#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yru n SER 2 N 0.00 0.00 -3.82 1.61 2.88 -1.26 -5.19 113.62 107.84 2yru n SER 2 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 2yru n SER 2 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2yru n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yru s SER 3 N 0.00 0.03 0.13 -3.46 0.01 -1.26 -5.18 113.70 103.97 2yru s SER 3 Ca 0.00 -0.61 0.02 0.00 1.31 0.00 0.00 55.95 56.67 2yru s SER 3 Cb 0.00 0.38 -0.01 0.00 0.21 0.00 0.00 66.02 66.61 2yru s SER 3 CO 0.00 -0.78 0.13 0.61 0.41 0.00 0.00 173.24 173.61 2yru n GLY 4 N -0.12 3.36 3.16 3.44 0.00 -1.26 -5.16 105.19 108.60 2yru n GLY 4 Ca -0.14 -1.66 0.05 0.00 0.00 0.00 0.00 46.02 44.27 2yru n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yru s SER 5 N -1.85 -0.11 -0.30 1.61 0.15 -1.26 -5.14 113.70 106.80 2yru s SER 5 Ca 0.14 0.08 -0.04 0.00 0.70 0.00 0.00 55.95 56.83 2yru s SER 5 Cb 0.00 1.10 0.19 0.00 -1.71 0.00 0.00 66.02 65.60 2yru s SER 5 CO 0.10 -0.02 0.87 -0.55 1.20 0.00 0.00 173.24 174.84 2yru s SER 6 N 2.84 -0.89 -0.04 5.45 0.15 -1.26 -5.15 113.70 114.81 2yru s SER 6 Ca -0.08 0.04 -0.14 0.00 0.70 0.00 0.00 55.95 56.47 2yru s SER 6 Cb -0.07 1.51 -0.05 0.00 -1.71 0.00 0.00 66.02 65.69 2yru s SER 6 CO -0.09 -0.16 0.38 -0.83 1.20 0.00 0.00 173.24 173.75 2yru s GLY 7 N 2.79 2.42 -0.02 9.45 0.00 -1.26 -5.08 107.32 115.62 2yru s GLY 7 Ca 0.20 -0.27 -0.10 0.00 0.00 0.00 0.00 44.72 44.55 2yru s GLY 7 CO -0.23 0.19 0.22 0.54 0.00 0.00 0.00 173.10 173.83 2yru s VAL 8 N -0.75 0.06 0.52 1.40 0.11 -1.26 -5.10 120.40 115.37 2yru s VAL 8 Ca 0.23 -0.47 0.00 0.00 -2.93 0.00 0.00 61.98 58.80 2yru s VAL 8 Cb -0.16 -0.49 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 2yru s VAL 8 CO 0.11 -0.26 0.00 -0.38 -3.33 0.00 0.00 175.10 171.24 2yru n ILE 9 N 1.68 -4.73 -3.95 7.04 5.41 -1.26 -4.98 119.36 118.57 2yru n ILE 9 Ca -0.20 2.15 -0.24 0.00 1.00 0.00 0.00 62.75 65.45 2yru n ILE 9 Cb 0.56 -3.03 -0.17 0.00 -0.71 0.00 0.00 39.64 36.29 2yru n ILE 9 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2yru s GLU 10 N -4.13 1.08 -0.20 0.38 0.41 -1.26 -5.12 118.70 109.86 2yru s GLU 10 Ca 0.00 -0.10 -0.33 0.00 -0.41 0.00 0.00 54.97 54.13 2yru s GLU 10 Cb 0.00 -1.21 0.15 0.00 -1.78 0.00 0.00 34.13 31.28 2yru s GLU 10 CO 0.00 -0.23 1.20 -1.54 -0.49 0.00 0.00 175.26 174.21 2yru s SER 11 N 1.59 -0.15 0.36 -0.19 1.04 -1.26 -5.18 113.70 109.91 2yru s SER 11 Ca 0.01 0.06 0.07 0.00 0.48 0.00 0.00 55.95 56.58 2yru s SER 11 Cb -0.13 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.12 2yru s SER 11 CO -0.05 -0.21 0.38 -1.61 0.98 0.00 0.00 173.24 172.73 2yru s GLU 12 N -1.95 2.80 0.03 4.02 8.01 -1.26 -5.06 118.70 125.30 2yru s GLU 12 Ca 0.08 -1.26 0.05 0.00 0.01 0.00 0.00 54.97 53.85 2yru s GLU 12 Cb -0.01 -2.58 -0.02 0.00 -4.31 0.00 0.00 34.13 27.21 2yru s GLU 12 CO -0.05 -0.00 -0.16 0.99 0.01 0.00 0.00 175.26 176.05 2yru s THR 13 N -2.31 1.27 0.00 3.63 2.01 -1.26 -5.13 115.64 113.86 2yru s THR 13 Ca 0.45 -1.01 -0.02 0.00 0.31 0.00 0.00 61.69 61.41 2yru s THR 13 Cb -0.07 -1.13 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 2yru s THR 13 CO 0.29 0.10 0.17 -0.76 -0.69 0.00 0.00 174.62 173.72 2yru s LEU 14 N -1.06 4.29 0.08 4.42 1.43 -1.26 -5.02 118.68 121.56 2yru s LEU 14 Ca 0.04 0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 53.14 2yru s LEU 14 Cb -0.08 -2.60 -0.16 0.00 0.03 0.00 0.00 46.19 43.38 2yru s LEU 14 CO 0.01 0.25 1.65 -0.29 0.23 0.00 0.00 176.35 178.20 2yru h ILE 15 N 2.79 0.45 -0.64 -0.59 2.10 -1.99 -0.61 117.51 119.03 2yru h ILE 15 Ca -0.48 0.00 0.17 0.00 1.08 0.00 0.00 64.86 65.62 2yru h ILE 15 Cb 1.18 0.45 -0.03 0.00 -1.09 0.00 0.00 36.82 37.34 2yru h ILE 15 CO 0.69 0.00 0.45 -0.33 -1.08 0.00 0.00 178.15 177.88 2yru h GLU 16 N -0.67 0.10 -0.01 2.19 5.08 -1.96 1.44 114.58 120.75 2yru h GLU 16 Ca -0.05 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 2yru h GLU 16 Cb 0.55 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 2yru h GLU 16 CO 0.06 0.07 -0.56 -0.44 -1.00 0.00 0.00 179.01 177.13 2yru h ASP 17 N 0.10 0.02 0.78 1.42 5.19 -1.69 1.45 116.42 123.69 2yru h ASP 17 Ca 0.31 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 2yru h ASP 17 Cb 1.07 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.58 2yru h ASP 17 CO -0.03 0.58 -1.12 0.52 -3.12 0.00 0.00 179.24 176.06 2yru n VAL 18 N -3.87 0.46 0.01 -1.35 0.31 0.23 -4.08 118.33 110.04 2yru n VAL 18 Ca -0.01 -0.49 -0.21 0.00 -0.01 0.00 0.00 64.34 63.62 2yru n VAL 18 Cb 0.57 -0.22 -0.14 0.00 -0.91 0.00 0.00 33.84 33.14 2yru n VAL 18 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2yru h LEU 19 N 0.00 0.41 -0.89 7.52 -0.00 0.19 -3.19 115.31 119.35 2yru h LEU 19 Ca 0.00 -0.91 0.15 0.00 -0.00 0.00 0.00 57.88 57.12 2yru h LEU 19 Cb 0.95 -0.13 -0.15 0.00 -0.00 0.00 0.00 40.66 41.33 2yru h LEU 19 CO 0.00 1.82 -0.31 -1.14 -0.00 0.00 0.00 178.44 178.81 2yru n ARG 20 N -3.47 -0.17 0.08 1.13 3.00 0.49 0.21 116.66 117.93 2yru n ARG 20 Ca -0.31 1.38 -0.06 0.00 -0.00 0.00 0.00 57.85 58.86 2yru n ARG 20 Cb 1.05 -2.05 -0.04 0.00 0.00 0.00 0.00 32.46 31.42 2yru n ARG 20 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 2yru h PRO 21 N 0.00 -0.28 -0.99 -0.14 0.13 -1.75 0.13 132.00 129.09 2yru h PRO 21 Ca 0.35 0.02 0.29 0.00 -0.87 0.00 0.00 66.00 65.79 2yru h PRO 21 Cb 0.57 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.73 2yru h PRO 21 CO -0.90 -0.08 0.96 -0.07 -0.23 0.00 0.00 178.00 177.68 2yru h LEU 22 N -1.04 0.00 0.07 1.56 3.38 -1.30 1.01 115.31 118.99 2yru h LEU 22 Ca -0.03 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.66 2yru h LEU 22 Cb 0.34 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2yru h LEU 22 CO 0.05 0.00 -1.51 -0.33 0.09 0.00 0.00 178.44 176.74 2yru h GLU 23 N 0.00 0.14 -0.76 1.13 5.08 0.24 -3.26 114.58 117.14 2yru h GLU 23 Ca 0.47 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.59 2yru h GLU 23 Cb 2.39 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 31.69 2yru h GLU 23 CO -0.00 1.12 0.50 -0.56 -1.00 0.00 0.00 179.01 179.06 2yru h GLN 24 N -0.50 1.01 -0.17 2.33 3.07 0.31 -1.73 115.11 119.44 2yru h GLN 24 Ca -0.36 -0.07 -0.00 0.00 0.09 0.00 0.00 58.65 58.32 2yru h GLN 24 Cb 1.64 -0.23 -0.01 0.00 0.08 0.00 0.00 27.48 28.96 2yru h GLN 24 CO -0.05 0.68 0.10 0.00 0.09 0.00 0.00 178.83 179.65 2yru h ALA 25 N 1.51 0.22 0.29 0.06 0.00 0.54 -2.74 119.26 119.14 2yru h ALA 25 Ca 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2yru h ALA 25 Cb -0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2yru h ALA 25 CO -0.06 -0.26 -0.34 1.25 0.00 0.00 0.00 179.25 179.84 2yru h LEU 26 N 0.19 -0.95 -1.50 0.00 5.85 -1.44 -0.30 115.31 117.17 2yru h LEU 26 Ca 0.06 0.08 0.47 0.00 0.84 0.00 0.00 57.88 59.33 2yru h LEU 26 Cb 0.04 0.32 -0.10 0.00 0.37 0.00 0.00 40.66 41.29 2yru h LEU 26 CO -0.01 -0.43 1.03 -0.62 -0.34 0.00 0.00 178.44 178.07 2yru n GLU 27 N -4.42 -0.02 0.07 1.25 1.02 -0.71 0.19 120.64 118.01 2yru n GLU 27 Ca -0.08 1.04 -0.11 0.00 -0.02 0.00 0.00 57.16 58.00 2yru n GLU 27 Cb 0.30 -2.22 -0.08 0.00 -0.02 0.00 0.00 31.44 29.43 2yru n GLU 27 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2yru h ASP 28 N 0.00 -0.21 -0.94 1.62 1.82 -0.79 -2.71 116.42 115.21 2yru h ASP 28 Ca 0.81 -0.32 0.04 0.00 -0.39 0.00 0.00 57.03 57.18 2yru h ASP 28 Cb 2.95 0.06 -0.06 0.00 0.68 0.00 0.00 39.33 42.96 2yru h ASP 28 CO -0.21 0.31 0.62 0.00 -1.61 0.00 0.00 179.24 178.34 2yru h HIS 30 N 1.17 0.68 -0.93 0.00 -0.00 0.90 1.38 115.15 118.35 2yru h HIS 30 Ca 0.38 0.02 -0.52 0.00 -0.00 0.00 0.00 60.37 60.25 2yru h HIS 30 Cb 0.03 -0.22 -0.28 0.00 -0.00 0.00 0.00 27.41 26.94 2yru h HIS 30 CO -0.00 0.26 0.66 0.41 -0.00 0.00 0.00 177.93 179.27 2yru n GLY 31 N -1.47 4.65 1.03 5.26 0.00 0.14 -4.63 105.19 110.17 2yru n GLY 31 Ca 0.16 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2yru n GLY 31 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2yru n HIS 32 N -0.96 -1.23 -1.15 1.61 -0.00 0.94 -5.02 115.22 109.42 2yru n HIS 32 Ca 0.56 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.96 2yru n HIS 32 Cb 1.35 0.26 0.12 0.00 -0.00 0.00 0.00 29.99 31.72 2yru n HIS 32 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 2yru s THR 33 N -0.51 2.29 0.65 1.59 2.01 0.44 -4.92 115.64 117.18 2yru s THR 33 Ca 0.00 0.12 -0.17 0.00 0.31 0.00 0.00 61.69 61.95 2yru s THR 33 Cb 0.00 -2.49 -0.06 0.00 0.01 0.00 0.00 72.50 69.96 2yru s THR 33 CO 0.00 -0.10 0.60 0.29 -0.69 0.00 0.00 174.62 174.72 2yru n LYS 34 N -3.34 0.47 0.03 4.92 5.02 -1.26 -4.57 118.16 119.43 2yru n LYS 34 Ca 0.13 0.19 -0.13 0.00 -2.02 0.00 0.00 58.31 56.48 2yru n LYS 34 Cb 0.51 -1.84 -0.09 0.00 -0.02 0.00 0.00 35.03 33.60 2yru n LYS 34 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2yru h LYS 35 N -0.02 -0.07 -0.93 1.97 3.11 -1.91 -2.12 116.57 116.61 2yru h LYS 35 Ca -0.46 0.00 0.27 0.00 -2.81 0.00 0.00 60.65 57.66 2yru h LYS 35 Cb 1.37 0.02 -0.15 0.00 -1.00 0.00 0.00 32.23 32.46 2yru h LYS 35 CO 0.45 0.23 0.30 1.96 -2.81 0.00 0.00 179.45 179.58 2yru h GLN 36 N -0.36 0.18 0.47 1.90 1.08 -1.97 1.33 115.11 117.74 2yru h GLN 36 Ca -0.01 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 2yru h GLN 36 Cb 0.32 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 2yru h GLN 36 CO 0.01 0.12 -0.23 0.28 -0.95 0.00 0.00 178.83 178.06 2yru h VAL 37 N 0.18 0.46 -0.16 -0.54 2.07 -1.87 -1.52 116.25 114.88 2yru h VAL 37 Ca 0.62 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.82 2yru h VAL 37 Cb 1.34 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 2yru h VAL 37 CO -0.69 0.06 -0.25 0.00 0.02 0.00 0.00 177.57 176.70 2yru h ASP 39 N -0.30 0.00 0.00 0.00 3.58 0.16 0.63 116.42 120.49 2yru h ASP 39 Ca 0.11 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.52 2yru h ASP 39 Cb 0.47 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2yru h ASP 39 CO -0.34 0.00 -0.41 -0.78 -2.88 0.00 0.00 179.24 174.84 2yru h ASP 40 N 0.00 0.00 -0.22 2.28 1.82 0.18 -3.06 116.42 117.41 2yru h ASP 40 Ca 0.07 -0.25 0.05 0.00 -0.39 0.00 0.00 57.03 56.52 2yru h ASP 40 Cb 0.86 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.81 2yru h ASP 40 CO -0.00 0.85 -0.15 0.40 -1.61 0.00 0.00 179.24 178.72 2yru h ILE 41 N -1.00 0.56 -0.49 2.25 2.04 0.15 -1.36 117.51 119.66 2yru h ILE 41 Ca -0.06 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.89 2yru h ILE 41 Cb 0.57 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 37.12 2yru h ILE 41 CO -0.04 0.00 -0.02 0.77 0.00 0.00 0.00 178.15 178.86 2yru h SER 42 N -0.15 -0.25 -1.31 1.72 4.64 0.01 0.34 113.55 118.56 2yru h SER 42 Ca 0.13 0.12 0.38 0.00 -0.47 0.00 0.00 61.79 61.95 2yru h SER 42 Cb 0.34 0.22 -0.06 0.00 -0.31 0.00 0.00 62.40 62.59 2yru h SER 42 CO -0.31 -0.09 0.94 0.03 -0.87 0.00 0.00 176.83 176.53 2yru h ARG 43 N 0.10 0.02 0.05 4.77 3.08 -1.14 0.47 114.38 121.72 2yru h ARG 43 Ca 0.25 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.19 2yru h ARG 43 Cb 0.37 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.43 2yru h ARG 43 CO -0.43 0.02 -0.43 0.00 -1.07 0.00 0.00 179.97 178.06 2yru h ARG 44 N 0.03 0.20 -0.48 0.04 2.47 -0.08 -3.24 114.38 113.31 2yru h ARG 44 Ca 0.63 -0.28 0.10 0.00 -1.26 0.00 0.00 59.98 59.17 2yru h ARG 44 Cb 2.48 0.10 -0.09 0.00 -1.65 0.00 0.00 29.97 30.80 2yru h ARG 44 CO -0.04 1.08 -0.11 -0.07 0.56 0.00 0.00 179.97 181.39 2yru h LEU 45 N -0.55 -0.44 -1.26 3.04 3.38 0.61 0.91 115.31 121.00 2yru h LEU 45 Ca -0.07 0.14 0.22 0.00 0.09 0.00 0.00 57.88 58.26 2yru h LEU 45 Cb 1.27 0.29 -0.09 0.00 0.09 0.00 0.00 40.66 42.22 2yru h LEU 45 CO 0.08 -0.15 0.63 0.00 0.09 0.00 0.00 178.44 179.08 2yru h ALA 46 N 1.48 2.00 -0.00 1.53 0.00 -1.23 0.27 119.26 123.30 2yru h ALA 46 Ca 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2yru h ALA 46 Cb 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2yru h ALA 46 CO -0.49 -0.36 -0.04 1.25 0.00 0.00 0.00 179.25 179.61 2yru h LEU 47 N 0.55 0.04 -0.28 0.00 6.46 -0.13 -2.14 115.31 119.80 2yru h LEU 47 Ca 0.55 -0.79 0.04 0.00 -0.12 0.00 0.00 57.88 57.57 2yru h LEU 47 Cb 1.17 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 41.01 2yru h LEU 47 CO -0.30 0.82 -0.52 0.25 -0.62 0.00 0.00 178.44 178.07 2yru h LEU 48 N -0.74 -1.71 0.28 2.25 5.85 0.24 0.64 115.31 122.11 2yru h LEU 48 Ca -0.01 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 2yru h LEU 48 Cb 0.83 0.69 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 2yru h LEU 48 CO 0.01 -0.43 -0.27 -0.09 -0.34 0.00 0.00 178.44 177.31 2yru h ARG 49 N -0.47 -0.53 -0.98 1.25 2.43 -0.67 0.59 114.38 116.00 2yru h ARG 49 Ca 0.07 0.04 0.19 0.00 -0.81 0.00 0.00 59.98 59.46 2yru h ARG 49 Cb 0.63 0.12 -0.18 0.00 -0.42 0.00 0.00 29.97 30.12 2yru h ARG 49 CO -0.52 -0.36 -0.27 0.93 -1.51 0.00 0.00 179.97 178.24 2yru h GLU 50 N -0.55 -0.00 -0.62 0.20 4.39 -1.03 1.70 114.58 118.67 2yru h GLU 50 Ca -0.04 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 2yru h GLU 50 Cb 0.48 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 2yru h GLU 50 CO -0.03 -0.00 0.16 1.96 -1.16 0.00 0.00 179.01 179.94 2yru h GLN 51 N -0.00 0.96 0.71 2.33 4.20 0.65 1.20 115.11 125.16 2yru h GLN 51 Ca 0.45 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.92 2yru h GLN 51 Cb 0.70 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 28.35 2yru h GLN 51 CO -1.01 0.85 -0.34 2.35 -0.67 0.00 0.00 178.83 180.01 2yru h TRP 52 N 0.92 -0.88 0.42 2.96 2.91 0.77 0.14 115.95 123.19 2yru h TRP 52 Ca 0.20 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.19 2yru h TRP 52 Cb 0.32 0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 29.24 2yru h TRP 52 CO 0.02 -0.55 -0.34 0.00 -1.03 0.00 0.00 178.44 176.54 2yru h ALA 53 N -1.38 -0.78 -1.72 2.65 0.00 0.11 -1.26 119.26 116.87 2yru h ALA 53 Ca -0.10 -0.14 0.53 0.00 0.00 0.00 0.00 54.91 55.20 2yru h ALA 53 Cb 0.73 0.47 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2yru h ALA 53 CO 0.16 -0.97 1.20 0.78 0.00 0.00 0.00 179.25 180.42 2yru h GLY 54 N -0.76 0.53 0.00 0.00 0.00 0.14 -3.43 103.07 99.55 2yru h GLY 54 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2yru h GLY 54 CO -0.02 -0.18 0.00 0.61 0.00 0.00 0.00 176.54 176.95 2yru n GLY 55 N -1.76 0.83 0.18 4.60 0.00 -0.48 -4.95 105.19 103.61 2yru n GLY 55 Ca 0.42 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2yru n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yru h LYS 56 N 1.08 0.00 -6.59 1.61 1.79 -0.93 -3.45 116.57 110.09 2yru h LYS 56 Ca 0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 2yru h LYS 56 Cb 0.00 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.62 2yru h LYS 56 CO 0.00 0.00 0.13 -0.51 -1.08 0.00 0.00 179.45 177.99 2yru s LEU 57 N -5.64 4.37 0.71 2.94 1.43 -0.97 -5.00 118.68 116.51 2yru s LEU 57 Ca 0.08 1.47 -0.11 0.00 -1.03 0.00 0.00 54.13 54.54 2yru s LEU 57 Cb 0.07 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.72 2yru s LEU 57 CO 0.65 0.04 1.06 -0.55 0.23 0.00 0.00 176.35 177.79 2yru s SER 58 N -1.59 5.28 0.09 2.29 0.15 -1.26 -4.96 113.70 113.70 2yru s SER 58 Ca 0.43 1.56 -0.17 0.00 0.70 0.00 0.00 55.95 58.47 2yru s SER 58 Cb -0.17 -2.43 -0.07 0.00 -1.71 0.00 0.00 66.02 61.63 2yru s SER 58 CO 0.22 -1.50 1.48 0.40 1.20 0.00 0.00 173.24 175.04 2yru h ILE 59 N -0.76 1.28 0.00 6.45 2.04 -1.97 -2.35 117.51 122.21 2yru h ILE 59 Ca -0.44 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.29 2yru h ILE 59 Cb 1.22 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2yru h ILE 59 CO 0.57 0.36 0.00 -0.81 0.00 0.00 0.00 178.15 178.27 2yru n PRO 60 N -4.48 0.33 0.10 2.37 -0.04 -1.26 -2.06 135.00 129.96 2yru n PRO 60 Ca -0.03 0.07 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 2yru n PRO 60 Cb 0.33 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.30 2yru n PRO 60 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2yru h VAL 61 N 0.00 0.00 0.03 0.52 2.07 -1.80 -3.20 116.25 113.87 2yru h VAL 61 Ca 0.00 -0.96 -0.34 0.00 0.82 0.00 0.00 66.70 66.22 2yru h VAL 61 Cb 0.21 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2yru h VAL 61 CO 0.00 0.00 -1.91 0.29 0.02 0.00 0.00 177.57 175.97 2yru n LYS 62 N -2.64 0.63 -0.07 1.57 5.02 -0.91 -3.12 118.16 118.65 2yru n LYS 62 Ca 0.00 0.37 0.14 0.00 -2.02 0.00 0.00 58.31 56.80 2yru n LYS 62 Cb 0.54 -1.65 0.54 0.00 -0.02 0.00 0.00 35.03 34.45 2yru n LYS 62 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2yru h LYS 63 N -0.60 0.31 0.03 1.97 1.57 -1.58 0.11 116.57 118.37 2yru h LYS 63 Ca -0.48 -0.02 -0.27 0.00 -1.87 0.00 0.00 60.65 58.01 2yru h LYS 63 Cb 1.64 -0.07 0.02 0.00 0.08 0.00 0.00 32.23 33.90 2yru h LYS 63 CO -0.17 0.20 -1.06 0.00 -0.57 0.00 0.00 179.45 177.85 2yru h ARG 64 N 0.31 0.66 0.52 3.15 3.08 -1.71 -3.29 114.38 117.10 2yru h ARG 64 Ca 0.28 -0.75 -0.01 0.00 0.07 0.00 0.00 59.98 59.56 2yru h ARG 64 Cb 0.66 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 2yru h ARG 64 CO -0.07 1.33 -0.45 0.52 -1.07 0.00 0.00 179.97 180.23 2yru h MET 65 N 0.32 -0.93 -0.97 0.04 2.86 -0.97 -2.07 114.93 113.21 2yru h MET 65 Ca -0.14 0.06 0.29 0.00 -2.06 0.00 0.00 59.70 57.85 2yru h MET 65 Cb 1.72 0.21 -0.18 0.00 0.06 0.00 0.00 31.60 33.42 2yru h MET 65 CO 0.21 -0.62 0.10 0.00 1.06 0.00 0.00 176.91 177.66 2yru n ALA 66 N -2.74 0.58 0.01 6.32 0.00 -0.48 -0.50 120.51 123.70 2yru n ALA 66 Ca -0.12 1.03 -0.01 0.00 0.00 0.00 0.00 53.44 54.34 2yru n ALA 66 Cb 0.44 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 19.09 2yru n ALA 66 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2yru h LEU 67 N 0.00 -0.10 -0.99 0.00 3.38 -1.45 1.09 115.31 117.24 2yru h LEU 67 Ca 0.63 0.01 0.35 0.00 0.09 0.00 0.00 57.88 58.95 2yru h LEU 67 Cb 1.37 0.03 -0.17 0.00 0.09 0.00 0.00 40.66 41.99 2yru h LEU 67 CO -0.88 -0.04 0.44 0.25 0.09 0.00 0.00 178.44 178.29 2yru h LEU 68 N -0.06 0.22 0.26 1.67 6.46 -0.47 0.81 115.31 124.20 2yru h LEU 68 Ca -0.00 0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 2yru h LEU 68 Cb 0.05 0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 2yru h LEU 68 CO -0.01 -0.31 -0.12 0.58 -0.62 0.00 0.00 178.44 177.96 2yru h VAL 69 N 0.12 0.79 -0.61 1.05 2.07 0.15 -1.18 116.25 118.65 2yru h VAL 69 Ca 0.74 -0.35 0.18 0.00 0.82 0.00 0.00 66.70 68.09 2yru h VAL 69 Cb 1.80 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 2yru h VAL 69 CO -0.73 0.08 0.62 1.56 0.02 0.00 0.00 177.57 179.11 2yru h GLN 70 N -0.53 0.00 0.26 1.57 1.08 0.80 0.58 115.11 118.86 2yru h GLN 70 Ca -0.04 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.82 2yru h GLN 70 Cb 0.39 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 27.86 2yru h GLN 70 CO 0.06 0.00 -1.50 0.93 -0.95 0.00 0.00 178.83 177.37 2yru h GLU 71 N 0.00 0.54 0.00 1.46 4.39 -0.34 -2.96 114.58 117.67 2yru h GLU 71 Ca 0.29 -0.92 0.00 0.00 0.34 0.00 0.00 59.36 59.06 2yru h GLU 71 Cb 1.52 0.34 0.00 0.00 -0.10 0.00 0.00 28.75 30.51 2yru h GLU 71 CO -0.00 1.44 0.00 1.25 -1.16 0.00 0.00 179.01 180.54 2yru h LEU 72 N 0.14 0.00 0.16 1.33 6.46 0.13 1.52 115.31 125.05 2yru h LEU 72 Ca -0.26 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.26 2yru h LEU 72 Cb 2.17 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 42.13 2yru h LEU 72 CO 0.27 0.00 -1.01 -0.07 -0.62 0.00 0.00 178.44 177.02 2yru h LEU 73 N 0.00 0.61 -0.05 2.25 3.38 -1.07 -3.16 115.31 117.27 2yru h LEU 73 Ca 0.00 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.05 2yru h LEU 73 Cb 0.29 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2yru h LEU 73 CO 0.00 1.48 -0.01 1.41 0.09 0.00 0.00 178.44 181.42 2yru n HIS 74 N -4.00 0.00 -0.13 1.13 8.25 -0.82 -4.84 115.22 114.81 2yru n HIS 74 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 2yru n HIS 74 Cb 0.90 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.92 2yru n HIS 74 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2yru n HIS 75 N -1.03 0.00 -1.80 4.41 8.25 -0.02 -4.95 115.22 120.07 2yru n HIS 75 Ca 0.21 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.46 2yru n HIS 75 Cb 0.17 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.20 2yru n HIS 75 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2yru s GLN 76 N -0.50 1.86 0.09 -0.41 -1.52 0.50 -4.63 119.66 115.06 2yru s GLN 76 Ca 0.00 -0.40 -0.04 0.00 -1.95 0.00 0.00 55.36 52.97 2yru s GLN 76 Cb 0.00 -5.02 -0.25 0.00 -0.22 0.00 0.00 33.01 27.52 2yru s GLN 76 CO 0.00 -4.50 1.17 -1.49 -0.25 0.00 0.00 175.29 170.23 2yru h TRP 77 N 11.29 0.49 -0.20 0.91 4.06 -1.93 -2.50 115.95 128.07 2yru h TRP 77 Ca 0.08 -0.34 -0.00 0.00 2.06 0.00 0.00 58.89 60.69 2yru h TRP 77 Cb 0.98 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 29.11 2yru h TRP 77 CO 1.14 1.25 0.12 -0.44 -3.56 0.00 0.00 178.44 176.95 2yru h ASP 78 N 0.09 0.24 0.40 -3.49 3.32 -1.95 0.86 116.42 115.89 2yru h ASP 78 Ca -0.12 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 2yru h ASP 78 Cb 1.90 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.40 2yru h ASP 78 CO 0.20 0.21 -0.19 0.00 -1.72 0.00 0.00 179.24 177.74 2yru h ALA 79 N 1.04 -0.53 -0.69 3.45 0.00 -1.94 -0.45 119.26 120.14 2yru h ALA 79 Ca 0.07 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.99 2yru h ALA 79 Cb 0.02 0.21 -0.12 0.00 0.00 0.00 0.00 17.79 17.89 2yru h ALA 79 CO -0.01 -0.76 0.02 0.00 0.00 0.00 0.00 179.25 178.49 2yru h ALA 80 N -0.02 0.71 0.00 0.00 0.00 -1.28 1.53 119.26 120.21 2yru h ALA 80 Ca -0.05 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2yru h ALA 80 Cb 0.45 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2yru h ALA 80 CO 0.09 -0.40 -0.09 0.22 0.00 0.00 0.00 179.25 179.07 2yru h ASP 81 N 0.12 0.00 -0.08 0.00 3.58 -0.50 1.01 116.42 120.55 2yru h ASP 81 Ca 0.37 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.77 2yru h ASP 81 Cb 0.63 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 2yru h ASP 81 CO -0.59 0.09 -0.13 -0.78 -2.88 0.00 0.00 179.24 174.95 2yru h ASP 82 N 0.00 0.26 -0.25 2.28 1.82 0.37 -2.22 116.42 118.68 2yru h ASP 82 Ca -0.00 -0.53 -0.14 0.00 -0.39 0.00 0.00 57.03 55.97 2yru h ASP 82 Cb 0.18 -0.07 -0.00 0.00 0.68 0.00 0.00 39.33 40.11 2yru h ASP 82 CO 0.01 0.74 -0.40 0.40 -1.61 0.00 0.00 179.24 178.38 2yru h ILE 83 N -0.22 1.31 -0.02 2.25 2.04 0.13 -2.90 117.51 120.10 2yru h ILE 83 Ca 0.01 -1.60 0.02 0.00 1.00 0.00 0.00 64.86 64.29 2yru h ILE 83 Cb 0.68 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 38.44 2yru h ILE 83 CO 0.03 0.51 -0.45 -0.74 0.00 0.00 0.00 178.15 177.49 2yru h HIS 84 N 0.43 -1.33 -0.41 1.37 -0.00 0.10 -0.09 115.15 115.21 2yru h HIS 84 Ca 0.02 0.04 0.07 0.00 -0.00 0.00 0.00 60.37 60.50 2yru h HIS 84 Cb 0.99 0.58 -0.09 0.00 -0.00 0.00 0.00 27.41 28.90 2yru h HIS 84 CO 0.08 -0.48 -0.46 0.00 -0.00 0.00 0.00 177.93 177.08 2yru h ARG 85 N -0.55 -0.33 -0.80 5.26 2.47 -1.45 1.04 114.38 120.02 2yru h ARG 85 Ca 0.01 0.02 0.23 0.00 -1.26 0.00 0.00 59.98 58.99 2yru h ARG 85 Cb 0.60 0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.96 2yru h ARG 85 CO -0.31 -0.22 0.74 0.66 0.56 0.00 0.00 179.97 181.39 2yru h SER 86 N -0.34 0.00 0.56 7.04 4.64 -1.20 1.80 113.55 126.05 2yru h SER 86 Ca 0.12 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.16 2yru h SER 86 Cb 0.59 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 2yru h SER 86 CO -0.58 0.00 -1.44 -0.07 -0.87 0.00 0.00 176.83 173.87 2yru h LEU 87 N 0.00 0.29 -0.00 5.97 3.38 0.28 -3.24 115.31 121.99 2yru h LEU 87 Ca 0.38 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2yru h LEU 87 Cb 1.85 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2yru h LEU 87 CO -0.00 1.32 -0.24 0.80 0.09 0.00 0.00 178.44 180.41 2yru n MET 88 N -3.40 0.01 -0.04 1.13 1.56 0.47 -1.58 117.12 115.26 2yru n MET 88 Ca -0.13 -0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.19 2yru n MET 88 Cb 1.03 -1.50 -0.10 0.00 2.15 0.00 0.00 33.22 34.80 2yru n MET 88 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2yru h VAL 89 N 0.00 1.30 0.00 1.12 2.07 0.20 -3.34 116.25 117.60 2yru h VAL 89 Ca 0.00 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2yru h VAL 89 Cb 0.50 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 2yru h VAL 89 CO 0.00 0.41 -0.04 0.47 0.02 0.00 0.00 177.57 178.43 2yru n ASP 90 N -4.71 0.10 -3.29 0.57 9.92 -1.22 -4.55 116.55 113.37 2yru n ASP 90 Ca -0.08 0.14 -0.33 0.00 -0.53 0.00 0.00 54.79 53.99 2yru n ASP 90 Cb 0.34 -0.52 -0.02 0.00 -0.64 0.00 0.00 41.12 40.28 2yru n ASP 90 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2yru n HIS 91 N -2.50 2.07 -0.04 1.24 8.25 -0.62 -4.36 115.22 119.27 2yru n HIS 91 Ca -0.01 -2.65 -0.18 0.00 -0.26 0.00 0.00 57.72 54.62 2yru n HIS 91 Cb 0.02 -2.18 -0.13 0.00 1.12 0.00 0.00 29.99 28.82 2yru n HIS 91 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2yru h VAL 92 N 3.24 1.40 0.00 1.59 3.04 -1.67 -1.93 116.25 121.92 2yru h VAL 92 Ca 0.71 -2.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.04 2yru h VAL 92 Cb 0.26 2.98 0.00 0.00 -2.01 0.00 0.00 31.29 32.52 2yru h VAL 92 CO 1.67 0.59 0.00 0.41 -1.01 0.00 0.00 177.57 179.23 2yru n THR 93 N -4.33 1.35 -0.07 3.17 -1.04 -1.26 0.38 114.28 112.48 2yru n THR 93 Ca -0.18 0.40 -0.06 0.00 -2.04 0.00 0.00 64.05 62.16 2yru n THR 93 Cb 0.68 -1.29 -0.02 0.00 -1.82 0.00 0.00 70.33 67.88 2yru n THR 93 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2yru n GLU 94 N -1.69 0.41 -0.12 -2.82 1.02 -1.23 -4.46 120.64 111.76 2yru n GLU 94 Ca 0.01 0.31 0.02 0.00 -0.02 0.00 0.00 57.16 57.48 2yru n GLU 94 Cb 0.10 -1.39 0.32 0.00 -0.02 0.00 0.00 31.44 30.45 2yru n GLU 94 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 2yru h VAL 95 N -0.83 1.16 -3.37 2.62 -1.51 -1.28 -3.43 116.25 109.60 2yru h VAL 95 Ca 0.00 -0.31 -0.53 0.00 -1.23 0.00 0.00 66.70 64.63 2yru h VAL 95 Cb 0.65 0.30 0.22 0.00 -2.13 0.00 0.00 31.29 30.33 2yru h VAL 95 CO 0.00 0.16 -0.59 -1.54 -1.23 0.00 0.00 177.57 174.37 2yru n SER 96 N -4.44 -2.08 0.00 4.19 3.41 0.16 0.06 113.62 114.92 2yru n SER 96 Ca 0.06 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2yru n SER 96 Cb 0.05 -1.20 0.00 0.00 -0.26 0.00 0.00 64.21 62.81 2yru n SER 96 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2yru n GLN 97 N -1.75 0.00 0.00 4.33 7.27 -1.26 -4.45 117.38 121.52 2yru n GLN 97 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.13 2yru n GLN 97 Cb 0.54 -1.97 0.00 0.00 2.41 0.00 0.00 30.24 31.22 2yru n GLN 97 CO 0.00 0.00 0.00 -2.67 0.07 0.00 0.00 177.06 174.46 2yru n TRP 98 N -2.34 -0.40 -0.39 3.69 4.27 -1.18 -4.86 117.44 116.22 2yru n TRP 98 Ca 0.00 0.00 0.33 0.00 -3.89 0.00 0.00 57.50 53.94 2yru n TRP 98 Cb 0.00 0.08 0.56 0.00 -1.36 0.00 0.00 31.31 30.59 2yru n TRP 98 CO 0.00 0.00 0.00 -0.12 -2.29 0.00 0.00 177.69 175.28 2yru n MET 99 N -1.40 -0.03 -0.18 -2.67 1.56 0.11 0.19 117.12 114.70 2yru n MET 99 Ca 0.00 1.04 -0.02 0.00 -0.27 0.00 0.00 57.70 58.45 2yru n MET 99 Cb 0.00 -2.06 0.05 0.00 2.15 0.00 0.00 33.22 33.36 2yru n MET 99 CO 0.00 0.00 0.00 -0.39 -0.73 0.00 0.00 175.97 174.85 2yru h VAL 100 N 0.00 0.47 0.57 1.12 -1.51 -1.92 0.25 116.25 115.22 2yru h VAL 100 Ca 0.73 -0.01 -0.02 0.00 -1.23 0.00 0.00 66.70 66.18 2yru h VAL 100 Cb 2.36 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 31.96 2yru h VAL 100 CO -0.39 0.00 -0.43 1.23 -1.23 0.00 0.00 177.57 176.75 2yru h GLY 101 N 0.01 -1.20 -0.44 5.19 0.00 0.18 -1.72 103.07 105.10 2yru h GLY 101 Ca 0.26 0.52 0.13 0.00 0.00 0.00 0.00 47.33 48.25 2yru h GLY 101 CO -0.54 -0.38 -0.22 -2.08 0.00 0.00 0.00 176.54 173.31 2yru h VAL 102 N -0.96 0.25 -0.92 4.60 2.07 -1.39 1.06 116.25 120.97 2yru h VAL 102 Ca -0.07 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.67 2yru h VAL 102 Cb 0.80 0.25 -0.12 0.00 -1.52 0.00 0.00 31.29 30.69 2yru h VAL 102 CO 0.02 0.00 0.44 0.50 0.02 0.00 0.00 177.57 178.55 2yru h LYS 103 N -0.04 0.43 0.06 1.57 3.64 -0.22 0.78 116.57 122.80 2yru h LYS 103 Ca 0.32 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2yru h LYS 103 Cb 0.53 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2yru h LYS 103 CO -0.73 0.29 -0.03 -0.09 -2.27 0.00 0.00 179.45 176.62 2yru h ARG 104 N 0.45 -0.08 -0.91 1.90 9.65 0.17 -3.18 114.38 122.38 2yru h ARG 104 Ca 0.57 0.01 0.15 0.00 -1.10 0.00 0.00 59.98 59.61 2yru h ARG 104 Cb 1.08 0.02 -0.16 0.00 -1.39 0.00 0.00 29.97 29.53 2yru h ARG 104 CO -0.51 0.50 -0.34 1.25 2.80 0.00 0.00 179.97 183.67 2yru h LEU 105 N -0.78 -1.25 -0.22 3.80 6.46 0.19 0.51 115.31 124.02 2yru h LEU 105 Ca -0.01 0.29 0.04 0.00 -0.12 0.00 0.00 57.88 58.08 2yru h LEU 105 Cb 0.62 0.68 -0.07 0.00 -0.73 0.00 0.00 40.66 41.16 2yru h LEU 105 CO 0.01 -0.30 -0.51 0.40 -0.62 0.00 0.00 178.44 177.43 2yru h ILE 106 N -0.03 0.04 -0.49 4.05 2.04 -0.98 1.28 117.51 123.43 2yru h ILE 106 Ca 0.35 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.31 2yru h ILE 106 Cb 0.61 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 36.65 2yru h ILE 106 CO -0.93 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 177.20 2yru h ALA 107 N -0.07 0.44 0.59 1.87 0.00 -0.41 0.86 119.26 122.55 2yru h ALA 107 Ca 0.06 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2yru h ALA 107 Cb 0.65 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2yru h ALA 107 CO -0.48 -0.40 -0.44 0.93 0.00 0.00 0.00 179.25 178.86 2yru h GLU 108 N 0.10 -0.96 -0.47 0.00 4.39 0.17 0.15 114.58 117.95 2yru h GLU 108 Ca 0.24 0.07 0.05 0.00 0.34 0.00 0.00 59.36 60.06 2yru h GLU 108 Cb 0.37 0.22 -0.09 0.00 -0.10 0.00 0.00 28.75 29.15 2yru h GLU 108 CO -0.42 -0.64 -0.56 0.87 -1.16 0.00 0.00 179.01 177.09 2yru h LYS 109 N -1.00 -0.34 -0.61 2.33 1.79 0.22 0.40 116.57 119.35 2yru h LYS 109 Ca -0.07 0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.55 2yru h LYS 109 Cb 0.84 0.08 -0.11 0.00 -1.58 0.00 0.00 32.23 31.46 2yru h LYS 109 CO 0.02 -0.23 -0.05 -0.22 -1.08 0.00 0.00 179.45 177.90 2yru h LYS 110 N -0.36 0.07 -0.54 3.15 3.64 -0.69 0.17 116.57 122.02 2yru h LYS 110 Ca 0.08 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.55 2yru h LYS 110 Cb 0.58 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.30 2yru h LYS 110 CO -0.63 0.05 0.11 1.03 -2.27 0.00 0.00 179.45 177.73 2yru h SER 111 N 0.07 -0.00 -0.03 4.20 0.87 0.23 -1.99 113.55 116.90 2yru h SER 111 Ca 0.31 0.10 0.03 0.00 -1.23 0.00 0.00 61.79 61.00 2yru h SER 111 Cb 0.50 0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 62.54 2yru h SER 111 CO -0.56 0.02 -0.52 -0.07 -0.53 0.00 0.00 176.83 175.17 2yru h LEU 112 N 0.24 -1.62 -0.89 2.23 3.38 0.26 -2.05 115.31 116.87 2yru h LEU 112 Ca 0.28 0.19 0.09 0.00 0.09 0.00 0.00 57.88 58.52 2yru h LEU 112 Cb 0.39 0.62 -0.12 0.00 0.09 0.00 0.00 40.66 41.64 2yru h LEU 112 CO -0.36 -0.51 -0.55 -1.28 0.09 0.00 0.00 178.44 175.83 2yru h SER 113 N -0.64 -2.00 0.00 -0.43 0.87 -0.65 -3.47 113.55 107.24 2yru h SER 113 Ca 0.02 0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 2yru h SER 113 Cb 0.71 0.89 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2yru h SER 113 CO -0.37 -0.27 0.00 0.61 -0.53 0.00 0.00 176.83 176.27 2yru n GLY 114 N -1.30 1.71 0.13 5.77 0.00 -0.77 -4.72 105.19 106.00 2yru n GLY 114 Ca 0.02 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 2yru n GLY 114 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yru h PRO 115 N 0.00 -0.19 -3.35 1.61 0.13 -1.89 -3.46 132.00 124.85 2yru h PRO 115 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2yru h PRO 115 Cb 0.00 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.17 2yru h PRO 115 CO 0.00 0.19 -0.82 0.45 -0.23 0.00 0.00 178.00 177.58 2yru n SER 116 N -4.89 -7.86 0.00 1.44 2.88 -1.26 -4.56 113.62 99.37 2yru n SER 116 Ca -0.06 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 2yru n SER 116 Cb 0.23 -4.26 0.00 0.00 -0.75 0.00 0.00 64.21 59.43 2yru n SER 116 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yru n SER 117 N -1.01 0.00 0.00 -3.46 2.88 -1.26 -5.22 113.62 105.55 2yru n SER 117 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2yru n SER 117 Cb 0.03 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2yru n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42