#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 -5.74 -3.57 1.61 2.88 -1.26 -5.08 113.62 102.46 2yru n SER 2 Ca 0.00 0.94 -0.03 0.00 -1.33 0.00 0.00 58.87 58.46 2yru n SER 2 Cb 0.00 -3.46 0.00 0.00 -0.75 0.00 0.00 64.21 60.00 2yru n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yru s SER 3 N -6.40 -0.09 0.00 -3.46 0.15 -1.26 -5.19 113.70 97.46 2yru s SER 3 Ca 0.00 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2yru s SER 3 Cb 0.00 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 2yru s SER 3 CO 0.00 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.17 2yru n GLY 4 N -0.57 3.96 3.78 9.45 0.00 -1.26 -5.17 105.19 115.38 2yru n GLY 4 Ca -0.05 -1.92 -0.01 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.02 -0.07 1.15 1.61 0.15 -1.26 -5.17 113.70 110.08 2yru s SER 5 Ca 0.00 -0.40 -0.17 0.00 0.70 0.00 0.00 55.95 56.09 2yru s SER 5 Cb 0.00 0.37 0.22 0.00 -1.71 0.00 0.00 66.02 64.90 2yru s SER 5 CO 0.00 -0.71 0.43 -1.20 1.20 0.00 0.00 173.24 172.96 2yru n SER 6 N -0.76 -3.12 -4.21 5.45 7.64 -1.26 -5.04 113.62 112.32 2yru n SER 6 Ca -0.05 -0.45 -0.14 0.00 1.01 0.00 0.00 58.87 59.24 2yru n SER 6 Cb 0.61 -0.88 -0.10 0.00 -1.01 0.00 0.00 64.21 62.83 2yru n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yru s GLY 7 N -2.23 0.95 -0.15 0.23 0.00 -1.26 -5.14 107.32 99.72 2yru s GLY 7 Ca 0.48 -1.34 -0.04 0.00 0.00 0.00 0.00 44.72 43.83 2yru s GLY 7 CO 0.46 -1.42 0.06 0.14 0.00 0.00 0.00 173.10 172.33 2yru s VAL 8 N -2.89 0.17 -0.06 1.40 1.01 -1.26 -5.13 120.40 113.64 2yru s VAL 8 Ca 0.11 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.93 2yru s VAL 8 Cb -0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 2yru s VAL 8 CO 0.00 -0.15 -0.21 -0.63 0.00 0.00 0.00 175.10 174.11 2yru s ILE 9 N 2.03 1.76 -0.29 2.22 1.01 -1.26 -5.11 121.20 121.55 2yru s ILE 9 Ca 0.02 -0.89 -0.25 0.00 0.00 0.00 0.00 60.65 59.53 2yru s ILE 9 Cb -0.16 -1.50 0.17 0.00 0.01 0.00 0.00 42.46 40.99 2yru s ILE 9 CO -0.08 0.49 1.34 -1.83 0.00 0.00 0.00 174.94 174.87 2yru s GLU 10 N 0.02 0.17 0.04 2.79 -1.05 -1.26 -5.08 118.70 114.33 2yru s GLU 10 Ca -0.06 0.21 -0.17 0.00 -0.15 0.00 0.00 54.97 54.80 2yru s GLU 10 Cb -0.13 0.08 0.06 0.00 -0.44 0.00 0.00 34.13 33.70 2yru s GLU 10 CO 0.04 -0.02 0.78 0.45 0.95 0.00 0.00 175.26 177.46 2yru n SER 11 N 1.77 -0.95 0.31 0.83 2.88 -1.26 -4.99 113.62 112.21 2yru n SER 11 Ca -0.11 -1.35 0.19 0.00 -1.33 0.00 0.00 58.87 56.27 2yru n SER 11 Cb 0.57 1.50 1.00 0.00 -0.75 0.00 0.00 64.21 66.53 2yru n SER 11 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2yru h GLU 12 N 0.00 0.00 -4.31 -1.46 5.08 -2.03 -3.48 114.58 108.39 2yru h GLU 12 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2yru h GLU 12 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2yru h GLU 12 CO 0.22 0.02 -0.98 2.41 -1.00 0.00 0.00 179.01 179.68 2yru n THR 13 N -3.28 -9.78 -4.08 1.13 -1.04 -1.26 -4.91 114.28 91.06 2yru n THR 13 Ca -0.02 3.11 -0.29 0.00 -2.04 0.00 0.00 64.05 64.81 2yru n THR 13 Cb 0.14 -4.55 -0.06 0.00 -1.82 0.00 0.00 70.33 64.04 2yru n THR 13 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2yru s LEU 14 N -1.30 3.72 0.08 -4.42 1.43 -1.26 -5.02 118.68 111.91 2yru s LEU 14 Ca 0.00 -0.09 -0.22 0.00 -1.03 0.00 0.00 54.13 52.78 2yru s LEU 14 Cb 0.00 -2.39 -0.13 0.00 0.03 0.00 0.00 46.19 43.69 2yru s LEU 14 CO 0.00 0.14 1.66 -0.29 0.23 0.00 0.00 176.35 178.09 2yru h ILE 15 N 2.46 1.09 0.00 -0.59 2.10 -1.98 -0.43 117.51 120.15 2yru h ILE 15 Ca -0.47 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.21 2yru h ILE 15 Cb 1.18 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 38.05 2yru h ILE 15 CO 0.64 0.08 0.00 -0.33 -1.08 0.00 0.00 178.15 177.45 2yru h GLU 16 N 0.00 0.00 0.09 2.19 4.39 -1.96 0.50 114.58 119.79 2yru h GLU 16 Ca 0.02 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.45 2yru h GLU 16 Cb 0.09 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2yru h GLU 16 CO -0.00 0.00 -1.28 -0.44 -1.16 0.00 0.00 179.01 176.12 2yru h ASP 17 N 0.00 0.28 1.01 1.42 5.19 -1.62 0.35 116.42 123.05 2yru h ASP 17 Ca 0.00 -0.33 -0.03 0.00 -0.62 0.00 0.00 57.03 56.04 2yru h ASP 17 Cb 0.25 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 2yru h ASP 17 CO 0.00 1.27 -1.01 0.58 -3.12 0.00 0.00 179.24 176.96 2yru h VAL 18 N 0.05 0.11 0.09 -1.35 2.07 0.04 -3.35 116.25 113.91 2yru h VAL 18 Ca -0.14 -1.20 -0.34 0.00 0.82 0.00 0.00 66.70 65.83 2yru h VAL 18 Cb 1.94 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 33.32 2yru h VAL 18 CO 0.17 0.06 -1.90 0.18 0.02 0.00 0.00 177.57 176.09 2yru n LEU 19 N -2.75 2.11 -0.35 2.57 7.99 0.16 -3.35 117.00 123.38 2yru n LEU 19 Ca -0.02 0.28 0.02 0.00 -0.01 0.00 0.00 56.01 56.28 2yru n LEU 19 Cb 0.61 -0.74 0.08 0.00 -0.11 0.00 0.00 43.42 43.26 2yru n LEU 19 CO 0.40 0.72 0.58 0.54 -1.51 0.00 0.00 177.39 178.12 2yru n ARG 20 N -3.36 -0.16 0.07 3.23 5.12 0.12 0.20 116.66 121.89 2yru n ARG 20 Ca -0.27 1.46 -0.07 0.00 -1.93 0.00 0.00 57.85 57.04 2yru n ARG 20 Cb 1.05 -2.17 -0.04 0.00 -1.16 0.00 0.00 32.46 30.13 2yru n ARG 20 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2yru h PRO 21 N 0.00 -0.26 -1.21 5.56 0.13 -1.74 0.27 132.00 134.75 2yru h PRO 21 Ca 0.38 0.02 0.35 0.00 -0.87 0.00 0.00 66.00 65.88 2yru h PRO 21 Cb 0.62 0.06 -0.05 0.00 0.13 0.00 0.00 31.00 31.76 2yru h PRO 21 CO -0.95 -0.02 1.00 -0.07 -0.23 0.00 0.00 178.00 177.72 2yru h LEU 22 N -1.02 0.00 0.07 1.56 3.38 -1.34 1.16 115.31 119.11 2yru h LEU 22 Ca -0.03 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.72 2yru h LEU 22 Cb 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2yru h LEU 22 CO 0.05 0.00 -1.14 -0.33 0.09 0.00 0.00 178.44 177.11 2yru h GLU 23 N 0.00 0.16 0.00 1.13 5.08 0.23 -3.08 114.58 118.10 2yru h GLU 23 Ca 0.58 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 2yru h GLU 23 Cb 2.56 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 31.91 2yru h GLU 23 CO -0.01 1.13 -0.10 -0.56 -1.00 0.00 0.00 179.01 178.47 2yru h GLN 24 N -0.56 0.00 0.01 2.33 3.07 0.24 -2.42 115.11 117.78 2yru h GLN 24 Ca -0.26 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.48 2yru h GLN 24 Cb 1.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.10 2yru h GLN 24 CO -0.00 0.10 -0.01 0.00 0.09 0.00 0.00 178.83 179.01 2yru h ALA 25 N 1.90 -0.02 -0.33 0.06 0.00 0.90 -3.00 119.26 118.77 2yru h ALA 25 Ca -0.00 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2yru h ALA 25 Cb 0.20 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 2yru h ALA 25 CO 0.01 -0.23 -0.48 1.25 0.00 0.00 0.00 179.25 179.80 2yru h LEU 26 N -0.58 -1.60 -0.91 0.00 5.85 -1.34 0.19 115.31 116.93 2yru h LEU 26 Ca -0.00 0.21 0.24 0.00 0.84 0.00 0.00 57.88 59.17 2yru h LEU 26 Cb 0.56 0.65 -0.16 0.00 0.37 0.00 0.00 40.66 42.08 2yru h LEU 26 CO 0.00 -0.36 0.10 -0.33 -0.34 0.00 0.00 178.44 177.52 2yru h GLU 27 N -0.36 0.09 -0.91 1.25 5.08 -1.56 1.57 114.58 119.74 2yru h GLU 27 Ca 0.06 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.51 2yru h GLU 27 Cb 0.52 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.68 2yru h GLU 27 CO -0.50 0.06 0.56 0.22 -1.00 0.00 0.00 179.01 178.34 2yru h ASP 28 N 0.09 0.83 -0.27 1.42 1.82 -0.53 -0.36 116.42 119.42 2yru h ASP 28 Ca 0.55 0.04 -0.13 0.00 -0.39 0.00 0.00 57.03 57.10 2yru h ASP 28 Cb 1.12 -0.13 -0.00 0.00 0.68 0.00 0.00 39.33 41.00 2yru h ASP 28 CO -0.78 0.48 -0.36 0.00 -1.61 0.00 0.00 179.24 176.97 2yru h HIS 30 N 0.46 -1.09 -0.96 0.00 6.17 0.18 1.16 115.15 121.07 2yru h HIS 30 Ca 0.03 0.09 -0.48 0.00 0.71 0.00 0.00 60.37 60.73 2yru h HIS 30 Cb 0.94 0.59 -0.17 0.00 2.52 0.00 0.00 27.41 31.29 2yru h HIS 30 CO 0.08 -0.40 0.43 0.41 0.71 0.00 0.00 177.93 179.16 2yru n GLY 31 N -1.44 4.37 0.45 5.26 0.00 -0.85 -4.43 105.19 108.55 2yru n GLY 31 Ca 0.07 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 0.67 -0.57 -1.92 1.61 -0.00 0.17 -5.01 115.22 110.18 2yru n HIS 32 Ca 0.46 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.83 2yru n HIS 32 Cb 0.55 0.11 0.04 0.00 -0.00 0.00 0.00 29.99 30.70 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 -0.36 2.81 1.06 1.59 2.01 0.35 -4.97 115.64 118.12 2yru s THR 33 Ca 0.00 0.46 -0.22 0.00 0.31 0.00 0.00 61.69 62.24 2yru s THR 33 Cb 0.00 -3.10 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 2yru s THR 33 CO 0.00 -0.15 -0.60 0.29 -0.69 0.00 0.00 174.62 173.47 2yru n LYS 34 N -1.88 -1.01 -0.04 4.92 5.02 -1.26 -4.58 118.16 119.32 2yru n LYS 34 Ca 0.13 -0.29 -0.18 0.00 -2.02 0.00 0.00 58.31 55.95 2yru n LYS 34 Cb 0.50 -1.39 -0.13 0.00 -0.02 0.00 0.00 35.03 33.99 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 -1.70 0.09 -0.96 1.97 1.63 -1.93 -2.44 116.57 113.24 2yru h LYS 35 Ca -0.45 -0.16 0.23 0.00 -0.85 0.00 0.00 60.65 59.42 2yru h LYS 35 Cb 1.31 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.92 2yru h LYS 35 CO 0.29 1.08 0.63 1.96 -3.45 0.00 0.00 179.45 179.96 2yru h GLN 36 N -0.78 0.37 0.08 1.90 1.08 -1.97 1.34 115.11 117.12 2yru h GLN 36 Ca -0.13 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.05 2yru h GLN 36 Cb 1.28 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 2yru h GLN 36 CO 0.00 0.24 -0.04 0.28 -0.95 0.00 0.00 178.83 178.37 2yru h VAL 37 N 0.38 0.89 -0.91 -0.54 2.07 -1.92 -2.07 116.25 114.15 2yru h VAL 37 Ca 0.51 -1.42 0.14 0.00 0.82 0.00 0.00 66.70 66.75 2yru h VAL 37 Cb 1.33 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 32.61 2yru h VAL 37 CO -0.20 0.27 0.51 0.00 0.02 0.00 0.00 177.57 178.17 2yru h ASP 39 N 0.75 0.18 0.41 0.00 3.32 0.17 0.51 116.42 121.76 2yru h ASP 39 Ca 0.48 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.47 2yru h ASP 39 Cb 0.62 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2yru h ASP 39 CO -0.33 0.36 -0.20 -0.78 -1.72 0.00 0.00 179.24 176.57 2yru h ASP 40 N 0.18 -0.46 -0.01 6.45 3.58 0.12 -2.19 116.42 124.09 2yru h ASP 40 Ca 0.04 0.02 0.02 0.00 0.42 0.00 0.00 57.03 57.52 2yru h ASP 40 Cb 0.39 0.12 -0.05 0.00 1.72 0.00 0.00 39.33 41.51 2yru h ASP 40 CO 0.02 -0.07 -0.48 0.40 -2.88 0.00 0.00 179.24 176.24 2yru h ILE 41 N -1.07 0.00 -0.83 2.25 2.04 -0.31 -1.63 117.51 117.95 2yru h ILE 41 Ca -0.06 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.93 2yru h ILE 41 Cb 0.42 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.36 2yru h ILE 41 CO 0.09 0.00 -0.40 0.77 0.00 0.00 0.00 178.15 178.62 2yru h SER 42 N -0.59 -1.43 -1.34 1.72 4.64 -1.02 1.37 113.55 116.91 2yru h SER 42 Ca 0.01 0.28 0.42 0.00 -0.47 0.00 0.00 61.79 62.03 2yru h SER 42 Cb 0.63 0.71 -0.11 0.00 -0.31 0.00 0.00 62.40 63.33 2yru h SER 42 CO -0.33 -0.30 0.89 0.03 -0.87 0.00 0.00 176.83 176.26 2yru h ARG 43 N -0.07 0.11 0.07 4.77 3.08 -0.63 0.52 114.38 122.22 2yru h ARG 43 Ca 0.28 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 2yru h ARG 43 Cb 0.57 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2yru h ARG 43 CO -0.86 0.07 -0.03 0.00 -1.07 0.00 0.00 179.97 178.08 2yru h ARG 44 N 0.11 -0.09 -0.84 0.04 2.47 0.22 -3.20 114.38 113.10 2yru h ARG 44 Ca 0.78 0.01 0.16 0.00 -1.26 0.00 0.00 59.98 59.67 2yru h ARG 44 Cb 2.53 0.02 -0.16 0.00 -1.65 0.00 0.00 29.97 30.71 2yru h ARG 44 CO -0.32 0.43 -0.24 -0.07 0.56 0.00 0.00 179.97 180.34 2yru h LEU 45 N -0.67 -0.87 -0.79 3.04 3.38 0.76 1.24 115.31 121.40 2yru h LEU 45 Ca -0.01 0.26 0.18 0.00 0.09 0.00 0.00 57.88 58.40 2yru h LEU 45 Cb 0.56 0.55 -0.12 0.00 0.09 0.00 0.00 40.66 41.74 2yru h LEU 45 CO 0.01 -0.28 0.22 0.00 0.09 0.00 0.00 178.44 178.48 2yru h ALA 46 N 1.74 1.08 -0.40 1.53 0.00 -1.38 0.49 119.26 122.31 2yru h ALA 46 Ca 0.39 0.18 -0.13 0.00 0.00 0.00 0.00 54.91 55.35 2yru h ALA 46 Cb 0.61 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2yru h ALA 46 CO -0.87 -0.35 -0.24 1.25 0.00 0.00 0.00 179.25 179.04 2yru h LEU 47 N 0.28 0.91 0.42 0.00 6.46 0.13 -1.43 115.31 122.08 2yru h LEU 47 Ca 0.46 -0.42 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 2yru h LEU 47 Cb 0.83 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 2yru h LEU 47 CO -0.54 1.13 -0.41 0.25 -0.62 0.00 0.00 178.44 178.25 2yru h LEU 48 N 0.69 -1.11 0.12 2.25 5.85 0.41 0.19 115.31 123.70 2yru h LEU 48 Ca 0.08 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.90 2yru h LEU 48 Cb 0.81 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 2yru h LEU 48 CO 0.07 -0.54 -0.49 -0.09 -0.34 0.00 0.00 178.44 177.05 2yru h ARG 49 N -0.82 -0.68 -0.81 1.25 2.43 -0.30 0.63 114.38 116.08 2yru h ARG 49 Ca -0.05 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.29 2yru h ARG 49 Cb 0.71 0.15 -0.14 0.00 -0.42 0.00 0.00 29.97 30.27 2yru h ARG 49 CO -0.04 -0.45 -0.38 0.93 -1.51 0.00 0.00 179.97 178.51 2yru h GLU 50 N -0.70 -0.08 -0.84 0.20 4.39 -1.17 1.69 114.58 118.07 2yru h GLU 50 Ca -0.01 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2yru h GLU 50 Cb 0.70 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.33 2yru h GLU 50 CO -0.26 -0.05 0.51 1.96 -1.16 0.00 0.00 179.01 180.01 2yru h GLN 51 N -0.08 1.14 0.23 2.33 4.20 0.03 1.15 115.11 124.11 2yru h GLN 51 Ca 0.28 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2yru h GLN 51 Cb 0.57 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2yru h GLN 51 CO -0.85 0.80 -0.11 2.35 -0.67 0.00 0.00 178.83 180.35 2yru h TRP 52 N 1.16 -0.29 0.03 2.96 2.91 0.64 0.11 115.95 123.47 2yru h TRP 52 Ca 0.30 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.34 2yru h TRP 52 Cb -0.05 0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 28.64 2yru h TRP 52 CO 0.00 -0.18 -0.50 0.00 -1.03 0.00 0.00 178.44 176.74 2yru h ALA 53 N -1.77 -0.87 -0.95 2.65 0.00 0.22 0.11 119.26 118.64 2yru h ALA 53 Ca -0.03 -0.08 0.39 0.00 0.00 0.00 0.00 54.91 55.19 2yru h ALA 53 Cb 0.24 0.87 -0.17 0.00 0.00 0.00 0.00 17.79 18.73 2yru h ALA 53 CO 0.05 -1.07 0.48 0.41 0.00 0.00 0.00 179.25 179.12 2yru n GLY 54 N -1.47 -0.75 0.00 0.00 0.00 0.40 -4.74 105.19 98.62 2yru n GLY 54 Ca -0.07 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.73 2yru n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yru n GLY 55 N -1.26 1.07 0.19 -0.02 0.00 0.02 -4.97 105.19 100.22 2yru n GLY 55 Ca 0.35 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.43 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 2.58 0.00 -7.02 1.61 6.56 -1.00 -3.44 116.57 115.86 2yru h LYS 56 Ca 0.00 0.00 -0.48 0.00 -1.06 0.00 0.00 60.65 59.11 2yru h LYS 56 Cb 0.00 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 31.69 2yru h LYS 56 CO 0.00 0.38 0.41 -0.51 -2.06 0.00 0.00 179.45 177.67 2yru s LEU 57 N -7.07 3.97 0.38 2.94 1.43 -0.93 -4.98 118.68 114.42 2yru s LEU 57 Ca 0.00 2.04 -0.20 0.00 -1.03 0.00 0.00 54.13 54.94 2yru s LEU 57 Cb 0.11 -4.37 -0.10 0.00 0.03 0.00 0.00 46.19 41.85 2yru s LEU 57 CO 0.69 -0.72 0.89 -0.44 0.23 0.00 0.00 176.35 177.00 2yru s SER 58 N -1.72 6.95 0.20 2.29 0.01 -1.26 -4.94 113.70 115.22 2yru s SER 58 Ca 0.64 1.60 -0.11 0.00 1.31 0.00 0.00 55.95 59.38 2yru s SER 58 Cb -0.21 -2.50 0.22 0.00 0.21 0.00 0.00 66.02 63.75 2yru s SER 58 CO 0.25 -0.27 1.77 0.40 0.41 0.00 0.00 173.24 175.80 2yru h ILE 59 N 2.04 0.86 0.00 1.44 2.04 -1.95 0.38 117.51 122.31 2yru h ILE 59 Ca -0.48 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2yru h ILE 59 Cb 1.18 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2yru h ILE 59 CO 0.63 0.09 0.00 -0.81 0.00 0.00 0.00 178.15 178.05 2yru n PRO 60 N -4.94 0.33 0.07 2.37 -0.04 -1.26 -2.16 135.00 129.38 2yru n PRO 60 Ca 0.07 0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.70 2yru n PRO 60 Cb 0.21 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.13 2yru n PRO 60 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2yru n VAL 61 N -1.28 0.59 -0.07 0.52 0.31 0.12 -3.30 118.33 115.21 2yru n VAL 61 Ca 0.11 -0.56 -0.21 0.00 -0.01 0.00 0.00 64.34 63.66 2yru n VAL 61 Cb 0.18 -0.33 -0.12 0.00 -0.91 0.00 0.00 33.84 32.66 2yru n VAL 61 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2yru h LYS 62 N 0.00 0.07 -0.09 5.55 1.57 -0.69 -2.85 116.57 120.12 2yru h LYS 62 Ca -0.03 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2yru h LYS 62 Cb 1.10 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 2yru h LYS 62 CO 0.01 1.05 0.07 0.87 -0.57 0.00 0.00 179.45 180.88 2yru h LYS 63 N -0.77 0.00 0.03 3.15 1.57 -1.61 -1.51 116.57 117.43 2yru h LYS 63 Ca -0.33 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.33 2yru h LYS 63 Cb 1.44 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.76 2yru h LYS 63 CO -0.12 0.00 -0.51 -0.09 -0.57 0.00 0.00 179.45 178.16 2yru h ARG 64 N 0.00 0.29 0.20 3.15 2.43 -1.68 -3.32 114.38 115.45 2yru h ARG 64 Ca 0.04 -0.35 0.01 0.00 -0.81 0.00 0.00 59.98 58.87 2yru h ARG 64 Cb 0.19 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 2yru h ARG 64 CO -0.00 1.08 -0.45 0.52 -1.51 0.00 0.00 179.97 179.60 2yru h MET 65 N -0.35 -0.71 -1.43 0.20 2.86 -1.07 -0.00 114.93 114.43 2yru h MET 65 Ca -0.07 0.05 0.48 0.00 -2.06 0.00 0.00 59.70 58.10 2yru h MET 65 Cb 1.28 0.16 -0.13 0.00 0.06 0.00 0.00 31.60 32.97 2yru h MET 65 CO 0.10 -0.47 0.93 0.00 1.06 0.00 0.00 176.91 178.52 2yru n ALA 66 N -2.84 1.41 0.35 6.32 0.00 -0.66 0.63 120.51 125.73 2yru n ALA 66 Ca -0.08 0.84 -0.14 0.00 0.00 0.00 0.00 53.44 54.06 2yru n ALA 66 Cb 0.40 -1.06 -0.07 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.77 -1.60 0.00 3.38 -1.09 0.86 115.31 116.09 2yru h LEU 67 Ca 0.88 0.03 0.32 0.00 0.09 0.00 0.00 57.88 59.20 2yru h LEU 67 Cb 2.91 0.20 -0.08 0.00 0.09 0.00 0.00 40.66 43.77 2yru h LEU 67 CO -0.42 -0.51 0.77 0.25 0.09 0.00 0.00 178.44 178.62 2yru h LEU 68 N -0.98 0.26 0.39 1.67 6.46 0.43 0.30 115.31 123.83 2yru h LEU 68 Ca -0.09 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 2yru h LEU 68 Cb 0.70 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 2yru h LEU 68 CO 0.15 0.02 -0.18 0.58 -0.62 0.00 0.00 178.44 178.39 2yru h VAL 69 N 0.21 0.00 -1.18 1.05 2.07 -0.60 -2.60 116.25 115.20 2yru h VAL 69 Ca 0.62 -0.62 0.42 0.00 0.82 0.00 0.00 66.70 67.95 2yru h VAL 69 Cb 1.96 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.58 2yru h VAL 69 CO -0.21 0.00 0.71 1.56 0.02 0.00 0.00 177.57 179.65 2yru h GLN 70 N -1.13 0.07 0.08 1.57 1.08 0.26 0.84 115.11 117.88 2yru h GLN 70 Ca -0.05 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2yru h GLN 70 Cb 0.40 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 2yru h GLN 70 CO 0.09 0.04 -0.04 0.93 -0.95 0.00 0.00 178.83 178.90 2yru h GLU 71 N 0.07 -0.11 -0.40 1.46 4.39 -1.04 -2.27 114.58 116.69 2yru h GLU 71 Ca 0.83 0.01 0.11 0.00 0.34 0.00 0.00 59.36 60.66 2yru h GLU 71 Cb 2.40 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 31.06 2yru h GLU 71 CO -0.58 0.23 0.36 1.25 -1.16 0.00 0.00 179.01 179.11 2yru h LEU 72 N -0.45 0.00 -0.14 1.33 6.46 0.10 0.76 115.31 123.38 2yru h LEU 72 Ca -0.01 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.67 2yru h LEU 72 Cb 0.38 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.31 2yru h LEU 72 CO 0.02 0.00 -0.20 -0.07 -0.62 0.00 0.00 178.44 177.57 2yru h LEU 73 N 0.00 0.42 0.00 2.25 3.38 -0.60 -2.66 115.31 118.10 2yru h LEU 73 Ca 0.19 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2yru h LEU 73 Cb 0.90 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2yru h LEU 73 CO -0.00 0.86 0.00 1.41 0.09 0.00 0.00 178.44 180.80 2yru n HIS 74 N -4.49 0.00 -0.35 1.13 8.25 0.58 -4.83 115.22 115.50 2yru n HIS 74 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2yru n HIS 74 Cb 0.41 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.43 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 -1.09 0.00 -1.20 4.41 8.25 0.85 -4.94 115.22 121.51 2yru n HIS 75 Ca 0.20 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.29 2yru n HIS 75 Cb 0.14 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.17 2yru n HIS 75 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2yru n GLN 76 N -2.00 0.92 -0.10 -0.41 1.13 0.23 -4.56 117.38 112.59 2yru n GLN 76 Ca 0.00 -1.72 -0.09 0.00 -1.94 0.00 0.00 57.00 53.25 2yru n GLN 76 Cb 0.00 -3.09 0.05 0.00 0.11 0.00 0.00 30.24 27.31 2yru n GLN 76 CO 0.00 0.00 0.00 -1.49 -1.44 0.00 0.00 177.06 174.13 2yru h TRP 77 N 9.32 0.95 -0.90 1.08 4.06 -1.91 -0.95 115.95 127.61 2yru h TRP 77 Ca 0.28 -0.24 0.11 0.00 2.06 0.00 0.00 58.89 61.11 2yru h TRP 77 Cb 0.77 -0.22 -0.08 0.00 -1.00 0.00 0.00 29.16 28.63 2yru h TRP 77 CO 1.14 1.00 0.53 0.22 -3.56 0.00 0.00 178.44 177.77 2yru h ASP 78 N 0.70 0.75 0.06 -3.49 1.82 -1.96 -1.21 116.42 113.10 2yru h ASP 78 Ca 0.09 0.05 -0.00 0.00 -0.39 0.00 0.00 57.03 56.78 2yru h ASP 78 Cb 0.81 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.73 2yru h ASP 78 CO 0.07 0.41 -0.03 0.00 -1.61 0.00 0.00 179.24 178.08 2yru h ALA 79 N 1.50 -0.08 -1.00 -0.78 0.00 -1.85 -2.02 119.26 115.04 2yru h ALA 79 Ca 0.44 -0.25 0.15 0.00 0.00 0.00 0.00 54.91 55.25 2yru h ALA 79 Cb 0.45 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.11 2yru h ALA 79 CO -0.27 -0.28 -0.42 0.00 0.00 0.00 0.00 179.25 178.28 2yru h ALA 80 N 0.26 0.06 -0.41 0.00 0.00 -0.40 0.99 119.26 119.76 2yru h ALA 80 Ca -0.01 0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2yru h ALA 80 Cb 0.52 1.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 2yru h ALA 80 CO 0.01 -0.67 0.25 0.22 0.00 0.00 0.00 179.25 179.06 2yru h ASP 81 N -0.00 0.48 -0.17 0.00 1.82 -1.27 0.95 116.42 118.23 2yru h ASP 81 Ca 0.32 -0.04 0.02 0.00 -0.39 0.00 0.00 57.03 56.94 2yru h ASP 81 Cb 0.57 -0.12 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 2yru h ASP 81 CO -0.98 0.38 -0.20 -0.78 -1.61 0.00 0.00 179.24 176.05 2yru h ASP 82 N 0.54 -0.66 -0.11 2.28 3.58 0.17 0.38 116.42 122.59 2yru h ASP 82 Ca 0.15 0.09 0.04 0.00 0.42 0.00 0.00 57.03 57.73 2yru h ASP 82 Cb -0.02 0.27 -0.05 0.00 1.72 0.00 0.00 39.33 41.26 2yru h ASP 82 CO -0.03 -0.13 -0.18 0.40 -2.88 0.00 0.00 179.24 176.42 2yru h ILE 83 N -0.12 0.54 0.00 2.25 2.04 -0.77 -2.33 117.51 119.12 2yru h ILE 83 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2yru h ILE 83 Cb 0.20 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2yru h ILE 83 CO -0.22 0.00 0.00 1.57 0.00 0.00 0.00 178.15 179.50 2yru n HIS 84 N -5.32 0.00 -0.28 1.37 -0.00 0.32 0.76 115.22 112.07 2yru n HIS 84 Ca -0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.62 2yru n HIS 84 Cb 0.24 -0.49 -0.07 0.00 -0.00 0.00 0.00 29.99 29.67 2yru n HIS 84 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2yru n ARG 85 N -2.94 -0.29 -0.35 1.57 5.12 0.12 0.18 116.66 120.08 2yru n ARG 85 Ca 0.00 1.32 0.25 0.00 -1.93 0.00 0.00 57.85 57.50 2yru n ARG 85 Cb 0.00 -1.96 0.53 0.00 -1.16 0.00 0.00 32.46 29.87 2yru n ARG 85 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 2yru h SER 86 N 0.00 0.42 0.10 0.55 0.02 -0.69 1.80 113.55 115.74 2yru h SER 86 Ca 0.11 0.10 -0.16 0.00 -0.84 0.00 0.00 61.79 61.00 2yru h SER 86 Cb 0.27 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2yru h SER 86 CO -0.62 0.02 -0.56 -0.07 -1.14 0.00 0.00 176.83 174.46 2yru h LEU 87 N 0.34 0.54 -0.03 5.07 3.38 0.80 -2.63 115.31 122.77 2yru h LEU 87 Ca 0.65 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2yru h LEU 87 Cb 1.72 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.31 2yru h LEU 87 CO -0.35 0.98 -0.26 0.80 0.09 0.00 0.00 178.44 179.71 2yru n MET 88 N -3.94 0.09 -0.04 1.13 1.56 0.46 -1.73 117.12 114.65 2yru n MET 88 Ca -0.03 -0.03 -0.03 0.00 -0.27 0.00 0.00 57.70 57.34 2yru n MET 88 Cb 0.60 -1.50 -0.02 0.00 2.15 0.00 0.00 33.22 34.45 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 0.08 0.30 0.00 1.12 2.07 0.24 -3.33 116.25 116.74 2yru h VAL 89 Ca 0.00 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.32 2yru h VAL 89 Cb 0.49 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2yru h VAL 89 CO 0.00 0.10 -0.14 -0.78 0.02 0.00 0.00 177.57 176.77 2yru h ASP 90 N -1.00 0.00 0.00 0.57 3.58 -1.61 -3.39 116.42 114.57 2yru h ASP 90 Ca -0.00 0.00 -0.68 0.00 0.42 0.00 0.00 57.03 56.77 2yru h ASP 90 Cb 0.18 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.25 2yru h ASP 90 CO 0.00 0.30 3.76 1.41 -2.88 0.00 0.00 179.24 181.83 2yru n HIS 91 N -3.30 2.59 0.13 0.28 -0.00 -0.70 -4.40 115.22 109.82 2yru n HIS 91 Ca -0.02 -3.08 0.04 0.00 -0.00 0.00 0.00 57.72 54.66 2yru n HIS 91 Cb 0.07 -2.51 0.03 0.00 -0.00 0.00 0.00 29.99 27.58 2yru n HIS 91 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.34 176.10 2yru h VAL 92 N 3.15 0.62 -0.00 1.59 3.04 -1.67 -0.99 116.25 122.00 2yru h VAL 92 Ca 0.83 -1.92 0.00 0.00 -1.01 0.00 0.00 66.70 64.60 2yru h VAL 92 Cb 0.34 2.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.86 2yru h VAL 92 CO 1.81 0.35 -0.22 0.41 -1.01 0.00 0.00 177.57 178.90 2yru n THR 93 N -3.12 0.00 -0.08 3.17 -1.04 -1.26 -3.75 114.28 108.19 2yru n THR 93 Ca 0.00 -0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 2yru n THR 93 Cb 0.71 -0.16 -0.05 0.00 -1.82 0.00 0.00 70.33 69.01 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 -1.48 0.45 -1.23 -2.82 -0.58 -1.18 -4.58 120.64 109.21 2yru n GLU 94 Ca 0.07 0.19 -0.21 0.00 -0.42 0.00 0.00 57.16 56.78 2yru n GLU 94 Cb 0.34 -1.27 -0.11 0.00 -0.57 0.00 0.00 31.44 29.82 2yru n GLU 94 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 2yru n VAL 95 N -4.18 3.41 -4.23 2.62 0.24 -0.38 -4.83 118.33 110.97 2yru n VAL 95 Ca -0.24 -2.22 -0.14 0.00 -2.04 0.00 0.00 64.34 59.70 2yru n VAL 95 Cb 0.58 -1.98 -0.10 0.00 -1.47 0.00 0.00 33.84 30.86 2yru n VAL 95 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2yru s SER 96 N 1.49 1.70 -0.15 -1.34 1.04 -1.25 -4.02 113.70 111.17 2yru s SER 96 Ca 0.64 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2yru s SER 96 Cb 0.31 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2yru s SER 96 CO -0.07 -0.33 0.00 0.00 0.98 0.00 0.00 173.24 173.82 2yru n GLN 97 N -0.05 -0.51 0.00 4.02 6.02 -1.26 -4.46 117.38 121.14 2yru n GLN 97 Ca -0.11 0.28 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2yru n GLN 97 Cb 0.60 -3.77 0.00 0.00 1.02 0.00 0.00 30.24 28.09 2yru n GLN 97 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.06 173.38 2yru n TRP 98 N -2.75 -1.67 -0.62 1.08 4.27 -1.26 -4.82 117.44 111.66 2yru n TRP 98 Ca -0.01 0.00 0.47 0.00 -3.89 0.00 0.00 57.50 54.06 2yru n TRP 98 Cb 0.15 0.33 0.72 0.00 -1.36 0.00 0.00 31.31 31.15 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 -2.20 -0.00 -0.05 -2.67 1.56 -1.26 0.21 117.12 112.70 2yru n MET 99 Ca 0.00 0.97 -0.08 0.00 -0.27 0.00 0.00 57.70 58.32 2yru n MET 99 Cb 0.00 -2.21 -0.02 0.00 2.15 0.00 0.00 33.22 33.14 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 0.83 0.45 1.12 -1.51 -1.91 -0.90 116.25 114.33 2yru h VAL 100 Ca 0.83 -0.02 -0.02 0.00 -1.23 0.00 0.00 66.70 66.26 2yru h VAL 100 Cb 3.30 0.75 -0.00 0.00 -2.13 0.00 0.00 31.29 33.21 2yru h VAL 100 CO -0.03 0.01 -0.30 1.23 -1.23 0.00 0.00 177.57 177.25 2yru h GLY 101 N 0.07 -0.96 -1.00 5.19 0.00 0.22 -2.75 103.07 103.84 2yru h GLY 101 Ca 0.11 0.40 0.16 0.00 0.00 0.00 0.00 47.33 48.01 2yru h GLY 101 CO -0.19 -0.32 -0.36 -2.08 0.00 0.00 0.00 176.54 173.58 2yru h VAL 102 N -0.72 0.00 -0.91 4.60 2.07 -1.49 1.21 116.25 121.02 2yru h VAL 102 Ca -0.06 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.65 2yru h VAL 102 Cb 0.58 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.18 2yru h VAL 102 CO 0.05 0.00 -0.18 0.50 0.02 0.00 0.00 177.57 177.95 2yru h LYS 103 N -0.00 0.01 0.05 1.57 3.64 -0.95 0.32 116.57 121.21 2yru h LYS 103 Ca 0.37 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2yru h LYS 103 Cb 0.62 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2yru h LYS 103 CO -1.00 0.00 -0.02 -0.09 -2.27 0.00 0.00 179.45 176.07 2yru h ARG 104 N 0.01 -0.06 -0.81 1.90 9.65 0.16 -3.07 114.38 122.15 2yru h ARG 104 Ca 0.45 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 59.45 2yru h ARG 104 Cb 0.73 0.01 -0.13 0.00 -1.39 0.00 0.00 29.97 29.19 2yru h ARG 104 CO -0.92 0.27 -0.44 1.25 2.80 0.00 0.00 179.97 182.94 2yru h LEU 105 N -0.40 -1.58 -0.56 3.80 5.85 0.24 0.33 115.31 123.00 2yru h LEU 105 Ca -0.01 0.28 0.07 0.00 0.84 0.00 0.00 57.88 59.07 2yru h LEU 105 Cb 0.36 0.75 -0.10 0.00 0.37 0.00 0.00 40.66 42.05 2yru h LEU 105 CO 0.01 -0.30 -0.49 0.40 -0.34 0.00 0.00 178.44 177.72 2yru h ILE 106 N -0.10 0.05 -0.33 4.05 2.04 -0.74 1.18 117.51 123.67 2yru h ILE 106 Ca 0.24 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.17 2yru h ILE 106 Cb 0.55 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 36.60 2yru h ILE 106 CO -0.84 0.00 -0.20 0.00 0.00 0.00 0.00 178.15 177.10 2yru h ALA 107 N 0.38 0.01 0.43 1.87 0.00 -0.52 0.42 119.26 121.86 2yru h ALA 107 Ca 0.14 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2yru h ALA 107 Cb 0.56 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2yru h ALA 107 CO -0.68 -0.60 -0.42 0.93 0.00 0.00 0.00 179.25 178.48 2yru h GLU 108 N -0.16 -0.82 -0.76 0.00 4.39 0.22 0.27 114.58 117.71 2yru h GLU 108 Ca 0.17 0.06 0.17 0.00 0.34 0.00 0.00 59.36 60.09 2yru h GLU 108 Cb 0.42 0.19 -0.14 0.00 -0.10 0.00 0.00 28.75 29.12 2yru h GLU 108 CO -0.43 -0.55 -0.04 0.87 -1.16 0.00 0.00 179.01 177.71 2yru h LYS 109 N -0.85 0.07 0.49 2.33 1.79 0.17 0.17 116.57 120.74 2yru h LYS 109 Ca -0.05 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 2yru h LYS 109 Cb 0.73 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.34 2yru h LYS 109 CO -0.04 0.05 -0.47 -0.22 -1.08 0.00 0.00 179.45 177.68 2yru h LYS 110 N 0.07 -0.93 -0.68 3.15 3.64 0.38 -2.00 116.57 120.20 2yru h LYS 110 Ca 0.41 0.06 0.12 0.00 -1.27 0.00 0.00 60.65 59.97 2yru h LYS 110 Cb 0.70 0.21 -0.13 0.00 -0.41 0.00 0.00 32.23 32.60 2yru h LYS 110 CO -0.70 -0.62 -0.29 1.03 -2.27 0.00 0.00 179.45 176.60 2yru h SER 111 N -0.97 -1.03 -0.56 4.20 0.87 0.16 0.37 113.55 116.60 2yru h SER 111 Ca -0.06 0.23 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 2yru h SER 111 Cb 0.84 0.55 -0.10 0.00 -0.44 0.00 0.00 62.40 63.26 2yru h SER 111 CO -0.05 -0.28 -0.52 -0.07 -0.53 0.00 0.00 176.83 175.37 2yru h LEU 112 N -0.09 -1.78 -0.49 2.23 3.38 -0.32 -0.21 115.31 118.02 2yru h LEU 112 Ca 0.28 0.26 0.08 0.00 0.09 0.00 0.00 57.88 58.59 2yru h LEU 112 Cb 0.55 0.76 -0.10 0.00 0.09 0.00 0.00 40.66 41.97 2yru h LEU 112 CO -0.73 -0.36 -0.44 -1.28 0.09 0.00 0.00 178.44 175.72 2yru h SER 113 N -0.28 -1.48 -1.82 -0.43 0.87 -0.23 -3.37 113.55 106.80 2yru h SER 113 Ca 0.12 0.23 -0.60 0.00 -1.23 0.00 0.00 61.79 60.32 2yru h SER 113 Cb 0.56 0.66 -0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2yru h SER 113 CO -0.68 -0.35 1.49 0.61 -0.53 0.00 0.00 176.83 177.36 2yru n GLY 114 N -1.41 0.91 3.55 5.77 0.00 -0.09 -4.87 105.19 109.06 2yru n GLY 114 Ca 0.00 0.80 -0.39 0.00 0.00 0.00 0.00 46.02 46.44 2yru n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yru s PRO 115 N 6.40 2.95 -0.15 1.61 0.04 -1.26 -4.89 135.00 139.69 2yru s PRO 115 Ca 1.02 -0.01 -0.16 0.00 0.04 0.00 0.00 61.00 61.89 2yru s PRO 115 Cb -0.42 -4.48 0.04 0.00 0.04 0.00 0.00 34.50 29.68 2yru s PRO 115 CO 0.37 -2.51 0.45 -1.12 0.04 0.00 0.00 177.00 174.23 2yru s SER 116 N 6.00 -0.45 -0.32 6.66 0.01 -1.26 -5.13 113.70 119.22 2yru s SER 116 Ca 0.52 0.81 0.01 0.00 1.31 0.00 0.00 55.95 58.61 2yru s SER 116 Cb -0.09 0.84 0.15 0.00 0.21 0.00 0.00 66.02 67.13 2yru s SER 116 CO 0.13 -0.21 0.34 -0.44 0.41 0.00 0.00 173.24 173.47 2yru s SER 117 N -0.01 1.34 0.00 2.44 0.01 -1.26 -5.10 113.70 111.12 2yru s SER 117 Ca -0.02 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.21 2yru s SER 117 Cb -0.03 0.59 0.00 0.00 0.21 0.00 0.00 66.02 66.79 2yru s SER 117 CO 0.01 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.94