#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 1.49 0.00 1.61 7.64 -1.26 -4.80 113.62 118.29 2yru n SER 2 Ca 0.00 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.39 2yru n SER 2 Cb 0.00 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 2yru n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yru n SER 3 N 8.94 0.00 -4.58 6.43 7.64 -1.26 -5.12 113.62 125.67 2yru n SER 3 Ca 0.48 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.93 2yru n SER 3 Cb 0.11 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.26 2yru n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yru s GLY 4 N 0.00 1.63 -0.32 0.23 0.00 -1.26 -4.97 107.32 102.64 2yru s GLY 4 Ca 0.00 -0.69 0.05 0.00 0.00 0.00 0.00 44.72 44.08 2yru s GLY 4 CO 0.00 1.79 0.55 -0.45 0.00 0.00 0.00 173.10 174.99 2yru s SER 5 N 1.90 -1.04 0.48 1.64 0.15 -1.26 -5.16 113.70 110.41 2yru s SER 5 Ca 0.32 -0.21 -0.06 0.00 0.70 0.00 0.00 55.95 56.70 2yru s SER 5 Cb -0.13 1.75 -0.04 0.00 -1.71 0.00 0.00 66.02 65.89 2yru s SER 5 CO 0.18 -0.28 0.79 -0.44 1.20 0.00 0.00 173.24 174.69 2yru s SER 6 N 2.51 6.28 0.48 5.45 0.01 -1.26 -5.01 113.70 122.16 2yru s SER 6 Ca 0.11 0.95 -0.21 0.00 1.31 0.00 0.00 55.95 58.12 2yru s SER 6 Cb -0.10 -2.26 -0.11 0.00 0.21 0.00 0.00 66.02 63.77 2yru s SER 6 CO -0.22 -0.57 0.56 0.61 0.41 0.00 0.00 173.24 174.02 2yru n GLY 7 N -2.20 -1.43 3.31 3.44 0.00 -1.26 -4.87 105.19 102.17 2yru n GLY 7 Ca 0.01 -0.03 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 2yru n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2yru n VAL 8 N -1.16 4.60 -4.37 1.61 0.31 -1.26 -5.00 118.33 113.06 2yru n VAL 8 Ca 0.11 -5.31 -0.31 0.00 -0.01 0.00 0.00 64.34 58.82 2yru n VAL 8 Cb 0.43 -2.50 -0.10 0.00 -0.91 0.00 0.00 33.84 30.75 2yru n VAL 8 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2yru s ILE 9 N -0.91 3.53 0.16 2.52 1.01 -1.26 -4.95 121.20 121.29 2yru s ILE 9 Ca 0.33 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.00 2yru s ILE 9 Cb -0.06 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.82 2yru s ILE 9 CO -0.04 0.27 0.00 -0.62 0.00 0.00 0.00 174.94 174.55 2yru n GLU 10 N 1.19 -4.69 -1.88 2.79 1.02 -1.26 -4.95 120.64 112.86 2yru n GLU 10 Ca -0.14 3.41 -0.00 0.00 -0.02 0.00 0.00 57.16 60.40 2yru n GLU 10 Cb 0.52 -3.65 -0.00 0.00 -0.02 0.00 0.00 31.44 28.29 2yru n GLU 10 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2yru n SER 11 N 1.60 -6.51 -4.07 1.62 7.64 -1.26 -5.09 113.62 107.55 2yru n SER 11 Ca 0.00 1.18 -0.09 0.00 1.01 0.00 0.00 58.87 60.97 2yru n SER 11 Cb 0.00 -3.70 -0.09 0.00 -1.01 0.00 0.00 64.21 59.40 2yru n SER 11 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2yru s GLU 12 N -1.10 0.91 -0.14 1.43 1.03 -1.26 -5.07 118.70 114.50 2yru s GLU 12 Ca -0.01 -1.30 -0.24 0.00 0.03 0.00 0.00 54.97 53.45 2yru s GLU 12 Cb 0.00 0.27 0.06 0.00 -0.80 0.00 0.00 34.13 33.66 2yru s GLU 12 CO 0.03 -0.27 0.59 0.99 -1.33 0.00 0.00 175.26 175.28 2yru s THR 13 N -3.99 0.01 -0.05 1.83 2.01 -1.26 -5.06 115.64 109.13 2yru s THR 13 Ca 0.18 -0.06 -0.09 0.00 0.31 0.00 0.00 61.69 62.02 2yru s THR 13 Cb 0.06 -0.87 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 2yru s THR 13 CO -0.02 -0.03 0.26 -0.76 -0.69 0.00 0.00 174.62 173.37 2yru s LEU 14 N -0.39 4.41 0.38 4.42 1.43 -1.26 -4.98 118.68 122.70 2yru s LEU 14 Ca -0.05 0.65 0.06 0.00 -1.03 0.00 0.00 54.13 53.76 2yru s LEU 14 Cb -0.03 -2.38 0.76 0.00 0.03 0.00 0.00 46.19 44.57 2yru s LEU 14 CO 0.04 0.34 1.99 -0.29 0.23 0.00 0.00 176.35 178.67 2yru h ILE 15 N 3.67 1.14 0.00 -0.59 2.10 -1.99 0.21 117.51 122.05 2yru h ILE 15 Ca -0.53 -0.41 0.00 0.00 1.08 0.00 0.00 64.86 65.00 2yru h ILE 15 Cb 1.22 0.66 0.00 0.00 -1.09 0.00 0.00 36.82 37.60 2yru h ILE 15 CO 0.61 0.16 0.00 -0.62 -1.08 0.00 0.00 178.15 177.22 2yru n GLU 16 N -4.40 0.14 -0.02 2.19 -0.58 -1.26 -0.40 120.64 116.31 2yru n GLU 16 Ca 0.03 0.09 -0.01 0.00 -0.42 0.00 0.00 57.16 56.85 2yru n GLU 16 Cb 0.13 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.37 2yru n GLU 16 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2yru n ASP 17 N -1.41 0.36 0.04 1.62 9.92 0.65 -2.18 116.55 125.56 2yru n ASP 17 Ca 0.08 0.16 0.11 0.00 -0.53 0.00 0.00 54.79 54.61 2yru n ASP 17 Cb 0.23 0.90 -0.09 0.00 -0.64 0.00 0.00 41.12 41.52 2yru n ASP 17 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2yru n VAL 18 N -2.68 0.29 -0.04 2.53 0.31 -0.66 -4.20 118.33 113.88 2yru n VAL 18 Ca -0.16 -0.52 -0.16 0.00 -0.01 0.00 0.00 64.34 63.49 2yru n VAL 18 Cb 0.88 -0.16 -0.14 0.00 -0.91 0.00 0.00 33.84 33.51 2yru n VAL 18 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2yru n LEU 19 N -2.45 2.00 -0.24 7.52 7.99 0.47 -3.19 117.00 129.08 2yru n LEU 19 Ca -0.02 0.17 -0.00 0.00 -0.01 0.00 0.00 56.01 56.15 2yru n LEU 19 Cb 0.56 -0.60 0.07 0.00 -0.11 0.00 0.00 43.42 43.34 2yru n LEU 19 CO 0.43 0.72 0.70 0.03 -1.51 0.00 0.00 177.39 177.76 2yru h ARG 20 N 0.03 -0.03 0.00 3.23 2.47 -1.61 1.34 114.38 119.82 2yru h ARG 20 Ca -0.43 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.29 2yru h ARG 20 Cb 2.03 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 30.35 2yru h ARG 20 CO 0.05 -0.02 -0.00 -1.00 0.56 0.00 0.00 179.97 179.56 2yru h PRO 21 N -0.03 -0.00 -0.84 0.04 0.13 -1.74 -0.56 132.00 129.00 2yru h PRO 21 Ca 0.33 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 65.64 2yru h PRO 21 Cb 0.54 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.56 2yru h PRO 21 CO -0.74 0.75 0.35 -0.07 -0.23 0.00 0.00 178.00 178.06 2yru h LEU 22 N -0.75 0.31 -0.03 1.56 3.38 -1.34 0.12 115.31 118.57 2yru h LEU 22 Ca -0.00 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2yru h LEU 22 Cb 0.75 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2yru h LEU 22 CO 0.00 0.06 -0.05 -0.33 0.09 0.00 0.00 178.44 178.20 2yru h GLU 23 N 0.43 0.09 -0.94 1.13 5.08 0.17 -2.87 114.58 117.66 2yru h GLU 23 Ca 0.49 -0.05 0.25 0.00 -1.00 0.00 0.00 59.36 59.05 2yru h GLU 23 Cb 0.85 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.97 2yru h GLU 23 CO -0.47 0.62 0.46 1.96 -1.00 0.00 0.00 179.01 180.58 2yru h GLN 24 N -0.44 0.40 -0.05 2.33 1.08 0.44 0.30 115.11 119.17 2yru h GLN 24 Ca 0.00 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 2yru h GLN 24 Cb 0.62 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2yru h GLN 24 CO 0.01 0.27 0.02 0.00 -0.95 0.00 0.00 178.83 178.18 2yru h ALA 25 N 1.75 0.06 -1.02 3.87 0.00 -0.79 -1.77 119.26 121.35 2yru h ALA 25 Ca 0.61 -0.07 0.27 0.00 0.00 0.00 0.00 54.91 55.72 2yru h ALA 25 Cb 1.22 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 2yru h ALA 25 CO -0.54 -0.37 0.70 1.25 0.00 0.00 0.00 179.25 180.29 2yru h LEU 26 N -0.05 0.25 -0.87 0.00 5.85 -0.23 1.49 115.31 121.74 2yru h LEU 26 Ca 0.02 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 2yru h LEU 26 Cb 0.13 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2yru h LEU 26 CO -0.00 0.06 -0.54 -0.33 -0.34 0.00 0.00 178.44 177.29 2yru h GLU 27 N 0.23 0.00 -0.01 1.25 4.39 -0.40 1.24 114.58 121.28 2yru h GLU 27 Ca 0.54 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 60.06 2yru h GLU 27 Cb 1.67 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.30 2yru h GLU 27 CO -0.15 0.54 -0.78 -0.44 -1.16 0.00 0.00 179.01 177.01 2yru h ASP 28 N 0.00 0.11 0.22 1.42 5.19 0.25 -2.79 116.42 120.82 2yru h ASP 28 Ca -0.01 -0.09 -0.35 0.00 -0.62 0.00 0.00 57.03 55.97 2yru h ASP 28 Cb 0.99 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.46 2yru h ASP 28 CO 0.07 0.85 -1.80 0.00 -3.12 0.00 0.00 179.24 175.23 2yru h HIS 30 N 0.09 0.38 -0.81 0.00 -0.00 0.15 1.61 115.15 116.57 2yru h HIS 30 Ca -0.36 0.01 -0.50 0.00 -0.00 0.00 0.00 60.37 59.53 2yru h HIS 30 Cb 2.07 -0.12 -0.27 0.00 -0.00 0.00 0.00 27.41 29.09 2yru h HIS 30 CO 0.08 0.12 0.36 0.41 -0.00 0.00 0.00 177.93 178.91 2yru n GLY 31 N -1.56 5.30 2.06 5.26 0.00 -1.05 -4.67 105.19 110.53 2yru n GLY 31 Ca 0.16 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.01 -3.02 -1.60 1.61 -0.00 0.11 -5.01 115.22 106.30 2yru n HIS 32 Ca 0.53 0.42 -0.34 0.00 -0.00 0.00 0.00 57.72 58.33 2yru n HIS 32 Cb 1.10 1.41 0.07 0.00 -0.00 0.00 0.00 29.99 32.58 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 -1.25 2.63 0.19 1.59 2.01 0.51 -4.89 115.64 116.42 2yru s THR 33 Ca 0.00 0.31 -0.33 0.00 0.31 0.00 0.00 61.69 61.98 2yru s THR 33 Cb 0.00 -2.88 -0.14 0.00 0.01 0.00 0.00 72.50 69.48 2yru s THR 33 CO 0.00 -0.16 1.42 0.29 -0.69 0.00 0.00 174.62 175.48 2yru n LYS 34 N -2.49 1.86 -0.38 4.92 5.02 -1.26 -4.64 118.16 121.18 2yru n LYS 34 Ca 0.12 0.66 0.30 0.00 -2.02 0.00 0.00 58.31 57.38 2yru n LYS 34 Cb 0.51 -2.33 0.58 0.00 -0.02 0.00 0.00 35.03 33.76 2yru n LYS 34 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2yru h LYS 35 N 4.67 0.23 0.00 1.97 -0.00 -1.90 0.10 116.57 121.64 2yru h LYS 35 Ca -0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.19 2yru h LYS 35 Cb 1.28 -0.05 0.00 0.00 -0.00 0.00 0.00 32.23 33.46 2yru h LYS 35 CO 0.79 0.15 0.00 1.04 -0.00 0.00 0.00 179.45 181.43 2yru n GLN 36 N -4.66 0.00 -0.24 0.07 1.13 -1.26 0.81 117.38 113.23 2yru n GLN 36 Ca 0.31 0.51 0.32 0.00 -1.94 0.00 0.00 57.00 56.20 2yru n GLN 36 Cb 1.15 -1.49 0.72 0.00 0.11 0.00 0.00 30.24 30.74 2yru n GLN 36 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2yru h VAL 37 N 0.00 0.37 -0.05 5.09 2.07 -1.60 0.92 116.25 123.04 2yru h VAL 37 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2yru h VAL 37 Cb 0.00 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2yru h VAL 37 CO 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.50 2yru h ASP 39 N -0.34 0.00 0.00 0.00 1.82 0.71 0.69 116.42 119.30 2yru h ASP 39 Ca 0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 2yru h ASP 39 Cb 0.65 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.66 2yru h ASP 39 CO 0.02 0.04 -0.09 -0.78 -1.61 0.00 0.00 179.24 176.82 2yru h ASP 40 N 0.00 0.07 0.46 2.28 1.82 -0.46 -2.77 116.42 117.83 2yru h ASP 40 Ca -0.00 -0.82 -0.02 0.00 -0.39 0.00 0.00 57.03 55.80 2yru h ASP 40 Cb 0.11 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 2yru h ASP 40 CO 0.01 0.88 -0.30 0.40 -1.61 0.00 0.00 179.24 178.62 2yru h ILE 41 N -0.73 0.38 -0.53 2.25 2.04 -0.31 -2.90 117.51 117.71 2yru h ILE 41 Ca -0.01 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 2yru h ILE 41 Cb 0.90 0.38 -0.10 0.00 -0.74 0.00 0.00 36.82 37.26 2yru h ILE 41 CO 0.02 0.00 -0.47 0.77 0.00 0.00 0.00 178.15 178.47 2yru h SER 42 N -0.73 -1.59 -1.29 1.72 4.64 -1.01 0.60 113.55 115.89 2yru h SER 42 Ca -0.05 0.24 0.44 0.00 -0.47 0.00 0.00 61.79 61.96 2yru h SER 42 Cb 0.61 0.70 -0.13 0.00 -0.31 0.00 0.00 62.40 63.27 2yru h SER 42 CO 0.04 -0.35 0.83 0.54 -0.87 0.00 0.00 176.83 177.02 2yru n ARG 43 N -5.40 -0.03 0.12 4.77 1.74 -1.04 0.88 116.66 117.69 2yru n ARG 43 Ca 0.00 1.15 -0.10 0.00 -0.77 0.00 0.00 57.85 58.13 2yru n ARG 43 Cb 0.34 -2.28 -0.06 0.00 -1.02 0.00 0.00 32.46 29.44 2yru n ARG 43 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yru h ARG 44 N 0.00 -0.36 -0.63 5.56 2.47 0.29 -3.19 114.38 118.53 2yru h ARG 44 Ca 0.82 0.02 0.13 0.00 -1.26 0.00 0.00 59.98 59.69 2yru h ARG 44 Cb 2.65 0.08 -0.12 0.00 -1.65 0.00 0.00 29.97 30.93 2yru h ARG 44 CO -0.42 -0.03 -0.14 -0.07 0.56 0.00 0.00 179.97 179.87 2yru h LEU 45 N -0.95 -0.55 -1.53 3.04 3.38 0.11 1.05 115.31 119.86 2yru h LEU 45 Ca -0.04 0.18 0.36 0.00 0.09 0.00 0.00 57.88 58.48 2yru h LEU 45 Cb 0.49 0.38 -0.10 0.00 0.09 0.00 0.00 40.66 41.52 2yru h LEU 45 CO 0.06 -0.20 0.81 0.00 0.09 0.00 0.00 178.44 179.21 2yru h ALA 46 N 1.62 2.67 0.00 1.53 0.00 -0.87 0.47 119.26 124.69 2yru h ALA 46 Ca 0.31 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 2yru h ALA 46 Cb 0.47 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2yru h ALA 46 CO -0.63 -1.16 -0.15 1.25 0.00 0.00 0.00 179.25 178.56 2yru h LEU 47 N 0.19 0.00 -1.01 0.00 6.46 0.94 -2.50 115.31 119.39 2yru h LEU 47 Ca 0.69 -0.07 0.42 0.00 -0.12 0.00 0.00 57.88 58.80 2yru h LEU 47 Cb 2.17 0.00 -0.17 0.00 -0.73 0.00 0.00 40.66 41.92 2yru h LEU 47 CO -0.28 0.61 0.56 -0.11 -0.62 0.00 0.00 178.44 178.60 2yru n LEU 48 N -4.72 0.34 0.12 2.25 7.94 0.10 0.65 117.00 123.68 2yru n LEU 48 Ca -0.03 1.62 -0.06 0.00 -1.11 0.00 0.00 56.01 56.43 2yru n LEU 48 Cb 0.11 -0.79 -0.03 0.00 0.53 0.00 0.00 43.42 43.24 2yru n LEU 48 CO 0.05 -1.81 0.21 -0.09 -1.11 0.00 0.00 177.39 174.64 2yru h ARG 49 N 0.00 -0.35 -0.86 1.96 2.43 -0.23 -1.20 114.38 116.13 2yru h ARG 49 Ca 0.84 0.02 0.20 0.00 -0.81 0.00 0.00 59.98 60.23 2yru h ARG 49 Cb 2.26 0.08 -0.16 0.00 -0.42 0.00 0.00 29.97 31.73 2yru h ARG 49 CO -0.74 -0.23 -0.06 0.93 -1.51 0.00 0.00 179.97 178.36 2yru h GLU 50 N -0.76 0.05 -0.56 0.20 5.08 -0.32 1.21 114.58 119.47 2yru h GLU 50 Ca -0.04 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2yru h GLU 50 Cb 0.28 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2yru h GLU 50 CO 0.06 0.03 0.12 1.96 -1.00 0.00 0.00 179.01 180.19 2yru h GLN 51 N 0.05 0.87 0.29 2.33 4.20 0.14 1.31 115.11 124.29 2yru h GLN 51 Ca 0.46 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.97 2yru h GLN 51 Cb 0.83 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2yru h GLN 51 CO -0.81 0.79 -0.14 2.35 -0.67 0.00 0.00 178.83 180.35 2yru h TRP 52 N 0.83 -0.36 0.54 2.96 2.91 0.24 0.12 115.95 123.19 2yru h TRP 52 Ca 0.18 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.18 2yru h TRP 52 Cb 0.32 0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.07 2yru h TRP 52 CO 0.02 -0.23 -0.50 0.00 -1.03 0.00 0.00 178.44 176.70 2yru h ALA 53 N -1.70 -1.15 -1.26 2.65 0.00 0.30 -1.24 119.26 116.86 2yru h ALA 53 Ca -0.04 -0.20 0.42 0.00 0.00 0.00 0.00 54.91 55.09 2yru h ALA 53 Cb 0.30 0.71 -0.11 0.00 0.00 0.00 0.00 17.79 18.70 2yru h ALA 53 CO 0.07 -1.18 0.83 0.41 0.00 0.00 0.00 179.25 179.37 2yru n GLY 54 N -1.57 -0.74 0.66 0.00 0.00 0.45 -4.70 105.19 99.29 2yru n GLY 54 Ca -0.12 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 -1.50 0.80 0.15 -0.02 0.00 -0.47 -4.95 105.19 99.19 2yru n GLY 55 Ca 0.35 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.09 0.00 0.00 1.61 6.56 -0.98 -3.46 116.57 120.38 2yru h LYS 56 Ca 0.00 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 59.22 2yru h LYS 56 Cb 0.00 0.00 0.16 0.00 -0.57 0.00 0.00 32.23 31.82 2yru h LYS 56 CO 0.00 0.00 0.25 1.28 -2.06 0.00 0.00 179.45 178.92 2yru n LEU 57 N -2.69 0.00 -4.54 2.94 4.77 -0.69 -5.01 117.00 111.79 2yru n LEU 57 Ca 0.03 -1.18 -0.30 0.00 -0.03 0.00 0.00 56.01 54.54 2yru n LEU 57 Cb 0.50 -0.90 -0.11 0.00 -2.33 0.00 0.00 43.42 40.59 2yru n LEU 57 CO 0.35 -1.65 -0.45 -0.44 -1.33 0.00 0.00 177.39 173.87 2yru s SER 58 N -4.79 4.16 0.18 -1.43 0.01 -1.26 -5.01 113.70 105.56 2yru s SER 58 Ca 0.65 -0.45 -0.13 0.00 1.31 0.00 0.00 55.95 57.33 2yru s SER 58 Cb -0.04 -0.71 0.14 0.00 0.21 0.00 0.00 66.02 65.62 2yru s SER 58 CO 0.48 0.18 1.78 0.40 0.41 0.00 0.00 173.24 176.49 2yru h ILE 59 N 3.42 0.94 0.00 1.44 2.04 -1.98 0.18 117.51 123.54 2yru h ILE 59 Ca -0.49 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.21 2yru h ILE 59 Cb 1.17 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2yru h ILE 59 CO 0.49 0.08 0.00 -0.81 0.00 0.00 0.00 178.15 177.92 2yru n PRO 60 N -4.91 0.24 0.09 2.37 -0.04 -1.26 -2.04 135.00 129.45 2yru n PRO 60 Ca 0.04 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2yru n PRO 60 Cb 0.14 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.16 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 0.04 0.52 2.07 -1.08 -3.18 116.25 114.62 2yru h VAL 61 Ca 0.00 -0.83 -0.36 0.00 0.82 0.00 0.00 66.70 66.33 2yru h VAL 61 Cb 0.26 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2yru h VAL 61 CO 0.00 0.00 -2.05 0.29 0.02 0.00 0.00 177.57 175.83 2yru n LYS 62 N -2.50 0.65 -0.12 1.57 5.02 -0.70 -2.96 118.16 119.13 2yru n LYS 62 Ca 0.01 0.31 0.09 0.00 -2.02 0.00 0.00 58.31 56.70 2yru n LYS 62 Cb 0.51 -1.63 0.43 0.00 -0.02 0.00 0.00 35.03 34.33 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 -0.42 0.55 0.10 1.97 6.56 -1.56 0.20 116.57 123.96 2yru h LYS 63 Ca -0.50 -0.03 -0.26 0.00 -1.06 0.00 0.00 60.65 58.79 2yru h LYS 63 Cb 1.75 -0.12 0.01 0.00 -0.57 0.00 0.00 32.23 33.29 2yru h LYS 63 CO -0.13 0.36 -1.16 0.00 -2.06 0.00 0.00 179.45 176.46 2yru h ARG 64 N 0.56 0.32 0.32 3.15 3.08 -1.71 -3.19 114.38 116.91 2yru h ARG 64 Ca 0.29 -0.47 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 2yru h ARG 64 Cb 0.39 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.60 2yru h ARG 64 CO -0.09 1.19 -0.16 0.52 -1.07 0.00 0.00 179.97 180.37 2yru h MET 65 N 0.12 -0.42 -0.92 0.04 2.86 -0.97 -2.77 114.93 112.87 2yru h MET 65 Ca -0.12 0.03 0.21 0.00 -2.06 0.00 0.00 59.70 57.76 2yru h MET 65 Cb 1.86 0.10 -0.12 0.00 0.06 0.00 0.00 31.60 33.50 2yru h MET 65 CO 0.19 -0.16 0.46 0.00 1.06 0.00 0.00 176.91 178.46 2yru h ALA 66 N -0.02 1.50 0.05 6.32 0.00 -0.81 -0.22 119.26 126.07 2yru h ALA 66 Ca -0.04 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2yru h ALA 66 Cb 0.45 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2yru h ALA 66 CO 0.07 -0.27 -0.11 -0.07 0.00 0.00 0.00 179.25 178.88 2yru h LEU 67 N 0.50 -0.33 -0.89 0.00 3.38 -1.49 0.99 115.31 117.47 2yru h LEU 67 Ca 0.56 0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.81 2yru h LEU 67 Cb 1.02 0.12 -0.15 0.00 0.09 0.00 0.00 40.66 41.74 2yru h LEU 67 CO -0.48 -0.12 0.23 0.25 0.09 0.00 0.00 178.44 178.40 2yru h LEU 68 N -0.17 -0.04 0.51 1.67 6.46 -1.06 0.28 115.31 122.95 2yru h LEU 68 Ca -0.00 0.21 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 2yru h LEU 68 Cb 0.17 0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 2yru h LEU 68 CO -0.05 -0.19 -0.32 0.58 -0.62 0.00 0.00 178.44 177.85 2yru h VAL 69 N 0.18 0.35 -0.61 1.05 2.07 -0.12 -0.35 116.25 118.82 2yru h VAL 69 Ca 0.57 0.00 0.18 0.00 0.82 0.00 0.00 66.70 68.27 2yru h VAL 69 Cb 1.17 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2yru h VAL 69 CO -0.69 0.00 0.74 1.56 0.02 0.00 0.00 177.57 179.20 2yru h GLN 70 N -0.78 0.00 0.22 1.57 1.08 0.45 1.02 115.11 118.67 2yru h GLN 70 Ca -0.06 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.81 2yru h GLN 70 Cb 0.64 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.10 2yru h GLN 70 CO 0.06 0.00 -1.53 0.93 -0.95 0.00 0.00 178.83 177.33 2yru h GLU 71 N 0.00 0.47 0.00 1.46 4.39 0.17 -3.08 114.58 117.99 2yru h GLU 71 Ca 0.29 -0.79 -0.01 0.00 0.34 0.00 0.00 59.36 59.19 2yru h GLU 71 Cb 1.76 0.30 -0.00 0.00 -0.10 0.00 0.00 28.75 30.71 2yru h GLU 71 CO -0.00 1.37 -0.04 1.25 -1.16 0.00 0.00 179.01 180.43 2yru h LEU 72 N 0.13 0.00 0.11 1.33 6.46 0.25 1.62 115.31 125.20 2yru h LEU 72 Ca -0.27 0.00 -0.28 0.00 -0.12 0.00 0.00 57.88 57.22 2yru h LEU 72 Cb 2.13 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 42.09 2yru h LEU 72 CO 0.24 0.04 -1.14 -0.07 -0.62 0.00 0.00 178.44 176.89 2yru h LEU 73 N 0.00 0.82 -0.31 2.25 3.38 -1.16 -3.10 115.31 117.20 2yru h LEU 73 Ca -0.00 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.15 2yru h LEU 73 Cb 0.29 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2yru h LEU 73 CO 0.00 1.56 -0.04 1.41 0.09 0.00 0.00 178.44 181.46 2yru n HIS 74 N -3.87 0.00 -0.52 1.13 8.25 -0.71 -4.86 115.22 114.64 2yru n HIS 74 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 2yru n HIS 74 Cb 0.94 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.97 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 -0.72 0.00 -1.06 4.41 8.25 0.39 -4.93 115.22 121.56 2yru n HIS 75 Ca 0.19 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.23 2yru n HIS 75 Cb 0.24 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.27 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 1.12 -0.05 -0.41 1.13 0.53 -4.58 117.38 113.11 2yru n GLN 76 Ca 0.00 -1.68 -0.11 0.00 -1.94 0.00 0.00 57.00 53.27 2yru n GLN 76 Cb 0.00 -2.89 -0.05 0.00 0.11 0.00 0.00 30.24 27.41 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 8.59 0.31 -0.49 1.08 4.06 -1.92 -0.74 115.95 126.84 2yru h TRP 77 Ca 0.36 -0.04 0.10 0.00 2.06 0.00 0.00 58.89 61.37 2yru h TRP 77 Cb 0.70 -0.09 -0.10 0.00 -1.00 0.00 0.00 29.16 28.67 2yru h TRP 77 CO 1.18 0.42 -0.25 -0.44 -3.56 0.00 0.00 178.44 175.79 2yru h ASP 78 N 0.10 -0.85 0.30 -3.49 3.32 -1.95 0.72 116.42 114.58 2yru h ASP 78 Ca 0.06 0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 2yru h ASP 78 Cb 0.27 0.45 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 2yru h ASP 78 CO 0.00 -0.26 -0.26 0.00 -1.72 0.00 0.00 179.24 177.00 2yru h ALA 79 N 1.14 -0.56 -0.84 3.45 0.00 -1.89 0.14 119.26 120.70 2yru h ALA 79 Ca 0.22 -0.09 0.19 0.00 0.00 0.00 0.00 54.91 55.23 2yru h ALA 79 Cb 0.49 0.35 -0.11 0.00 0.00 0.00 0.00 17.79 18.52 2yru h ALA 79 CO -0.58 -0.84 0.33 0.00 0.00 0.00 0.00 179.25 178.16 2yru h ALA 80 N 0.05 1.25 -0.83 0.00 0.00 0.30 0.67 119.26 120.70 2yru h ALA 80 Ca -0.02 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2yru h ALA 80 Cb 0.51 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2yru h ALA 80 CO -0.03 -0.30 0.38 0.22 0.00 0.00 0.00 179.25 179.52 2yru h ASP 81 N 0.40 1.11 0.39 0.00 3.58 0.12 0.76 116.42 122.78 2yru h ASP 81 Ca 0.50 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.78 2yru h ASP 81 Cb 0.88 -0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.64 2yru h ASP 81 CO -0.49 0.95 -0.19 -0.78 -2.88 0.00 0.00 179.24 175.85 2yru h ASP 82 N 1.19 -0.44 -0.65 2.28 1.82 0.29 -0.73 116.42 120.18 2yru h ASP 82 Ca 0.28 -0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.90 2yru h ASP 82 Cb 0.15 0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.25 2yru h ASP 82 CO -0.03 -0.28 0.34 0.40 -1.61 0.00 0.00 179.24 178.06 2yru h ILE 83 N -0.57 1.21 -0.75 2.25 2.04 -0.37 -1.80 117.51 119.53 2yru h ILE 83 Ca -0.05 -0.55 0.15 0.00 1.00 0.00 0.00 64.86 65.40 2yru h ILE 83 Cb 0.43 0.38 -0.10 0.00 -0.74 0.00 0.00 36.82 36.79 2yru h ILE 83 CO 0.09 0.24 0.28 -0.74 0.00 0.00 0.00 178.15 178.01 2yru h HIS 84 N 0.89 0.46 0.15 1.37 -0.00 0.81 -0.84 115.15 118.00 2yru h HIS 84 Ca 0.23 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.63 2yru h HIS 84 Cb 0.07 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 2yru h HIS 84 CO -0.00 0.02 -0.07 0.00 -0.00 0.00 0.00 177.93 177.88 2yru h ARG 85 N 0.40 -0.19 -1.10 5.26 2.47 -0.50 -1.37 114.38 119.34 2yru h ARG 85 Ca 0.42 0.01 0.32 0.00 -1.26 0.00 0.00 59.98 59.47 2yru h ARG 85 Cb 0.66 0.04 -0.12 0.00 -1.65 0.00 0.00 29.97 28.91 2yru h ARG 85 CO -0.43 0.02 0.69 0.66 0.56 0.00 0.00 179.97 181.47 2yru h SER 86 N -0.38 0.43 0.20 7.04 4.64 -0.39 1.46 113.55 126.55 2yru h SER 86 Ca -0.02 0.12 -0.20 0.00 -0.47 0.00 0.00 61.79 61.22 2yru h SER 86 Cb 0.30 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2yru h SER 86 CO 0.03 -0.02 -0.77 -0.07 -0.87 0.00 0.00 176.83 175.14 2yru h LEU 87 N 0.32 0.57 0.00 5.97 3.38 -0.82 -2.77 115.31 121.96 2yru h LEU 87 Ca 0.68 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2yru h LEU 87 Cb 1.78 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.36 2yru h LEU 87 CO -0.40 1.14 0.00 0.23 0.09 0.00 0.00 178.44 179.50 2yru n MET 88 N -3.84 0.07 -0.05 1.13 2.81 0.46 -0.59 117.12 117.11 2yru n MET 88 Ca -0.05 0.13 -0.10 0.00 -1.81 0.00 0.00 57.70 55.87 2yru n MET 88 Cb 0.73 -1.50 -0.09 0.00 -0.71 0.00 0.00 33.22 31.65 2yru n MET 88 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2yru h VAL 89 N 0.00 1.28 0.00 2.03 2.07 -0.19 -3.34 116.25 118.10 2yru h VAL 89 Ca 0.00 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.66 2yru h VAL 89 Cb 0.32 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 2yru h VAL 89 CO 0.00 0.42 -0.02 0.47 0.02 0.00 0.00 177.57 178.46 2yru n ASP 90 N -4.69 0.04 -3.50 0.57 9.92 -1.19 -4.59 116.55 113.11 2yru n ASP 90 Ca -0.07 0.12 -0.40 0.00 -0.53 0.00 0.00 54.79 53.90 2yru n ASP 90 Cb 0.34 -0.51 -0.02 0.00 -0.64 0.00 0.00 41.12 40.30 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 -2.44 2.80 0.14 1.24 8.25 0.24 -4.49 115.22 120.96 2yru n HIS 91 Ca -0.00 -3.00 -0.25 0.00 -0.26 0.00 0.00 57.72 54.21 2yru n HIS 91 Cb 0.01 -2.38 -0.16 0.00 1.12 0.00 0.00 29.99 28.59 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 3.28 1.28 0.23 1.59 3.04 -1.64 -2.95 116.25 121.08 2yru h VAL 92 Ca 0.73 -2.67 -0.01 0.00 -1.01 0.00 0.00 66.70 63.74 2yru h VAL 92 Cb 0.41 2.99 0.00 0.00 -2.01 0.00 0.00 31.29 32.69 2yru h VAL 92 CO 1.76 0.80 -0.11 0.74 -1.01 0.00 0.00 177.57 179.75 2yru h THR 93 N 0.17 0.39 -0.59 3.17 2.02 -1.89 -1.67 112.91 114.50 2yru h THR 93 Ca -0.25 -0.93 0.09 0.00 0.77 0.00 0.00 66.41 66.10 2yru h THR 93 Cb 2.14 0.66 -0.11 0.00 -1.74 0.00 0.00 68.15 69.10 2yru h THR 93 CO 0.27 0.11 -0.41 -0.33 0.37 0.00 0.00 175.52 175.53 2yru h GLU 94 N -1.01 -0.20 -0.54 6.66 4.39 -1.91 0.67 114.58 122.64 2yru h GLU 94 Ca -0.03 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2yru h GLU 94 Cb 0.41 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 2yru h GLU 94 CO 0.05 -0.13 0.36 -0.39 -1.16 0.00 0.00 179.01 177.74 2yru h VAL 95 N -0.20 1.14 -1.99 3.13 -1.51 -1.63 -3.43 116.25 111.75 2yru h VAL 95 Ca 0.20 -0.26 -0.25 0.00 -1.23 0.00 0.00 66.70 65.16 2yru h VAL 95 Cb 0.56 0.35 0.14 0.00 -2.13 0.00 0.00 31.29 30.21 2yru h VAL 95 CO -0.69 0.14 -0.40 -1.54 -1.23 0.00 0.00 177.57 173.84 2yru n SER 96 N -4.45 -2.97 0.00 4.19 3.41 0.23 0.11 113.62 114.15 2yru n SER 96 Ca 0.05 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.30 2yru n SER 96 Cb 0.05 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 2yru n SER 96 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2yru n GLN 97 N -1.78 -0.38 0.00 4.33 6.02 -1.26 -3.95 117.38 120.36 2yru n GLN 97 Ca 0.05 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 2yru n GLN 97 Cb 0.39 -3.77 0.00 0.00 1.02 0.00 0.00 30.24 27.88 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 -2.16 -0.49 -0.38 1.08 4.27 -1.18 -4.77 117.44 113.82 2yru n TRP 98 Ca 0.00 0.00 0.32 0.00 -3.89 0.00 0.00 57.50 53.93 2yru n TRP 98 Cb 0.09 0.10 0.54 0.00 -1.36 0.00 0.00 31.31 30.68 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 -1.49 -0.03 0.08 -2.67 1.56 0.31 0.21 117.12 115.09 2yru n MET 99 Ca 0.00 1.00 -0.12 0.00 -0.27 0.00 0.00 57.70 58.31 2yru n MET 99 Cb 0.00 -1.97 -0.05 0.00 2.15 0.00 0.00 33.22 33.35 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 0.51 -0.16 1.12 -1.51 -1.91 -1.86 116.25 112.44 2yru h VAL 100 Ca 0.70 0.00 0.05 0.00 -1.23 0.00 0.00 66.70 66.22 2yru h VAL 100 Cb 2.27 0.51 -0.07 0.00 -2.13 0.00 0.00 31.29 31.87 2yru h VAL 100 CO -0.37 0.00 -0.42 1.23 -1.23 0.00 0.00 177.57 176.78 2yru h GLY 101 N -0.37 -0.69 -0.58 5.19 0.00 0.21 -1.24 103.07 105.59 2yru h GLY 101 Ca 0.04 0.52 0.13 0.00 0.00 0.00 0.00 47.33 48.02 2yru h GLY 101 CO -0.15 -0.22 -0.31 -2.08 0.00 0.00 0.00 176.54 173.77 2yru h VAL 102 N -0.47 0.14 -0.93 4.60 2.07 -1.35 1.25 116.25 121.56 2yru h VAL 102 Ca 0.08 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.83 2yru h VAL 102 Cb 0.62 0.14 -0.12 0.00 -1.52 0.00 0.00 31.29 30.41 2yru h VAL 102 CO -0.42 0.00 0.47 0.50 0.02 0.00 0.00 177.57 178.15 2yru h LYS 103 N -0.09 0.47 0.26 1.57 3.64 -0.42 0.16 116.57 122.16 2yru h LYS 103 Ca 0.29 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2yru h LYS 103 Cb 0.57 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2yru h LYS 103 CO -0.78 0.31 -0.12 -0.09 -2.27 0.00 0.00 179.45 176.50 2yru h ARG 104 N 0.48 -0.33 -0.88 1.90 9.65 0.19 -2.87 114.38 122.53 2yru h ARG 104 Ca 0.58 0.02 0.16 0.00 -1.10 0.00 0.00 59.98 59.64 2yru h ARG 104 Cb 1.09 0.08 -0.16 0.00 -1.39 0.00 0.00 29.97 29.59 2yru h ARG 104 CO -0.50 0.02 -0.30 1.25 2.80 0.00 0.00 179.97 183.24 2yru h LEU 105 N -0.91 -1.10 0.05 3.80 5.85 0.15 0.37 115.31 123.52 2yru h LEU 105 Ca -0.04 0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.97 2yru h LEU 105 Cb 0.50 0.63 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 2yru h LEU 105 CO 0.06 -0.30 -0.37 0.40 -0.34 0.00 0.00 178.44 177.89 2yru h ILE 106 N -0.03 0.00 -0.69 4.05 2.04 -0.79 0.60 117.51 122.69 2yru h ILE 106 Ca 0.37 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.36 2yru h ILE 106 Cb 0.62 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.57 2yru h ILE 106 CO -0.90 0.00 -0.26 0.00 0.00 0.00 0.00 178.15 176.99 2yru h ALA 107 N -0.82 0.24 0.30 1.87 0.00 -0.64 0.40 119.26 120.62 2yru h ALA 107 Ca -0.00 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2yru h ALA 107 Cb 0.52 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2yru h ALA 107 CO -0.22 -0.54 -0.42 0.93 0.00 0.00 0.00 179.25 179.00 2yru h GLU 108 N -0.07 -0.73 -0.48 0.00 4.39 0.55 0.80 114.58 119.05 2yru h GLU 108 Ca 0.30 0.05 0.07 0.00 0.34 0.00 0.00 59.36 60.13 2yru h GLU 108 Cb 0.55 0.17 -0.10 0.00 -0.10 0.00 0.00 28.75 29.27 2yru h GLU 108 CO -0.74 -0.49 -0.46 0.87 -1.16 0.00 0.00 179.01 177.03 2yru h LYS 109 N -0.76 -0.29 -0.17 2.33 1.79 0.15 0.20 116.57 119.83 2yru h LYS 109 Ca -0.04 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.51 2yru h LYS 109 Cb 0.68 0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 31.34 2yru h LYS 109 CO -0.12 -0.19 -0.29 -0.22 -1.08 0.00 0.00 179.45 177.55 2yru h LYS 110 N -0.30 -0.33 -0.64 3.15 3.64 0.06 -1.48 116.57 120.67 2yru h LYS 110 Ca 0.14 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.65 2yru h LYS 110 Cb 0.58 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 32.35 2yru h LYS 110 CO -0.63 -0.22 -0.34 1.03 -2.27 0.00 0.00 179.45 177.02 2yru h SER 111 N -0.34 -1.20 -0.61 4.20 0.87 0.26 0.15 113.55 116.88 2yru h SER 111 Ca 0.11 0.24 0.11 0.00 -1.23 0.00 0.00 61.79 61.02 2yru h SER 111 Cb 0.51 0.60 -0.12 0.00 -0.44 0.00 0.00 62.40 62.95 2yru h SER 111 CO -0.36 -0.30 -0.31 -0.07 -0.53 0.00 0.00 176.83 175.26 2yru h LEU 112 N -0.14 -1.09 -7.78 2.23 3.38 0.33 -2.91 115.31 109.32 2yru h LEU 112 Ca 0.24 0.22 -0.73 0.00 0.09 0.00 0.00 57.88 57.71 2yru h LEU 112 Cb 0.56 0.56 -0.18 0.00 0.09 0.00 0.00 40.66 41.68 2yru h LEU 112 CO -0.72 -0.29 1.20 -0.55 0.09 0.00 0.00 178.44 178.17 2yru s SER 113 N -5.18 6.97 -0.61 -0.43 0.15 0.53 -4.89 113.70 110.25 2yru s SER 113 Ca -0.14 -2.79 0.04 0.00 0.70 0.00 0.00 55.95 53.76 2yru s SER 113 Cb 0.17 -2.39 0.16 0.00 -1.71 0.00 0.00 66.02 62.24 2yru s SER 113 CO 0.70 -0.81 0.41 -0.83 1.20 0.00 0.00 173.24 173.92 2yru s GLY 114 N 2.97 2.49 0.45 9.45 0.00 -1.10 -4.83 107.32 116.75 2yru s GLY 114 Ca 0.40 -3.44 -0.22 0.00 0.00 0.00 0.00 44.72 41.47 2yru s GLY 114 CO -0.02 1.27 1.04 2.56 0.00 0.00 0.00 173.10 177.95 2yru s PRO 115 N -0.90 3.93 -0.18 2.90 0.04 -1.26 -4.54 135.00 134.98 2yru s PRO 115 Ca 0.24 1.42 -0.09 0.00 0.04 0.00 0.00 61.00 62.61 2yru s PRO 115 Cb -0.08 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.24 2yru s PRO 115 CO -0.13 -0.33 0.17 0.43 0.04 0.00 0.00 177.00 177.18 2yru n SER 116 N -0.65 -2.80 0.14 6.66 7.64 -1.26 -5.02 113.62 118.33 2yru n SER 116 Ca 0.08 1.30 0.00 0.00 1.01 0.00 0.00 58.87 61.26 2yru n SER 116 Cb 0.51 -4.76 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 2yru n SER 116 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yru n SER 117 N 1.61 -0.88 0.00 6.43 2.88 -1.26 -5.28 113.62 117.12 2yru n SER 117 Ca -0.29 0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 2yru n SER 117 Cb 0.46 0.99 0.00 0.00 -0.75 0.00 0.00 64.21 64.92 2yru n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42