105.97 2dft n GLY 74 Ca 0.00 -1.78 -0.38 0.00 0.00 0.00 0.00 46.02 43.86 2dft n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dft s VAL 75 N 1.75 5.23 -0.20 1.61 1.01 -0.41 -0.92 120.40 128.47 2dft s VAL 75 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 61.98 62.63 2dft s VAL 75 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2dft s VAL 75 CO 0.00 0.30 -0.03 -0.22 0.00 0.00 0.00 175.10 175.14 2dft s LEU 76 N 1.02 3.05 -0.39 3.92 2.96 0.95 -2.03 118.68 128.16 2dft s LEU 76 Ca 0.19 -0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 53.69 2dft s LEU 76 Cb -0.14 -1.76 0.02 0.00 0.50 0.00 0.00 46.19 44.81 2dft s LEU 76 CO 0.07 0.05 0.24 -0.44 -1.32 0.00 0.00 176.35 174.96 2dft s SER 77 N 1.07 5.89 -0.10 3.68 0.01 -1.10 -0.04 113.70 123.12 2dft s SER 77 Ca 0.01 -0.92 -0.18 0.00 1.31 0.00 0.00 55.95 56.17 2dft s SER 77 Cb -0.15 -2.08 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2dft s SER 77 CO 0.00 -0.40 0.49 -0.22 0.41 0.00 0.00 173.24 173.52 2dft s LEU 78 N 1.61 4.30 0.09 2.44 2.96 -0.42 -2.61 118.68 127.05 2dft s LEU 78 Ca 0.03 0.86 -0.29 0.00 -0.22 0.00 0.00 54.13 54.51 2dft s LEU 78 Cb -0.19 -2.71 -0.16 0.00 0.50 0.00 0.00 46.19 43.63 2dft s LEU 78 CO 0.08 0.02 0.67 0.61 -1.32 0.00 0.00 176.35 176.41 2dft n GLY 79 N 3.13 -0.87 0.10 7.98 0.00 -1.26 -4.76 105.19 109.51 2dft n GLY 79 Ca -0.07 0.46 0.11 0.00 0.00 0.00 0.00 46.02 46.51 2dft n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dft n GLY 80 N 1.48 -1.18 1.34 -0.02 0.00 -1.26 -1.82 105.19 103.73 2dft n GLY 80 Ca 0.16 0.06 0.03 0.00 0.00 0.00 0.00 46.02 46.27 2dft n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dft n GLY 81 N -0.08 2.47 0.13 -0.02 0.00 -1.26 -4.60 105.19 101.83 2dft n GLY 81 Ca 0.02 -1.06 -0.20 0.00 0.00 0.00 0.00 46.02 44.78 2dft n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dft h ALA 82 N 1.15 -0.03 0.00 4.61 0.00 -1.71 -3.12 119.26 120.16 2dft h ALA 82 Ca -0.14 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.11 2dft h ALA 82 Cb 1.58 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2dft h ALA 82 CO 0.10 0.41 0.31 1.33 0.00 0.00 0.00 179.25 181.40 2dft n VAL 83 N -4.11 0.65 0.54 0.00 0.24 -1.26 -0.88 118.33 113.51 2dft n VAL 83 Ca -0.13 0.71 0.10 0.00 -2.04 0.00 0.00 64.34 62.98 2dft n VAL 83 Cb 0.80 -1.71 0.41 0.00 -1.47 0.00 0.00 33.84 31.87 2dft n VAL 83 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2dft n THR 84 N -1.93 0.79 -3.39 3.34 -2.24 -1.18 -4.61 114.28 105.07 2dft n THR 84 Ca -0.01 0.17 -0.44 0.00 -2.27 0.00 0.00 64.05 61.50 2dft n THR 84 Cb 0.33 -0.95 -0.07 0.00 -2.10 0.00 0.00 70.33 67.54 2dft n THR 84 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2dft s SER 85 N -3.50 6.08 0.05 3.42 0.01 -0.06 -4.96 113.70 114.74 2dft s SER 85 Ca 0.07 -1.61 -0.09 0.00 1.31 0.00 0.00 55.95 55.63 2dft s SER 85 Cb 0.11 -2.16 -0.02 0.00 0.21 0.00 0.00 66.02 64.16 2dft s SER 85 CO 0.36 -0.74 0.69 -2.65 0.41 0.00 0.00 173.24 171.31 2dft n PRO 86 N 5.17 -0.13 -0.10 12.44 -0.01 -1.26 0.14 135.00 151.25 2dft n PRO 86 Ca -0.13 0.68 0.07 0.00 -0.01 0.00 0.00 63.50 64.12 2dft n PRO 86 Cb 0.42 -1.01 0.13 0.00 -0.01 0.00 0.00 33.50 33.03 2dft n PRO 86 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2dft n GLY 87 N -1.07 -0.34 0.11 -1.23 0.00 -1.26 -0.29 105.19 101.10 2dft n GLY 87 Ca 0.01 0.28 -0.12 0.00 0.00 0.00 0.00 46.02 46.18 2dft n GLY 87 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2dft h VAL 88 N 0.00 1.08 -0.90 1.61 2.07 0.94 -2.76 116.25 118.29 2dft h VAL 88 Ca 0.22 -1.00 0.20 0.00 0.82 0.00 0.00 66.70 66.93 2dft h VAL 88 Cb 0.52 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 2dft h VAL 88 CO -0.27 0.23 0.59 0.03 0.02 0.00 0.00 177.57 178.18 2dft h ARG 89 N -0.65 0.43 0.01 1.57 3.08 0.00 0.50 114.38 119.33 2dft h ARG 89 Ca -0.02 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2dft h ARG 89 Cb 0.50 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2dft h ARG 89 CO 0.03 0.29 -0.07 0.00 -1.07 0.00 0.00 179.97 179.15 2dft h ALA 90 N 1.61 -0.00 0.00 0.04 0.00 -1.29 -1.19 119.26 118.43 2dft h ALA 90 Ca 0.47 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dft h ALA 90 Cb 1.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2dft h ALA 90 CO -0.19 0.00 0.02 0.00 0.00 0.00 0.00 179.25 179.08 2dft n ALA 91 N -2.58 1.04 1.14 0.00 0.00 -0.99 -1.99 120.51 117.13 2dft n ALA 91 Ca -0.10 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.47 2dft n ALA 91 Cb 0.48 -0.95 0.36 0.00 0.00 0.00 0.00 19.45 19.34 2dft n ALA 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dft n LEU 92 N -1.39 0.67 -4.43 0.00 4.77 0.17 -4.91 117.00 111.88 2dft n LEU 92 Ca 0.00 -0.07 -0.54 0.00 -0.03 0.00 0.00 56.01 55.37 2dft n LEU 92 Cb 0.02 -0.21 -0.08 0.00 -2.33 0.00 0.00 43.42 40.82 2dft n LEU 92 CO 0.00 0.14 1.72 0.00 -1.33 0.00 0.00 177.39 177.92 2dft n ALA 93 N -1.11 0.69 0.00 -1.18 0.00 -0.84 -2.51 120.51 115.56 2dft n ALA 93 Ca 0.09 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2dft n ALA 93 Cb 0.33 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2dft n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dft n GLY 94 N 6.45 2.46 3.79 0.00 0.00 -1.26 -5.04 105.19 111.59 2dft n GLY 94 Ca 0.43 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.09 2dft n GLY 94 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dft s HIS 95 N -2.53 3.44 -0.57 1.61 4.02 -1.04 -4.93 115.29 115.28 2dft s HIS 95 Ca 0.00 1.69 -0.27 0.00 1.02 0.00 0.00 55.06 57.50 2dft s HIS 95 Cb 0.00 -2.99 0.03 0.00 -1.02 0.00 0.00 32.58 28.61 2dft s HIS 95 CO 0.00 -0.19 1.13 0.95 1.02 0.00 0.00 174.74 177.65 2dft s THR 96 N -1.76 4.11 -0.27 1.30 -4.23 -1.26 -4.74 115.64 108.79 2dft s THR 96 Ca 0.56 0.74 -0.03 0.00 -1.18 0.00 0.00 61.69 61.78 2dft s THR 96 Cb -0.18 -4.68 0.03 0.00 1.34 0.00 0.00 72.50 69.01 2dft s THR 96 CO 0.23 -1.28 -0.02 -0.69 -0.54 0.00 0.00 174.62 172.32 2dft s VAL 97 N 4.69 3.11 -0.40 2.29 1.01 -1.26 -1.95 120.40 127.90 2dft s VAL 97 Ca 0.40 -1.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.14 2dft s VAL 97 Cb -0.09 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.65 2dft s VAL 97 CO 0.24 0.08 0.36 -0.69 0.00 0.00 0.00 175.10 175.09 2dft s VAL 98 N 1.34 5.17 -0.44 2.92 1.01 0.34 -0.25 120.40 130.49 2dft s VAL 98 Ca -0.01 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.29 2dft s VAL 98 Cb -0.18 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.28 2dft s VAL 98 CO -0.02 -0.31 1.18 -0.47 0.00 0.00 0.00 175.10 175.48 2dft s TYR 99 N 1.93 2.79 -0.28 5.22 5.04 0.28 -1.66 117.35 130.67 2dft s TYR 99 Ca 0.09 0.78 -0.29 0.00 -2.44 0.00 0.00 57.07 55.21 2dft s TYR 99 Cb -0.18 -4.29 -0.00 0.00 0.35 0.00 0.00 41.96 37.84 2dft s TYR 99 CO 0.12 -1.33 1.35 -0.51 -1.34 0.00 0.00 175.55 173.84 2dft s LEU 100 N 4.49 3.89 -0.10 6.97 1.43 0.17 0.16 118.68 135.69 2dft s LEU 100 Ca 0.50 1.28 -0.11 0.00 -1.03 0.00 0.00 54.13 54.77 2dft s LEU 100 Cb -0.09 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.54 2dft s LEU 100 CO 0.29 -1.10 0.25 -1.61 0.23 0.00 0.00 176.35 174.41 2dft s GLU 101 N 4.22 3.79 -0.11 1.70 2.02 0.18 -3.91 118.70 126.59 2dft s GLU 101 Ca 0.58 0.07 -0.08 0.00 0.02 0.00 0.00 54.97 55.56 2dft s GLU 101 Cb -0.18 -3.26 0.04 0.00 0.10 0.00 0.00 34.13 30.83 2dft s GLU 101 CO 0.24 0.61 0.29 -1.50 0.02 0.00 0.00 175.26 174.92 2dft s ILE 102 N -0.65 -0.02 0.39 -1.63 1.10 -1.26 0.46 121.20 119.60 2dft s ILE 102 Ca 0.17 0.06 -0.23 0.00 -0.51 0.00 0.00 60.65 60.14 2dft s ILE 102 Cb -0.13 -0.42 -0.13 0.00 0.15 0.00 0.00 42.46 41.92 2dft s ILE 102 CO 0.06 0.02 0.51 -1.20 -2.11 0.00 0.00 174.94 172.23 2dft n SER 103 N 3.52 -1.03 -0.02 4.50 7.64 -1.26 -4.82 113.62 122.14 2dft n SER 103 Ca -0.18 0.93 0.18 0.00 1.01 0.00 0.00 58.87 60.81 2dft n SER 103 Cb 0.56 -1.08 0.64 0.00 -1.01 0.00 0.00 64.21 63.32 2dft n SER 103 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dft h ALA 104 N 0.83 2.37 0.00 -0.43 0.00 -1.99 -0.10 119.26 119.94 2dft h ALA 104 Ca -0.39 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 2dft h ALA 104 Cb 1.40 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 2dft h ALA 104 CO 0.52 -0.52 -0.30 0.00 0.00 0.00 0.00 179.25 178.94 2dft h ALA 105 N 1.73 0.85 0.06 0.00 0.00 -2.00 -2.43 119.26 117.46 2dft h ALA 105 Ca 0.26 -0.13 -0.35 0.00 0.00 0.00 0.00 54.91 54.70 2dft h ALA 105 Cb 0.89 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 2dft h ALA 105 CO -0.03 0.16 -2.01 -1.91 0.00 0.00 0.00 179.25 175.47 2dft n GLU 106 N -3.06 0.70 0.33 0.00 4.07 -1.15 -2.58 120.64 118.94 2dft n GLU 106 Ca 0.02 0.23 -0.18 0.00 -0.06 0.00 0.00 57.16 57.17 2dft n GLU 106 Cb 0.59 -1.69 -0.09 0.00 -0.06 0.00 0.00 31.44 30.18 2dft n GLU 106 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 2dft h GLY 107 N 2.30 -1.19 -0.84 8.31 0.00 -1.05 -1.09 103.07 109.50 2dft h GLY 107 Ca -0.41 0.53 0.15 0.00 0.00 0.00 0.00 47.33 47.60 2dft h GLY 107 CO 0.06 -0.38 -0.35 -2.08 0.00 0.00 0.00 176.54 173.79 2dft h VAL 108 N -1.02 0.05 -0.45 4.60 2.07 -1.55 -1.28 116.25 118.68 2dft h VAL 108 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 2dft h VAL 108 Cb 0.86 0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 2dft h VAL 108 CO -0.00 0.00 0.04 0.03 0.02 0.00 0.00 177.57 177.66 2dft h ARG 109 N -0.03 0.16 0.00 1.57 3.08 -0.98 -2.54 114.38 115.63 2dft h ARG 109 Ca 0.34 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.33 2dft h ARG 109 Cb 0.60 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 2dft h ARG 109 CO -0.92 0.10 -0.65 0.00 -1.07 0.00 0.00 179.97 177.44 2dft h ARG 110 N 0.16 0.00 0.00 0.04 3.08 -0.97 -2.60 114.38 114.10 2dft h ARG 110 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2dft h ARG 110 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2dft h ARG 110 CO -0.34 0.16 -0.11 0.25 -1.07 0.00 0.00 179.97 178.86 2dft n THR 111 N -2.97 0.12 0.73 2.04 -2.24 -0.51 -4.05 114.28 107.41 2dft n THR 111 Ca 0.00 -0.06 0.01 0.00 -2.27 0.00 0.00 64.05 61.73 2dft n THR 111 Cb 0.63 -0.37 0.05 0.00 -2.10 0.00 0.00 70.33 68.55 2dft n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dft n GLY 112 N 1.46 1.76 0.00 3.38 0.00 -0.98 -4.55 105.19 106.26 2dft n GLY 112 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2dft n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dft n GLY 113 N 0.10 -1.78 0.00 -0.02 0.00 -1.26 -5.09 105.19 97.15 2dft n GLY 113 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2dft n GLY 113 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dft n ASN 114 N 0.00 0.00 0.00 1.61 5.03 -1.26 -5.14 115.26 115.50 2dft n ASN 114 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2dft n ASN 114 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2dft n ASN 114 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2dft n THR 115 N -0.74 0.00 -2.44 3.41 -2.24 -1.26 -5.17 114.28 105.84 2dft n THR 115 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2dft n THR 115 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2dft n THR 115 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2dft n VAL 116 N 0.00 0.00 -3.36 2.28 0.24 -1.26 -4.91 118.33 111.33 2dft n VAL 116 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 2dft n VAL 116 Cb 0.00 0.00 0.08 0.00 -1.47 0.00 0.00 33.84 32.45 2dft n VAL 116 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2dft n ARG 117 N 13.41 -6.05 0.22 7.34 1.74 -1.26 -4.68 116.66 127.38 2dft n ARG 117 Ca 0.00 0.82 0.15 0.00 -0.77 0.00 0.00 57.85 58.05 2dft n ARG 117 Cb 0.00 -5.72 0.61 0.00 -1.02 0.00 0.00 32.46 26.32 2dft n ARG 117 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2dft h PRO 118 N -1.76 0.00 -0.01 5.56 0.13 -1.93 0.40 132.00 134.39 2dft h PRO 118 Ca -0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 2dft h PRO 118 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2dft h PRO 118 CO 0.48 0.00 -0.12 1.28 -0.23 0.00 0.00 178.00 179.41 2dft n LEU 119 N -2.77 0.66 -0.05 1.56 4.77 -1.26 -3.58 117.00 116.33 2dft n LEU 119 Ca 0.01 -0.10 -0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2dft n LEU 119 Cb 0.28 -0.14 -0.13 0.00 -2.33 0.00 0.00 43.42 41.11 2dft n LEU 119 CO 0.24 0.12 -0.87 0.18 -1.33 0.00 0.00 177.39 175.74 2dft n LEU 120 N -0.77 0.00 -0.88 2.23 4.77 -0.79 -4.77 117.00 116.79 2dft n LEU 120 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2dft n LEU 120 Cb 0.29 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2dft n LEU 120 CO 0.23 0.21 0.00 0.00 -1.33 0.00 0.00 177.39 176.50 2dft n ALA 121 N -2.35 -1.00 0.00 -1.18 0.00 0.06 -4.60 120.51 111.44 2dft n ALA 121 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2dft n ALA 121 Cb 0.75 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.76 2dft n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dft n GLY 122 N -1.41 0.42 3.83 0.00 0.00 -1.26 -4.66 105.19 102.11 2dft n GLY 122 Ca 0.00 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2dft n GLY 122 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2dft s PRO 123 N 0.00 4.16 -1.12 1.61 0.02 -1.26 -4.40 135.00 134.00 2dft s PRO 123 Ca 0.00 1.03 -0.09 0.00 0.02 0.00 0.00 61.00 61.96 2dft s PRO 123 Cb 0.00 -2.21 -0.04 0.00 0.02 0.00 0.00 34.50 32.28 2dft s PRO 123 CO 0.00 -0.04 0.86 -0.25 -0.33 0.00 0.00 177.00 177.24 2dft n ASP 124 N -0.75 -5.20 0.00 2.53 9.92 -1.26 -4.81 116.55 116.98 2dft n ASP 124 Ca 0.06 -0.81 -0.12 0.00 -0.53 0.00 0.00 54.79 53.40 2dft n ASP 124 Cb 0.54 -4.51 -0.06 0.00 -0.64 0.00 0.00 41.12 36.45 2dft n ASP 124 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 2dft h ARG 125 N -1.49 -0.46 -0.75 -1.24 2.43 -1.81 -1.76 114.38 109.30 2dft h ARG 125 Ca -0.63 0.03 0.22 0.00 -0.81 0.00 0.00 59.98 58.79 2dft h ARG 125 Cb 1.33 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.96 2dft h ARG 125 CO 0.47 -0.30 0.77 0.00 -1.51 0.00 0.00 179.97 179.40 2dft h ALA 126 N 0.18 2.56 0.00 2.80 0.00 -1.93 -0.11 119.26 122.77 2dft h ALA 126 Ca 0.08 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.74 2dft h ALA 126 Cb 0.61 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2dft h ALA 126 CO -0.39 -1.16 -1.83 0.39 0.00 0.00 0.00 179.25 176.27 2dft n GLU 127 N -3.62 1.97 0.25 0.00 1.02 -0.73 0.18 120.64 119.72 2dft n GLU 127 Ca 0.16 -0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.38 2dft n GLU 127 Cb 1.03 -1.31 0.64 0.00 -0.02 0.00 0.00 31.44 31.78 2dft n GLU 127 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2dft h LYS 128 N 0.00 0.00 0.05 3.49 1.57 -0.49 -2.52 116.57 118.67 2dft h LYS 128 Ca -0.33 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.37 2dft h LYS 128 Cb 1.73 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.05 2dft h LYS 128 CO 0.02 0.09 -0.34 -0.92 -0.57 0.00 0.00 179.45 177.72 2dft h TYR 129 N 0.00 0.25 0.00 -1.35 5.03 -0.97 -2.51 116.97 117.42 2dft h TYR 129 Ca -0.00 -0.17 0.00 0.00 2.58 0.00 0.00 58.73 61.14 2dft h TYR 129 Cb 0.17 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.44 2dft h TYR 129 CO 0.00 1.10 0.00 0.00 -1.32 0.00 0.00 178.16 177.94 2dft h ARG 130 N -0.67 0.00 0.00 1.82 3.08 -0.21 -0.76 114.38 117.65 2dft h ARG 130 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2dft h ARG 130 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2dft h ARG 130 CO 0.06 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.96 2dft n ALA 131 N -1.83 0.00 0.00 0.04 0.00 -0.96 -3.16 120.51 114.61 2dft n ALA 131 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2dft n ALA 131 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2dft n ALA 131 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dft n LEU 132 N -0.64 0.00 -0.21 0.00 4.32 -0.95 0.70 117.00 120.22 2dft n LEU 132 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 2dft n LEU 132 Cb 0.00 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 41.83 2dft n LEU 132 CO 0.00 0.00 1.07 -0.03 -1.22 0.00 0.00 177.39 177.21 2dft h MET 133 N 0.00 0.84 0.00 3.23 4.05 -1.27 0.87 114.93 122.65 2dft h MET 133 Ca 0.00 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2dft h MET 133 Cb 0.00 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 30.63 2dft h MET 133 CO 0.00 0.63 0.00 0.00 0.23 0.00 0.00 176.91 177.77 2dft n ALA 134 N -2.31 2.44 -0.93 0.39 0.00 0.22 0.74 120.51 121.06 2dft n ALA 134 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2dft n ALA 134 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2dft n ALA 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dft n LYS 135 N -1.05 0.14 0.00 0.00 5.02 0.16 -4.74 118.16 117.68 2dft n LYS 135 Ca 0.18 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.02 2dft n LYS 135 Cb 0.11 -0.53 0.00 0.00 -0.02 0.00 0.00 35.03 34.59 2dft n LYS 135 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2dft n ARG 136 N -0.03 2.39 0.05 1.97 1.74 0.25 -4.83 116.66 118.21 2dft n ARG 136 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 2dft n ARG 136 Cb 0.43 -0.76 0.03 0.00 -1.02 0.00 0.00 32.46 31.14 2dft n ARG 136 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dft h ALA 137 N 0.00 0.60 0.00 7.54 0.00 0.16 -2.47 119.26 125.09 2dft h ALA 137 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 2dft h ALA 137 Cb 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2dft h ALA 137 CO 0.00 0.77 -0.00 -1.00 0.00 0.00 0.00 179.25 179.02 2dft h PRO 138 N 0.26 0.00 -0.10 0.00 0.13 -1.89 -0.38 132.00 130.02 2dft h PRO 138 Ca -0.03 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.95 2dft h PRO 138 Cb 1.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 2dft h PRO 138 CO 0.13 0.00 -0.60 -0.07 -0.23 0.00 0.00 178.00 177.23 2dft h LEU 139 N 0.00 0.38 -0.12 1.56 3.38 -1.85 -3.04 115.31 115.63 2dft h LEU 139 Ca -0.00 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2dft h LEU 139 Cb 0.81 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2dft h LEU 139 CO 0.00 0.89 -0.14 1.88 0.09 0.00 0.00 178.44 181.17 2dft h TYR 140 N 0.25 0.36 -0.19 1.13 0.05 -0.61 -3.08 116.97 114.88 2dft h TYR 140 Ca -0.00 -0.11 0.02 0.00 0.05 0.00 0.00 58.73 58.68 2dft h TYR 140 Cb 1.12 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.76 2dft h TYR 140 CO 0.03 0.72 -0.11 -2.13 -1.05 0.00 0.00 178.16 175.62 2dft n ARG 141 N -4.59 -0.08 0.01 4.88 3.00 -0.87 -1.42 116.66 117.58 2dft n ARG 141 Ca -0.07 0.31 0.14 0.00 -0.00 0.00 0.00 57.85 58.23 2dft n ARG 141 Cb 0.36 -0.45 0.58 0.00 0.00 0.00 0.00 32.46 32.95 2dft n ARG 141 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2dft n ARG 142 N -4.02 0.01 0.00 -0.14 1.85 -1.15 -3.87 116.66 109.34 2dft n ARG 142 Ca 0.00 0.01 0.05 0.00 -1.00 0.00 0.00 57.85 56.92 2dft n ARG 142 Cb 0.05 -1.52 -0.04 0.00 -1.05 0.00 0.00 32.46 29.90 2dft n ARG 142 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 2dft n VAL 143 N -1.54 0.00 -2.78 8.89 0.24 -0.53 -5.01 118.33 117.60 2dft n VAL 143 Ca 0.07 -0.29 -0.33 0.00 -2.04 0.00 0.00 64.34 61.74 2dft n VAL 143 Cb 0.34 1.05 -0.06 0.00 -1.47 0.00 0.00 33.84 33.70 2dft n VAL 143 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dft s ALA 144 N -1.82 3.02 -0.09 2.33 0.00 -0.51 -4.68 121.76 120.01 2dft s ALA 144 Ca 0.06 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.47 2dft s ALA 144 Cb 0.08 -3.17 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 2dft s ALA 144 CO 0.39 0.06 -0.07 0.25 0.00 0.00 0.00 175.76 176.39 2dft n THR 145 N -0.66 0.51 -4.27 0.00 -2.24 0.66 -4.92 114.28 103.36 2dft n THR 145 Ca 0.07 -0.21 -0.24 0.00 -2.27 0.00 0.00 64.05 61.40 2dft n THR 145 Cb 0.54 -0.82 -0.08 0.00 -2.10 0.00 0.00 70.33 67.87 2dft n THR 145 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2dft s MET 146 N -2.18 2.15 -0.01 -0.78 -2.45 -1.18 -5.00 119.30 109.86 2dft s MET 146 Ca -0.11 -1.75 -0.04 0.00 -1.25 0.00 0.00 55.69 52.55 2dft s MET 146 Cb 0.03 -1.97 0.00 0.00 1.25 0.00 0.00 34.83 34.14 2dft s MET 146 CO 0.22 0.08 0.08 -0.98 1.05 0.00 0.00 175.02 175.46 2dft s ARG 147 N -3.77 0.26 -0.08 4.11 1.70 -1.26 -0.56 118.95 119.35 2dft s ARG 147 Ca 0.36 -0.19 -0.05 0.00 -0.47 0.00 0.00 55.73 55.38 2dft s ARG 147 Cb 0.01 0.11 0.03 0.00 -0.57 0.00 0.00 34.95 34.52 2dft s ARG 147 CO 0.20 -0.05 0.19 0.08 -1.08 0.00 0.00 175.30 174.65 2dft s VAL 148 N -0.70 -0.02 -0.30 4.99 1.01 0.12 -4.90 120.40 120.61 2dft s VAL 148 Ca -0.08 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.77 2dft s VAL 148 Cb -0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 36.38 36.04 2dft s VAL 148 CO 0.00 0.03 0.65 -0.62 0.00 0.00 0.00 175.10 175.16 2dft s ASP 149 N 0.63 6.52 -0.07 3.32 -1.08 -1.26 0.52 116.67 125.24 2dft s ASP 149 Ca -0.04 0.48 -0.03 0.00 -0.52 0.00 0.00 52.55 52.44 2dft s ASP 149 Cb -0.06 -2.34 -0.01 0.00 -1.46 0.00 0.00 42.92 39.05 2dft s ASP 149 CO -0.03 -0.48 -0.07 0.71 0.52 0.00 0.00 175.17 175.82 2dft h THR 150 N 5.53 0.00 0.00 1.71 1.35 -0.31 -3.44 112.91 117.76 2dft h THR 150 Ca -0.26 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2dft h THR 150 Cb 1.12 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 2dft h THR 150 CO 0.81 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 176.67 2dft n ASN 151 N -3.63 0.00 0.15 5.36 3.02 -1.22 -0.93 115.26 118.00 2dft n ASN 151 Ca -0.03 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.63 2dft n ASN 151 Cb 0.10 0.00 0.55 0.00 -0.61 0.00 0.00 39.78 39.82 2dft n ASN 151 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2dft n ARG 152 N 1.09 0.16 -2.51 3.52 5.12 -1.26 -4.70 116.66 118.08 2dft n ARG 152 Ca 0.00 0.56 -0.36 0.00 -1.93 0.00 0.00 57.85 56.12 2dft n ARG 152 Cb 0.00 -1.92 -0.04 0.00 -1.16 0.00 0.00 32.46 29.34 2dft n ARG 152 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2dft s ARG 153 N -3.46 4.06 0.54 5.56 3.52 -0.11 -5.06 118.95 124.01 2dft s ARG 153 Ca -0.00 1.52 0.07 0.00 -0.13 0.00 0.00 55.73 57.19 2dft s ARG 153 Cb 0.07 -2.45 0.05 0.00 -1.56 0.00 0.00 34.95 31.05 2dft s ARG 153 CO 0.26 -0.24 0.52 0.54 -0.81 0.00 0.00 175.30 175.58 2dft s ASN 154 N -1.60 4.81 0.17 -2.12 2.20 -1.26 -4.88 114.94 112.26 2dft s ASN 154 Ca 0.60 -1.08 -0.15 0.00 -0.94 0.00 0.00 52.86 51.30 2dft s ASN 154 Cb -0.22 0.29 0.07 0.00 -2.00 0.00 0.00 41.25 39.39 2dft s ASN 154 CO 0.27 -1.13 1.81 -0.65 -2.94 0.00 0.00 177.10 174.46 2dft h PRO 155 N 0.61 0.57 -0.10 3.55 0.11 -1.98 -0.19 132.00 134.57 2dft h PRO 155 Ca -0.35 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.62 2dft h PRO 155 Cb 1.29 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2dft h PRO 155 CO 0.52 0.38 -0.40 0.78 -0.21 0.00 0.00 178.00 179.07 2dft h GLY 156 N 0.59 0.23 2.00 -0.55 0.00 -2.00 -1.14 103.07 102.20 2dft h GLY 156 Ca 0.19 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2dft h GLY 156 CO -0.07 0.19 -0.02 0.00 0.00 0.00 0.00 176.54 176.64 2dft h ALA 157 N 1.41 1.00 0.22 3.60 0.00 -1.44 -2.15 119.26 121.91 2dft h ALA 157 Ca 0.02 -0.02 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 2dft h ALA 157 Cb 0.78 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.60 2dft h ALA 157 CO 0.06 0.03 -1.46 0.28 0.00 0.00 0.00 179.25 178.16 2dft h VAL 158 N 0.00 1.21 -0.49 0.00 2.07 -0.68 0.92 116.25 119.28 2dft h VAL 158 Ca -0.00 -2.61 0.01 0.00 0.82 0.00 0.00 66.70 64.92 2dft h VAL 158 Cb 0.67 2.98 -0.02 0.00 -1.52 0.00 0.00 31.29 33.40 2dft h VAL 158 CO 0.00 0.80 0.32 0.58 0.02 0.00 0.00 177.57 179.30 2dft h VAL 159 N 0.04 1.11 0.19 2.57 2.07 -1.15 0.49 116.25 121.57 2dft h VAL 159 Ca -0.27 -0.22 -0.31 0.00 0.82 0.00 0.00 66.70 66.72 2dft h VAL 159 Cb 2.06 0.41 0.02 0.00 -1.52 0.00 0.00 31.29 32.26 2dft h VAL 159 CO 0.22 0.12 -1.40 0.03 0.02 0.00 0.00 177.57 176.56 2dft h ARG 160 N 0.64 0.40 -0.12 1.57 3.08 -1.28 0.95 114.38 119.63 2dft h ARG 160 Ca 0.18 -0.68 0.04 0.00 0.07 0.00 0.00 59.98 59.59 2dft h ARG 160 Cb -0.04 0.25 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 2dft h ARG 160 CO -0.04 1.32 -0.22 1.25 -1.07 0.00 0.00 179.97 181.21 2dft h HIS 161 N 0.11 -0.57 -0.29 3.04 2.76 0.11 -1.66 115.15 118.65 2dft h HIS 161 Ca -0.21 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 57.92 2dft h HIS 161 Cb 2.08 0.27 -0.01 0.00 1.55 0.00 0.00 27.41 31.30 2dft h HIS 161 CO 0.10 -0.30 -0.06 0.82 -1.30 0.00 0.00 177.93 177.19 2dft h ILE 162 N -0.28 1.28 -0.85 6.26 2.04 -0.69 -2.58 117.51 122.68 2dft h ILE 162 Ca 0.10 -1.08 0.14 0.00 1.00 0.00 0.00 64.86 65.02 2dft h ILE 162 Cb 0.42 1.39 -0.09 0.00 -0.74 0.00 0.00 36.82 37.80 2dft h ILE 162 CO -0.28 0.34 0.44 -0.07 0.00 0.00 0.00 178.15 178.59 2dft h LEU 163 N 0.32 0.55 0.00 1.44 3.38 0.10 -1.14 115.31 119.96 2dft h LEU 163 Ca 0.07 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2dft h LEU 163 Cb 0.53 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2dft h LEU 163 CO 0.03 0.24 0.00 -1.54 0.09 0.00 0.00 178.44 177.25 2dft n SER 164 N -4.86 0.00 -0.74 -0.43 3.41 -0.63 -1.94 113.62 108.43 2dft n SER 164 Ca 0.17 -0.46 0.03 0.00 -0.26 0.00 0.00 58.87 58.35 2dft n SER 164 Cb 0.42 -0.17 0.20 0.00 -0.26 0.00 0.00 64.21 64.40 2dft n SER 164 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2dft n ARG 165 N -1.17 1.70 0.00 4.33 1.74 -0.44 -5.09 116.66 117.72 2dft n ARG 165 Ca 0.18 -3.17 0.00 0.00 -0.77 0.00 0.00 57.85 54.09 2dft n ARG 165 Cb 0.18 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 2dft n ARG 165 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39