#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yru s SER 2 N 0.00 3.42 0.17 1.61 1.04 -1.26 -4.93 113.70 113.74 2yru s SER 2 Ca 0.00 0.97 -0.28 0.00 0.48 0.00 0.00 55.95 57.11 2yru s SER 2 Cb 0.00 -1.54 -0.01 0.00 0.10 0.00 0.00 66.02 64.56 2yru s SER 2 CO 0.00 -2.61 1.54 0.28 0.98 0.00 0.00 173.24 173.43 2yru h SER 3 N -1.54 -1.99 -2.16 7.02 0.02 -2.13 -3.46 113.55 109.31 2yru h SER 3 Ca -0.51 0.32 0.06 0.00 -0.84 0.00 0.00 61.79 60.82 2yru h SER 3 Cb 1.33 0.90 -0.01 0.00 0.14 0.00 0.00 62.40 64.76 2yru h SER 3 CO 0.61 -0.26 -0.08 0.61 -1.14 0.00 0.00 176.83 176.58 2yru n GLY 4 N -1.31 -1.40 3.00 -3.77 0.00 -1.26 -4.94 105.19 95.50 2yru n GLY 4 Ca 0.03 -1.14 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 2yru n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yru s SER 5 N -4.35 0.31 0.01 1.61 0.01 -1.26 -5.16 113.70 104.87 2yru s SER 5 Ca 0.00 -0.54 -0.18 0.00 1.31 0.00 0.00 55.95 56.54 2yru s SER 5 Cb 0.00 0.10 0.03 0.00 0.21 0.00 0.00 66.02 66.36 2yru s SER 5 CO 0.00 -0.31 0.39 -0.44 0.41 0.00 0.00 173.24 173.28 2yru s SER 6 N -1.58 -0.27 -0.25 2.44 0.01 -1.26 -5.11 113.70 107.69 2yru s SER 6 Ca -0.14 0.07 -0.40 0.00 1.31 0.00 0.00 55.95 56.80 2yru s SER 6 Cb -0.09 0.39 -0.18 0.00 0.21 0.00 0.00 66.02 66.35 2yru s SER 6 CO -0.02 -0.58 1.23 0.61 0.41 0.00 0.00 173.24 174.90 2yru n GLY 7 N 0.82 -0.02 3.58 3.44 0.00 -1.26 -4.91 105.19 106.84 2yru n GLY 7 Ca -0.20 0.81 -0.07 0.00 0.00 0.00 0.00 46.02 46.56 2yru n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yru s VAL 8 N 1.50 0.00 0.37 1.61 0.11 -1.26 -5.14 120.40 117.58 2yru s VAL 8 Ca 0.89 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.94 2yru s VAL 8 Cb -1.26 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 2yru s VAL 8 CO 0.64 0.00 0.00 -0.38 -3.33 0.00 0.00 175.10 172.03 2yru n ILE 9 N 0.34 -4.33 -3.44 7.04 5.41 -1.26 -5.01 119.36 118.11 2yru n ILE 9 Ca -0.06 1.85 -0.19 0.00 1.00 0.00 0.00 62.75 65.35 2yru n ILE 9 Cb 0.59 -2.58 -0.01 0.00 -0.71 0.00 0.00 39.64 36.93 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 -3.90 3.00 0.27 0.38 2.02 -1.26 -4.99 118.70 114.22 2yru s GLU 10 Ca 0.00 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 53.88 2yru s GLU 10 Cb 0.00 -2.75 0.00 0.00 0.10 0.00 0.00 34.13 31.48 2yru s GLU 10 CO 0.00 0.00 0.00 0.45 0.02 0.00 0.00 175.26 175.73 2yru n SER 11 N -1.64 -2.42 -2.25 -0.19 2.88 -1.26 -5.14 113.62 103.60 2yru n SER 11 Ca 0.01 0.70 -0.01 0.00 -1.33 0.00 0.00 58.87 58.25 2yru n SER 11 Cb 0.59 2.44 -0.01 0.00 -0.75 0.00 0.00 64.21 66.48 2yru n SER 11 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2yru n GLU 12 N -3.20 -4.65 -5.22 -1.46 1.02 -1.26 -5.02 120.64 100.84 2yru n GLU 12 Ca 0.00 3.44 -0.32 0.00 -0.02 0.00 0.00 57.16 60.26 2yru n GLU 12 Cb 0.00 -4.38 -0.16 0.00 -0.02 0.00 0.00 31.44 26.88 2yru n GLU 12 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2yru s THR 13 N -0.55 2.18 0.17 2.62 2.01 -1.26 -5.12 115.64 115.69 2yru s THR 13 Ca -0.03 -1.03 -0.25 0.00 0.31 0.00 0.00 61.69 60.69 2yru s THR 13 Cb 0.00 -1.79 -0.08 0.00 0.01 0.00 0.00 72.50 70.64 2yru s THR 13 CO 0.09 0.57 0.78 -0.76 -0.69 0.00 0.00 174.62 174.61 2yru s LEU 14 N -0.24 4.60 0.22 4.42 1.43 -1.26 -4.96 118.68 122.88 2yru s LEU 14 Ca -0.01 1.65 -0.09 0.00 -1.03 0.00 0.00 54.13 54.65 2yru s LEU 14 Cb -0.13 -3.30 0.17 0.00 0.03 0.00 0.00 46.19 42.96 2yru s LEU 14 CO 0.03 0.21 1.84 -0.29 0.23 0.00 0.00 176.35 178.37 2yru h ILE 15 N 3.33 1.24 0.00 -0.59 2.10 -1.99 -0.12 117.51 121.47 2yru h ILE 15 Ca -0.47 -0.56 -0.01 0.00 1.08 0.00 0.00 64.86 64.90 2yru h ILE 15 Cb 1.21 0.13 -0.00 0.00 -1.09 0.00 0.00 36.82 37.07 2yru h ILE 15 CO 0.66 0.26 -0.03 -0.33 -1.08 0.00 0.00 178.15 177.62 2yru h GLU 16 N 1.12 0.00 0.00 2.19 4.39 -1.96 0.25 114.58 120.56 2yru h GLU 16 Ca 0.29 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.81 2yru h GLU 16 Cb 0.00 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 2yru h GLU 16 CO -0.05 0.03 -0.86 -0.44 -1.16 0.00 0.00 179.01 176.53 2yru h ASP 17 N 0.00 0.00 0.86 1.42 5.19 -1.43 0.55 116.42 123.00 2yru h ASP 17 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2yru h ASP 17 Cb 0.38 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.89 2yru h ASP 17 CO 0.00 0.86 -1.09 0.52 -3.12 0.00 0.00 179.24 176.42 2yru n VAL 18 N -3.44 0.52 -0.04 -1.35 0.31 -0.58 -3.94 118.33 109.81 2yru n VAL 18 Ca -0.00 -0.51 -0.09 0.00 -0.01 0.00 0.00 64.34 63.72 2yru n VAL 18 Cb 0.84 -0.26 -0.14 0.00 -0.91 0.00 0.00 33.84 33.36 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 -2.57 0.69 -0.15 7.52 7.99 0.77 -3.27 117.00 127.97 2yru n LEU 19 Ca -0.00 0.31 -0.04 0.00 -0.01 0.00 0.00 56.01 56.27 2yru n LEU 19 Cb 0.54 0.23 0.02 0.00 -0.11 0.00 0.00 43.42 44.11 2yru n LEU 19 CO 0.40 0.42 0.71 0.03 -1.51 0.00 0.00 177.39 177.45 2yru h ARG 20 N 0.00 -0.10 0.02 3.23 -0.00 -0.02 0.63 114.38 118.15 2yru h ARG 20 Ca -0.35 0.01 -0.00 0.00 -0.50 0.00 0.00 59.98 59.13 2yru h ARG 20 Cb 2.07 0.02 0.00 0.00 0.00 0.00 0.00 29.97 32.06 2yru h ARG 20 CO 0.07 -0.07 -0.01 -1.00 0.00 0.00 0.00 179.97 178.96 2yru h PRO 21 N -0.10 -0.03 -0.98 0.04 0.13 -1.74 -1.44 132.00 127.88 2yru h PRO 21 Ca 0.23 0.00 0.28 0.00 -0.87 0.00 0.00 66.00 65.64 2yru h PRO 21 Cb 0.46 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 31.46 2yru h PRO 21 CO -0.55 0.66 0.54 -0.07 -0.23 0.00 0.00 178.00 178.34 2yru h LEU 22 N -0.78 0.52 -0.07 1.56 3.38 -1.47 0.40 115.31 118.86 2yru h LEU 22 Ca -0.00 0.17 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2yru h LEU 22 Cb 0.70 0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.57 2yru h LEU 22 CO 0.01 -0.03 -0.46 -0.33 0.09 0.00 0.00 178.44 177.72 2yru h GLU 23 N 0.42 0.43 -0.78 1.13 5.08 0.24 -2.85 114.58 118.25 2yru h GLU 23 Ca 0.67 -0.37 0.15 0.00 -1.00 0.00 0.00 59.36 58.81 2yru h GLU 23 Cb 1.41 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 30.65 2yru h GLU 23 CO -0.55 1.01 0.33 1.96 -1.00 0.00 0.00 179.01 180.76 2yru h GLN 24 N -0.04 0.46 0.01 2.33 1.08 0.78 0.13 115.11 119.86 2yru h GLN 24 Ca -0.04 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2yru h GLN 24 Cb 1.12 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 2yru h GLN 24 CO 0.09 0.31 -0.00 0.00 -0.95 0.00 0.00 178.83 178.28 2yru h ALA 25 N 1.55 -0.01 -0.01 3.87 0.00 -0.71 -2.89 119.26 121.05 2yru h ALA 25 Ca 0.43 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.32 2yru h ALA 25 Cb 0.65 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 2yru h ALA 25 CO -0.40 -0.46 -0.43 1.25 0.00 0.00 0.00 179.25 179.21 2yru h LEU 26 N -0.11 -1.31 -1.15 0.00 5.85 -0.87 0.14 115.31 117.86 2yru h LEU 26 Ca -0.00 0.16 0.44 0.00 0.84 0.00 0.00 57.88 59.32 2yru h LEU 26 Cb 0.10 0.51 -0.16 0.00 0.37 0.00 0.00 40.66 41.48 2yru h LEU 26 CO 0.00 -0.46 0.67 -0.62 -0.34 0.00 0.00 178.44 177.69 2yru n GLU 27 N -5.45 -0.05 -0.03 1.25 1.02 0.28 0.19 120.64 117.85 2yru n GLU 27 Ca -0.06 1.33 -0.14 0.00 -0.02 0.00 0.00 57.16 58.28 2yru n GLU 27 Cb 0.37 -2.48 -0.10 0.00 -0.02 0.00 0.00 31.44 29.21 2yru n GLU 27 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2yru h ASP 28 N 0.00 0.10 0.21 1.62 3.32 -0.62 -2.85 116.42 118.20 2yru h ASP 28 Ca 0.86 -0.64 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2yru h ASP 28 Cb 2.48 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 41.99 2yru h ASP 28 CO -0.66 0.72 -0.15 0.00 -1.72 0.00 0.00 179.24 177.44 2yru h HIS 30 N -0.35 0.12 -0.68 0.00 -0.00 0.20 1.75 115.15 116.18 2yru h HIS 30 Ca -0.01 0.00 -0.44 0.00 -0.00 0.00 0.00 60.37 59.92 2yru h HIS 30 Cb 0.31 -0.03 -0.26 0.00 -0.00 0.00 0.00 27.41 27.42 2yru h HIS 30 CO -0.10 -0.00 -0.01 0.41 -0.00 0.00 0.00 177.93 178.23 2yru n GLY 31 N -1.74 5.56 2.07 5.26 0.00 -0.20 -4.71 105.19 111.45 2yru n GLY 31 Ca 0.29 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 -3.92 -1.11 1.61 -0.00 0.44 -4.96 115.22 106.33 2yru n HIS 32 Ca 0.46 1.05 -0.29 0.00 -0.00 0.00 0.00 57.72 58.94 2yru n HIS 32 Cb 0.97 2.79 0.16 0.00 -0.00 0.00 0.00 29.99 33.91 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 -1.64 2.45 1.11 1.59 2.01 0.49 -4.99 115.64 116.67 2yru s THR 33 Ca 0.00 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.96 2yru s THR 33 Cb 0.00 -2.57 0.12 0.00 0.01 0.00 0.00 72.50 70.06 2yru s THR 33 CO 0.00 -0.19 0.02 0.29 -0.69 0.00 0.00 174.62 174.05 2yru n LYS 34 N -4.06 -1.80 -0.00 4.92 4.01 -1.26 -4.68 118.16 115.29 2yru n LYS 34 Ca 0.06 -0.51 -0.21 0.00 -0.51 0.00 0.00 58.31 57.14 2yru n LYS 34 Cb 0.55 -1.64 -0.14 0.00 -0.51 0.00 0.00 35.03 33.30 2yru n LYS 34 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 2yru h LYS 35 N -2.20 0.22 -0.04 1.97 3.11 -1.93 -2.42 116.57 115.28 2yru h LYS 35 Ca -0.48 -0.37 -0.11 0.00 -2.81 0.00 0.00 60.65 56.88 2yru h LYS 35 Cb 1.26 0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 32.62 2yru h LYS 35 CO 0.33 1.18 -0.49 -0.56 -2.81 0.00 0.00 179.45 177.10 2yru h GLN 36 N -0.38 0.09 -0.02 1.90 3.07 -1.98 0.11 115.11 117.91 2yru h GLN 36 Ca -0.29 -0.05 -0.24 0.00 0.09 0.00 0.00 58.65 58.16 2yru h GLN 36 Cb 1.70 0.00 0.02 0.00 0.08 0.00 0.00 27.48 29.28 2yru h GLN 36 CO 0.04 0.56 -0.94 0.28 0.09 0.00 0.00 178.83 178.87 2yru h VAL 37 N 0.07 1.30 0.18 1.86 2.07 -1.93 -2.06 116.25 117.74 2yru h VAL 37 Ca 0.00 -2.18 -0.01 0.00 0.82 0.00 0.00 66.70 65.33 2yru h VAL 37 Cb 0.90 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 33.03 2yru h VAL 37 CO 0.07 0.67 -0.09 0.00 0.02 0.00 0.00 177.57 178.24 2yru h ASP 39 N -0.53 0.39 -0.15 0.00 3.58 -0.85 0.14 116.42 119.00 2yru h ASP 39 Ca -0.02 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 2yru h ASP 39 Cb 0.41 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 2yru h ASP 39 CO 0.04 0.19 0.02 -0.78 -2.88 0.00 0.00 179.24 175.82 2yru h ASP 40 N 0.40 0.24 0.58 2.28 3.58 -0.96 -0.79 116.42 121.75 2yru h ASP 40 Ca 0.40 -0.27 -0.02 0.00 0.42 0.00 0.00 57.03 57.56 2yru h ASP 40 Cb 0.97 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.95 2yru h ASP 40 CO -0.13 0.46 -0.35 0.40 -2.88 0.00 0.00 179.24 176.73 2yru h ILE 41 N 0.02 0.28 -0.69 2.25 2.04 0.40 -2.54 117.51 119.27 2yru h ILE 41 Ca 0.04 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.05 2yru h ILE 41 Cb 0.32 0.28 -0.12 0.00 -0.74 0.00 0.00 36.82 36.56 2yru h ILE 41 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 178.15 178.93 2yru h SER 42 N -0.88 -0.31 -0.99 1.72 4.64 -0.87 0.45 113.55 117.30 2yru h SER 42 Ca -0.07 0.17 0.28 0.00 -0.47 0.00 0.00 61.79 61.70 2yru h SER 42 Cb 0.72 0.31 -0.14 0.00 -0.31 0.00 0.00 62.40 62.98 2yru h SER 42 CO 0.07 -0.14 0.56 0.03 -0.87 0.00 0.00 176.83 176.48 2yru h ARG 43 N 0.11 0.44 0.02 4.77 3.08 -0.73 0.19 114.38 122.27 2yru h ARG 43 Ca 0.37 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 2yru h ARG 43 Cb 0.62 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2yru h ARG 43 CO -0.60 0.29 -0.01 0.00 -1.07 0.00 0.00 179.97 178.58 2yru h ARG 44 N 0.45 -0.03 -0.37 0.04 2.47 0.14 -3.15 114.38 113.93 2yru h ARG 44 Ca 0.68 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 59.48 2yru h ARG 44 Cb 1.40 0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 29.64 2yru h ARG 44 CO -0.54 0.46 -0.29 -0.07 0.56 0.00 0.00 179.97 180.09 2yru h LEU 45 N -0.54 -0.97 -0.93 3.04 3.38 0.23 0.50 115.31 120.03 2yru h LEU 45 Ca -0.00 0.18 0.25 0.00 0.09 0.00 0.00 57.88 58.39 2yru h LEU 45 Cb 0.50 0.46 -0.17 0.00 0.09 0.00 0.00 40.66 41.55 2yru h LEU 45 CO 0.01 -0.30 0.07 0.00 0.09 0.00 0.00 178.44 178.30 2yru h ALA 46 N 0.82 1.14 0.32 1.53 0.00 -0.78 0.51 119.26 122.79 2yru h ALA 46 Ca 0.17 0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.37 2yru h ALA 46 Cb 0.51 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2yru h ALA 46 CO -0.51 -0.54 -0.15 1.25 0.00 0.00 0.00 179.25 179.31 2yru h LEU 47 N 0.06 -0.36 -0.97 0.00 6.46 -0.61 -0.88 115.31 119.01 2yru h LEU 47 Ca 0.56 -0.18 0.17 0.00 -0.12 0.00 0.00 57.88 58.31 2yru h LEU 47 Cb 1.14 0.09 -0.17 0.00 -0.73 0.00 0.00 40.66 41.00 2yru h LEU 47 CO -0.83 0.08 -0.33 0.25 -0.62 0.00 0.00 178.44 176.99 2yru h LEU 48 N -0.91 -1.21 0.49 2.25 5.85 0.26 0.90 115.31 122.94 2yru h LEU 48 Ca -0.04 0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2yru h LEU 48 Cb 0.52 0.69 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2yru h LEU 48 CO 0.07 -0.30 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.54 2yru h ARG 49 N -0.01 -0.63 -0.96 1.25 2.43 -0.15 0.19 114.38 116.51 2yru h ARG 49 Ca 0.39 0.04 0.18 0.00 -0.81 0.00 0.00 59.98 59.79 2yru h ARG 49 Cb 0.64 0.14 -0.18 0.00 -0.42 0.00 0.00 29.97 30.16 2yru h ARG 49 CO -0.98 -0.42 -0.27 0.93 -1.51 0.00 0.00 179.97 177.72 2yru h GLU 50 N -0.70 -0.00 -0.81 0.20 5.08 0.19 1.40 114.58 119.93 2yru h GLU 50 Ca -0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2yru h GLU 50 Cb 0.50 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 2yru h GLU 50 CO 0.11 -0.00 0.41 1.96 -1.00 0.00 0.00 179.01 180.49 2yru h GLN 51 N -0.00 1.15 0.67 2.33 4.20 0.84 1.22 115.11 125.51 2yru h GLN 51 Ca 0.44 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.96 2yru h GLN 51 Cb 0.68 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.25 2yru h GLN 51 CO -0.98 0.87 -0.32 2.35 -0.67 0.00 0.00 178.83 180.08 2yru h TRP 52 N 1.14 -0.84 0.45 2.96 2.91 0.46 0.18 115.95 123.21 2yru h TRP 52 Ca 0.28 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.27 2yru h TRP 52 Cb 0.08 0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 28.98 2yru h TRP 52 CO 0.01 -0.52 -0.51 0.00 -1.03 0.00 0.00 178.44 176.39 2yru h ALA 53 N -1.46 -1.12 -1.20 2.65 0.00 0.97 -1.07 119.26 118.03 2yru h ALA 53 Ca -0.09 -0.18 0.42 0.00 0.00 0.00 0.00 54.91 55.06 2yru h ALA 53 Cb 0.69 0.75 -0.13 0.00 0.00 0.00 0.00 17.79 19.11 2yru h ALA 53 CO 0.15 -1.18 0.76 0.41 0.00 0.00 0.00 179.25 179.40 2yru n GLY 54 N -1.56 -0.74 0.27 0.00 0.00 0.42 -4.71 105.19 98.87 2yru n GLY 54 Ca -0.12 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -1.44 1.43 0.09 -0.02 0.00 -0.40 -4.99 105.19 99.85 2yru n GLY 55 Ca 0.36 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 0.09 -6.91 1.61 1.79 -0.86 -3.46 116.57 108.84 2yru h LYS 56 Ca 0.00 -0.16 -0.51 0.00 -2.18 0.00 0.00 60.65 57.81 2yru h LYS 56 Cb 0.08 0.06 0.05 0.00 -1.58 0.00 0.00 32.23 30.84 2yru h LYS 56 CO 0.00 0.87 0.51 -0.51 -1.08 0.00 0.00 179.45 179.24 2yru s LEU 57 N -6.59 4.29 0.64 2.94 1.43 -1.10 -5.01 118.68 115.28 2yru s LEU 57 Ca -0.05 2.36 -0.12 0.00 -1.03 0.00 0.00 54.13 55.30 2yru s LEU 57 Cb 0.08 -3.91 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 2yru s LEU 57 CO 0.83 -0.55 1.04 -0.55 0.23 0.00 0.00 176.35 177.35 2yru s SER 58 N -1.02 5.85 0.15 2.29 0.15 -1.26 -4.93 113.70 114.93 2yru s SER 58 Ca 0.54 1.55 -0.16 0.00 0.70 0.00 0.00 55.95 58.58 2yru s SER 58 Cb -0.32 -2.49 0.01 0.00 -1.71 0.00 0.00 66.02 61.52 2yru s SER 58 CO 0.40 -1.13 1.81 0.40 1.20 0.00 0.00 173.24 175.92 2yru h ILE 59 N -0.34 1.11 0.00 6.45 2.04 -1.98 -0.24 117.51 124.55 2yru h ILE 59 Ca -0.44 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2yru h ILE 59 Cb 1.20 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2yru h ILE 59 CO 0.59 0.11 0.00 -0.81 0.00 0.00 0.00 178.15 178.04 2yru n PRO 60 N -4.80 0.29 0.10 2.37 -0.04 -1.26 -2.09 135.00 129.57 2yru n PRO 60 Ca 0.00 0.08 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 2yru n PRO 60 Cb 0.03 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.98 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 0.11 0.07 0.52 2.07 -1.43 -3.24 116.25 114.36 2yru h VAL 61 Ca 0.00 -1.22 -0.33 0.00 0.82 0.00 0.00 66.70 65.97 2yru h VAL 61 Cb 0.23 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 2yru h VAL 61 CO 0.00 0.06 -1.85 0.29 0.02 0.00 0.00 177.57 176.09 2yru n LYS 62 N -2.75 0.69 -0.21 1.57 5.02 -0.79 -3.10 118.16 118.58 2yru n LYS 62 Ca -0.02 0.35 0.12 0.00 -2.02 0.00 0.00 58.31 56.74 2yru n LYS 62 Cb 0.61 -1.69 0.42 0.00 -0.02 0.00 0.00 35.03 34.34 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 -0.31 0.59 -0.02 1.97 1.57 -1.57 0.16 116.57 118.96 2yru h LYS 63 Ca -0.43 -0.04 -0.22 0.00 -1.87 0.00 0.00 60.65 58.10 2yru h LYS 63 Cb 1.79 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.96 2yru h LYS 63 CO -0.04 0.39 -0.89 0.00 -0.57 0.00 0.00 179.45 178.34 2yru h ARG 64 N 0.61 0.41 0.43 3.15 3.08 -1.70 -3.05 114.38 117.31 2yru h ARG 64 Ca 0.39 -0.42 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2yru h ARG 64 Cb 0.67 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2yru h ARG 64 CO -0.15 1.08 -0.21 0.52 -1.07 0.00 0.00 179.97 180.13 2yru h MET 65 N 0.25 -0.56 -0.98 0.04 2.86 -0.74 -2.01 114.93 113.79 2yru h MET 65 Ca -0.07 0.04 0.20 0.00 -2.06 0.00 0.00 59.70 57.81 2yru h MET 65 Cb 1.51 0.13 -0.09 0.00 0.06 0.00 0.00 31.60 33.20 2yru h MET 65 CO 0.15 -0.30 0.62 0.00 1.06 0.00 0.00 176.91 178.44 2yru h ALA 66 N -0.19 1.91 0.25 6.32 0.00 -1.01 -0.69 119.26 125.85 2yru h ALA 66 Ca -0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2yru h ALA 66 Cb 0.51 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2yru h ALA 66 CO 0.10 -0.25 -0.15 -0.07 0.00 0.00 0.00 179.25 178.88 2yru h LEU 67 N 0.61 -0.36 -0.97 0.00 3.38 -1.35 0.45 115.31 117.06 2yru h LEU 67 Ca 0.54 0.02 0.32 0.00 0.09 0.00 0.00 57.88 58.85 2yru h LEU 67 Cb 1.05 0.10 -0.17 0.00 0.09 0.00 0.00 40.66 41.73 2yru h LEU 67 CO -0.30 -0.23 0.35 0.25 0.09 0.00 0.00 178.44 178.60 2yru h LEU 68 N -0.37 0.09 0.13 1.67 6.46 -0.66 0.88 115.31 123.50 2yru h LEU 68 Ca -0.03 0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 2yru h LEU 68 Cb 0.29 0.30 0.00 0.00 -0.73 0.00 0.00 40.66 40.52 2yru h LEU 68 CO 0.04 -0.29 -0.06 0.58 -0.62 0.00 0.00 178.44 178.09 2yru h VAL 69 N 0.12 0.93 -1.09 1.05 2.07 -0.73 -0.97 116.25 117.63 2yru h VAL 69 Ca 0.69 -0.23 0.31 0.00 0.82 0.00 0.00 66.70 68.30 2yru h VAL 69 Cb 1.61 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.41 2yru h VAL 69 CO -0.75 0.05 0.78 1.56 0.02 0.00 0.00 177.57 179.24 2yru h GLN 70 N -0.27 0.03 0.12 1.57 1.08 0.55 0.53 115.11 118.72 2yru h GLN 70 Ca -0.02 -0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.92 2yru h GLN 70 Cb 0.22 -0.01 0.03 0.00 -0.05 0.00 0.00 27.48 27.67 2yru h GLN 70 CO 0.03 0.02 -1.10 0.93 -0.95 0.00 0.00 178.83 177.76 2yru h GLU 71 N 0.03 0.54 0.00 1.46 4.39 -0.36 -2.93 114.58 117.71 2yru h GLU 71 Ca 0.53 -0.73 -0.00 0.00 0.34 0.00 0.00 59.36 59.49 2yru h GLU 71 Cb 2.04 0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 30.94 2yru h GLU 71 CO -0.03 1.32 -0.02 1.25 -1.16 0.00 0.00 179.01 180.37 2yru h LEU 72 N 0.10 0.00 0.13 1.33 6.46 0.13 1.08 115.31 124.54 2yru h LEU 72 Ca -0.17 0.00 -0.29 0.00 -0.12 0.00 0.00 57.88 57.30 2yru h LEU 72 Cb 1.80 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 41.75 2yru h LEU 72 CO 0.21 0.02 -1.29 -0.07 -0.62 0.00 0.00 178.44 176.69 2yru h LEU 73 N 0.00 0.64 -0.52 2.25 3.38 -0.92 -3.13 115.31 117.00 2yru h LEU 73 Ca -0.00 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2yru h LEU 73 Cb 0.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2yru h LEU 73 CO 0.00 1.49 -0.09 1.41 0.09 0.00 0.00 178.44 181.34 2yru n HIS 74 N -3.65 0.00 -1.00 1.13 8.25 -0.29 -4.88 115.22 114.77 2yru n HIS 74 Ca -0.12 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.34 2yru n HIS 74 Cb 1.02 -0.08 -0.00 0.00 1.12 0.00 0.00 29.99 32.05 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 -0.50 0.00 -1.05 4.41 8.25 0.90 -4.91 115.22 122.32 2yru n HIS 75 Ca 0.17 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.45 2yru n HIS 75 Cb 0.30 -0.08 -0.14 0.00 1.12 0.00 0.00 29.99 31.20 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 -2.99 2.35 -0.27 -0.41 1.13 0.34 -4.62 117.38 112.91 2yru n GLN 76 Ca -0.00 -1.25 -0.05 0.00 -1.94 0.00 0.00 57.00 53.76 2yru n GLN 76 Cb 0.00 -2.17 0.00 0.00 0.11 0.00 0.00 30.24 28.18 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 3.48 -1.11 -0.79 1.08 4.06 -1.91 0.62 115.95 121.38 2yru h TRP 77 Ca 0.34 0.09 0.14 0.00 2.06 0.00 0.00 58.89 61.51 2yru h TRP 77 Cb 1.23 0.59 -0.14 0.00 -1.00 0.00 0.00 29.16 29.84 2yru h TRP 77 CO 1.80 -0.40 -0.33 0.22 -3.56 0.00 0.00 178.44 176.18 2yru h ASP 78 N -0.13 -1.17 0.13 -3.49 3.58 -1.95 0.65 116.42 114.04 2yru h ASP 78 Ca 0.25 0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.96 2yru h ASP 78 Cb 0.56 0.63 -0.00 0.00 1.72 0.00 0.00 39.33 42.23 2yru h ASP 78 CO -0.78 -0.29 -0.09 0.00 -2.88 0.00 0.00 179.24 175.20 2yru h ALA 79 N 1.31 -0.20 -0.74 -0.78 0.00 -0.41 -0.83 119.26 117.62 2yru h ALA 79 Ca 0.31 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.35 2yru h ALA 79 Cb 0.58 0.11 -0.12 0.00 0.00 0.00 0.00 17.79 18.36 2yru h ALA 79 CO -0.83 -0.62 0.10 0.00 0.00 0.00 0.00 179.25 177.90 2yru h ALA 80 N 0.65 0.88 0.44 0.00 0.00 0.34 0.26 119.26 121.83 2yru h ALA 80 Ca -0.01 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2yru h ALA 80 Cb 0.19 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2yru h ALA 80 CO 0.00 -0.39 -0.30 0.22 0.00 0.00 0.00 179.25 178.77 2yru h ASP 81 N 0.18 -0.78 -1.00 0.00 1.82 0.73 -0.04 116.42 117.33 2yru h ASP 81 Ca 0.42 0.05 0.18 0.00 -0.39 0.00 0.00 57.03 57.29 2yru h ASP 81 Cb 0.74 0.24 -0.17 0.00 0.68 0.00 0.00 39.33 40.82 2yru h ASP 81 CO -0.58 -0.47 -0.32 -0.78 -1.61 0.00 0.00 179.24 175.48 2yru h ASP 82 N -0.72 -1.19 0.88 2.28 3.58 0.44 0.45 116.42 122.13 2yru h ASP 82 Ca -0.04 0.31 -0.04 0.00 0.42 0.00 0.00 57.03 57.67 2yru h ASP 82 Cb 0.61 0.69 0.00 0.00 1.72 0.00 0.00 39.33 42.35 2yru h ASP 82 CO 0.02 -0.31 -0.47 0.40 -2.88 0.00 0.00 179.24 176.00 2yru h ILE 83 N -0.00 0.00 -0.99 2.25 2.04 -0.82 -1.92 117.51 118.08 2yru h ILE 83 Ca 0.41 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.51 2yru h ILE 83 Cb 0.66 0.00 -0.19 0.00 -0.74 0.00 0.00 36.82 36.55 2yru h ILE 83 CO -1.01 0.00 -0.12 -0.74 0.00 0.00 0.00 178.15 176.28 2yru h HIS 84 N -1.24 -0.30 0.01 1.37 -0.00 0.13 0.63 115.15 115.75 2yru h HIS 84 Ca -0.12 0.08 0.03 0.00 -0.00 0.00 0.00 60.37 60.36 2yru h HIS 84 Cb 0.97 0.29 -0.04 0.00 -0.00 0.00 0.00 27.41 28.63 2yru h HIS 84 CO -0.04 -0.43 -0.26 0.00 -0.00 0.00 0.00 177.93 177.19 2yru h ARG 85 N 0.00 -0.40 -1.07 5.26 2.47 0.11 0.30 114.38 121.05 2yru h ARG 85 Ca 0.54 0.03 0.28 0.00 -1.26 0.00 0.00 59.98 59.57 2yru h ARG 85 Cb 0.97 0.09 -0.09 0.00 -1.65 0.00 0.00 29.97 29.29 2yru h ARG 85 CO -0.98 -0.27 0.69 0.77 0.56 0.00 0.00 179.97 180.75 2yru h SER 86 N -0.41 0.40 0.34 7.04 0.02 0.10 1.39 113.55 122.42 2yru h SER 86 Ca 0.06 0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.94 2yru h SER 86 Cb 0.49 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 2yru h SER 86 CO -0.22 0.06 -0.62 -0.07 -1.14 0.00 0.00 176.83 174.83 2yru h LEU 87 N 0.34 0.31 0.00 5.07 3.38 0.09 -2.50 115.31 122.00 2yru h LEU 87 Ca 0.61 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2yru h LEU 87 Cb 1.64 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.30 2yru h LEU 87 CO -0.29 0.86 0.00 0.23 0.09 0.00 0.00 178.44 179.33 2yru n MET 88 N -3.87 0.15 -0.04 1.13 2.81 0.46 -1.08 117.12 116.68 2yru n MET 88 Ca -0.03 0.10 -0.03 0.00 -1.81 0.00 0.00 57.70 55.93 2yru n MET 88 Cb 0.63 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.61 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 0.35 0.00 2.03 2.07 -0.64 -3.37 116.25 116.69 2yru h VAL 89 Ca 0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2yru h VAL 89 Cb 0.30 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2yru h VAL 89 CO 0.00 0.12 0.00 0.47 0.02 0.00 0.00 177.57 178.18 2yru n ASP 90 N -4.76 0.00 -3.46 0.57 8.00 -1.22 -4.58 116.55 111.10 2yru n ASP 90 Ca -0.02 0.11 -0.39 0.00 0.71 0.00 0.00 54.79 55.19 2yru n ASP 90 Cb 0.10 -0.49 -0.02 0.00 -0.02 0.00 0.00 41.12 40.69 2yru n ASP 90 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2yru n HIS 91 N -2.38 2.75 0.48 1.24 8.25 -0.24 -4.40 115.22 120.92 2yru n HIS 91 Ca 0.00 -2.97 0.12 0.00 -0.26 0.00 0.00 57.72 54.61 2yru n HIS 91 Cb 0.00 -2.46 0.19 0.00 1.12 0.00 0.00 29.99 28.84 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 3.40 0.00 0.00 1.59 3.04 -1.59 -3.21 116.25 119.48 2yru h VAL 92 Ca 0.74 -0.61 0.00 0.00 -1.01 0.00 0.00 66.70 65.82 2yru h VAL 92 Cb 0.41 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 31.00 2yru h VAL 92 CO 1.81 0.00 -0.62 0.41 -1.01 0.00 0.00 177.57 178.16 2yru n THR 93 N -2.33 1.17 -0.27 3.17 -1.04 -1.26 -3.45 114.28 110.27 2yru n THR 93 Ca 0.03 0.24 -0.02 0.00 -2.04 0.00 0.00 64.05 62.27 2yru n THR 93 Cb 0.46 -2.20 0.04 0.00 -1.82 0.00 0.00 70.33 66.82 2yru n THR 93 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2yru h GLU 94 N -0.80 -0.07 -0.45 -2.82 4.39 -1.92 1.12 114.58 114.04 2yru h GLU 94 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 2yru h GLU 94 Cb 0.62 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 2yru h GLU 94 CO 0.00 -0.05 0.17 -0.39 -1.16 0.00 0.00 179.01 177.58 2yru h VAL 95 N -0.07 1.17 -2.15 3.13 -1.51 -1.79 -3.44 116.25 111.60 2yru h VAL 95 Ca 0.31 -0.55 -0.26 0.00 -1.23 0.00 0.00 66.70 64.97 2yru h VAL 95 Cb 0.58 0.65 0.15 0.00 -2.13 0.00 0.00 31.29 30.53 2yru h VAL 95 CO -0.81 0.21 -0.28 -1.54 -1.23 0.00 0.00 177.57 173.92 2yru n SER 96 N -4.36 -3.16 0.00 4.19 3.41 0.39 0.90 113.62 114.99 2yru n SER 96 Ca 0.03 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.19 2yru n SER 96 Cb 0.16 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 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 -2.49 -0.42 0.00 4.33 6.02 -1.26 -3.97 117.38 119.59 2yru n GLN 97 Ca 0.07 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 2yru n GLN 97 Cb 0.40 -3.78 0.00 0.00 1.02 0.00 0.00 30.24 27.89 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 -2.18 -0.44 -0.43 1.08 4.27 -1.19 -4.80 117.44 113.76 2yru n TRP 98 Ca 0.00 0.00 0.35 0.00 -3.89 0.00 0.00 57.50 53.96 2yru n TRP 98 Cb 0.10 0.09 0.57 0.00 -1.36 0.00 0.00 31.31 30.71 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 -1.45 -0.02 0.14 -2.67 1.56 0.26 0.21 117.12 115.15 2yru n MET 99 Ca 0.00 0.97 -0.13 0.00 -0.27 0.00 0.00 57.70 58.27 2yru n MET 99 Cb 0.00 -1.98 -0.06 0.00 2.15 0.00 0.00 33.22 33.33 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 0.55 -0.31 1.12 -1.51 -1.91 -1.94 116.25 112.25 2yru h VAL 100 Ca 0.72 0.00 0.06 0.00 -1.23 0.00 0.00 66.70 66.25 2yru h VAL 100 Cb 2.45 0.55 -0.08 0.00 -2.13 0.00 0.00 31.29 32.08 2yru h VAL 100 CO -0.28 0.00 -0.38 1.23 -1.23 0.00 0.00 177.57 176.91 2yru h GLY 101 N -0.43 -0.46 -0.38 5.19 0.00 0.22 -0.94 103.07 106.27 2yru h GLY 101 Ca 0.01 0.47 0.10 0.00 0.00 0.00 0.00 47.33 47.91 2yru h GLY 101 CO -0.07 -0.21 -0.31 -2.08 0.00 0.00 0.00 176.54 173.88 2yru h VAL 102 N -0.35 0.20 -0.80 4.60 2.07 -1.37 0.59 116.25 121.20 2yru h VAL 102 Ca 0.13 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.84 2yru h VAL 102 Cb 0.57 0.20 -0.13 0.00 -1.52 0.00 0.00 31.29 30.41 2yru h VAL 102 CO -0.49 0.00 0.12 0.50 0.02 0.00 0.00 177.57 177.71 2yru h LYS 103 N -0.15 0.17 0.17 1.57 3.64 -0.41 0.32 116.57 121.86 2yru h LYS 103 Ca 0.24 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 2yru h LYS 103 Cb 0.54 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2yru h LYS 103 CO -0.66 0.11 -0.08 -0.09 -2.27 0.00 0.00 179.45 176.46 2yru h ARG 104 N 0.17 -0.21 -0.59 1.90 9.65 0.73 -2.37 114.38 123.66 2yru h ARG 104 Ca 0.46 0.01 0.12 0.00 -1.10 0.00 0.00 59.98 59.47 2yru h ARG 104 Cb 0.86 0.05 -0.12 0.00 -1.39 0.00 0.00 29.97 29.37 2yru h ARG 104 CO -0.64 0.08 -0.24 1.25 2.80 0.00 0.00 179.97 183.23 2yru h LEU 105 N -0.51 -0.84 0.07 3.80 5.85 0.20 1.16 115.31 125.05 2yru h LEU 105 Ca -0.02 0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2yru h LEU 105 Cb 0.39 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 2yru h LEU 105 CO 0.04 -0.26 -0.32 0.40 -0.34 0.00 0.00 178.44 177.96 2yru h ILE 106 N -0.09 0.00 -0.71 4.05 2.04 -0.40 1.01 117.51 123.41 2yru h ILE 106 Ca 0.27 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.27 2yru h ILE 106 Cb 0.51 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.49 2yru h ILE 106 CO -0.65 0.00 0.19 0.00 0.00 0.00 0.00 178.15 177.69 2yru h ALA 107 N -0.94 0.92 0.49 1.87 0.00 -0.72 0.45 119.26 121.32 2yru h ALA 107 Ca -0.00 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2yru h ALA 107 Cb 0.46 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2yru h ALA 107 CO -0.18 -0.30 -0.41 0.93 0.00 0.00 0.00 179.25 179.29 2yru h GLU 108 N 0.31 -0.85 -0.52 0.00 5.08 0.24 0.57 114.58 119.41 2yru h GLU 108 Ca 0.39 0.06 0.07 0.00 -1.00 0.00 0.00 59.36 58.88 2yru h GLU 108 Cb 0.63 0.19 -0.10 0.00 0.50 0.00 0.00 28.75 29.98 2yru h GLU 108 CO -0.46 -0.56 -0.50 0.87 -1.00 0.00 0.00 179.01 177.36 2yru h LYS 109 N -0.88 -0.29 -0.36 2.33 1.79 0.18 0.27 116.57 119.61 2yru h LYS 109 Ca -0.06 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 58.50 2yru h LYS 109 Cb 0.74 0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 31.38 2yru h LYS 109 CO -0.01 -0.19 -0.18 -0.22 -1.08 0.00 0.00 179.45 177.77 2yru h LYS 110 N -0.30 -0.12 -0.42 3.15 3.64 -0.76 -1.35 116.57 120.42 2yru h LYS 110 Ca 0.13 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 2yru h LYS 110 Cb 0.57 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.33 2yru h LYS 110 CO -0.66 -0.08 -0.36 1.03 -2.27 0.00 0.00 179.45 177.11 2yru h SER 111 N -0.13 -1.21 -0.79 4.20 0.87 0.27 -0.92 113.55 115.84 2yru h SER 111 Ca 0.18 0.20 0.09 0.00 -1.23 0.00 0.00 61.79 61.04 2yru h SER 111 Cb 0.40 0.56 -0.12 0.00 -0.44 0.00 0.00 62.40 62.80 2yru h SER 111 CO -0.44 -0.34 -0.51 -0.07 -0.53 0.00 0.00 176.83 174.94 2yru h LEU 112 N -0.27 -1.83 -0.50 2.23 3.38 0.52 -0.67 115.31 118.17 2yru h LEU 112 Ca 0.16 0.29 0.05 0.00 0.09 0.00 0.00 57.88 58.47 2yru h LEU 112 Cb 0.56 0.82 -0.06 0.00 0.09 0.00 0.00 40.66 42.07 2yru h LEU 112 CO -0.56 -0.30 -0.32 -1.28 0.09 0.00 0.00 178.44 176.07 2yru h SER 113 N -0.13 -1.16 0.00 -0.43 0.87 -0.72 -3.47 113.55 108.52 2yru h SER 113 Ca 0.18 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2yru h SER 113 Cb 0.51 0.51 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2yru h SER 113 CO -0.83 -0.14 0.00 0.61 -0.53 0.00 0.00 176.83 175.95 2yru n GLY 114 N -1.15 2.14 3.78 5.77 0.00 -0.26 -5.14 105.19 110.34 2yru n GLY 114 Ca 0.01 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.49 0.55 -0.05 1.61 0.04 -1.26 -5.06 135.00 130.34 2yru s PRO 115 Ca 0.00 0.07 0.06 0.00 0.04 0.00 0.00 61.00 61.17 2yru s PRO 115 Cb 0.00 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.74 2yru s PRO 115 CO 0.00 -2.55 -0.23 -1.54 0.04 0.00 0.00 177.00 172.71 2yru s SER 116 N -4.18 2.86 0.03 6.66 1.04 -1.26 -5.12 113.70 113.72 2yru s SER 116 Ca 0.67 -0.47 -0.23 0.00 0.48 0.00 0.00 55.95 56.40 2yru s SER 116 Cb -0.11 -0.74 0.05 0.00 0.10 0.00 0.00 66.02 65.32 2yru s SER 116 CO 0.54 0.23 0.54 -0.55 0.98 0.00 0.00 173.24 174.98 2yru s SER 117 N -0.16 -0.47 0.00 7.02 0.15 -1.26 -5.31 113.70 113.67 2yru s SER 117 Ca -0.02 0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2yru s SER 117 Cb -0.13 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.67 2yru s SER 117 CO 0.03 -0.69 0.00 0.61 1.20 0.00 0.00 173.24 174.39