#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x59 n SER 2 N 0.00 -1.26 -4.27 1.61 2.88 -1.26 -5.06 113.62 106.26 1x59 n SER 2 Ca 0.00 -3.35 -0.38 0.00 -1.33 0.00 0.00 58.87 53.81 1x59 n SER 2 Cb 0.00 1.04 -0.03 0.00 -0.75 0.00 0.00 64.21 64.46 1x59 n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x59 n SER 3 N 0.22 3.69 0.00 -3.46 7.64 -1.26 -4.78 113.62 115.67 1x59 n SER 3 Ca 0.10 -2.79 0.00 0.00 1.01 0.00 0.00 58.87 57.20 1x59 n SER 3 Cb 0.71 -1.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.30 1x59 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x59 n GLY 4 N 5.16 -1.33 4.00 0.23 0.00 -1.26 -5.07 105.19 106.92 1x59 n GLY 4 Ca 0.48 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 1x59 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x59 n SER 5 N 0.99 -2.44 -3.89 1.61 3.41 -1.26 -4.97 113.62 107.06 1x59 n SER 5 Ca 0.00 -1.03 -0.10 0.00 -0.26 0.00 0.00 58.87 57.48 1x59 n SER 5 Cb 0.00 -1.24 -0.09 0.00 -0.26 0.00 0.00 64.21 62.62 1x59 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x59 s SER 6 N -3.89 0.11 0.00 4.04 0.01 -1.26 -5.08 113.70 107.62 1x59 s SER 6 Ca 0.32 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1x59 s SER 6 Cb -0.18 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1x59 s SER 6 CO 0.77 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 174.54 1x59 n GLY 7 N 0.89 -0.65 0.16 3.44 0.00 -1.26 -5.07 105.19 102.69 1x59 n GLY 7 Ca -0.20 0.21 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 1x59 n GLY 7 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1x59 h MET 8 N 0.00 0.11 -0.27 1.61 0.00 -1.99 -0.70 114.93 113.70 1x59 h MET 8 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 59.70 59.58 1x59 h MET 8 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 31.60 31.60 1x59 h MET 8 CO 0.00 0.64 -0.03 0.00 0.00 0.00 0.00 176.91 177.52 1x59 h ALA 9 N 1.35 0.36 -0.34 6.32 0.00 -1.99 -2.09 119.26 122.88 1x59 h ALA 9 Ca -0.00 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.71 1x59 h ALA 9 Cb 1.02 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1x59 h ALA 9 CO 0.08 0.13 0.04 0.93 0.00 0.00 0.00 179.25 180.43 1x59 h GLU 10 N 0.26 0.14 -0.16 0.00 4.39 -1.94 -0.63 114.58 116.64 1x59 h GLU 10 Ca 0.07 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.79 1x59 h GLU 10 Cb 0.48 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 1x59 h GLU 10 CO 0.02 0.10 -0.01 -0.09 -1.16 0.00 0.00 179.01 177.87 1x59 h ARG 11 N 0.15 0.04 -0.88 2.33 9.65 -0.99 -0.89 114.38 123.79 1x59 h ARG 11 Ca 0.16 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.02 1x59 h ARG 11 Cb 0.20 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 1x59 h ARG 11 CO -0.23 0.03 0.49 0.00 2.80 0.00 0.00 179.97 183.06 1x59 h ALA 12 N 1.14 1.13 -0.14 2.80 0.00 -1.14 0.23 119.26 123.28 1x59 h ALA 12 Ca 0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1x59 h ALA 12 Cb 0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1x59 h ALA 12 CO -0.14 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.71 1x59 h ALA 13 N 1.27 1.69 0.00 0.00 0.00 -0.46 -1.25 119.26 120.51 1x59 h ALA 13 Ca 0.31 -0.12 -0.27 0.00 0.00 0.00 0.00 54.91 54.83 1x59 h ALA 13 Cb 0.01 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1x59 h ALA 13 CO -0.05 0.23 -1.71 1.28 0.00 0.00 0.00 179.25 179.00 1x59 n LEU 14 N -4.38 0.79 -0.21 0.00 4.77 -0.40 -2.88 117.00 114.68 1x59 n LEU 14 Ca -0.01 0.37 -0.04 0.00 -0.03 0.00 0.00 56.01 56.31 1x59 n LEU 14 Cb 0.18 0.18 0.07 0.00 -2.33 0.00 0.00 43.42 41.52 1x59 n LEU 14 CO 0.36 0.35 1.10 -0.33 -1.33 0.00 0.00 177.39 177.54 1x59 h GLU 15 N 0.00 0.70 -0.23 3.23 4.39 -0.40 -0.95 114.58 121.32 1x59 h GLU 15 Ca -0.28 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.43 1x59 h GLU 15 Cb 1.95 -0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 30.39 1x59 h GLU 15 CO 0.07 0.46 -0.14 0.93 -1.16 0.00 0.00 179.01 179.17 1x59 h GLU 16 N 0.72 -0.12 -0.38 2.33 3.07 -1.29 0.11 114.58 119.01 1x59 h GLU 16 Ca 0.26 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 1x59 h GLU 16 Cb 0.06 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 1x59 h GLU 16 CO -0.12 -0.08 0.25 -0.07 -1.40 0.00 0.00 179.01 177.59 1x59 h LEU 17 N -0.12 0.44 0.10 1.33 3.38 -1.30 0.80 115.31 119.93 1x59 h LEU 17 Ca 0.13 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1x59 h LEU 17 Cb 0.32 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1x59 h LEU 17 CO -0.31 0.32 -0.05 0.58 0.09 0.00 0.00 178.44 179.07 1x59 h VAL 18 N 0.52 0.97 0.09 1.22 2.07 -0.91 -0.27 116.25 119.94 1x59 h VAL 18 Ca 0.14 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.41 1x59 h VAL 18 Cb -0.06 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1x59 h VAL 18 CO -0.03 0.07 -0.16 0.50 0.02 0.00 0.00 177.57 177.96 1x59 h LYS 19 N -0.26 -0.30 -0.54 1.57 3.11 -0.54 0.13 116.57 119.74 1x59 h LYS 19 Ca -0.01 0.02 -0.12 0.00 -2.81 0.00 0.00 60.65 57.73 1x59 h LYS 19 Cb 0.21 0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 31.49 1x59 h LYS 19 CO 0.02 -0.20 -0.11 -0.07 -2.81 0.00 0.00 179.45 176.28 1x59 h LEU 20 N -0.31 1.04 -0.67 5.20 -0.00 -0.88 -0.27 115.31 119.41 1x59 h LEU 20 Ca 0.02 -0.35 -0.07 0.00 -0.00 0.00 0.00 57.88 57.48 1x59 h LEU 20 Cb 0.33 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.68 1x59 h LEU 20 CO -0.09 1.15 0.16 -0.61 -0.00 0.00 0.00 178.44 179.05 1x59 h GLN 21 N 0.91 1.08 -0.16 1.13 5.75 -0.73 0.13 115.11 123.22 1x59 h GLN 21 Ca 0.14 -0.26 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 1x59 h GLN 21 Cb 0.68 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.09 1x59 h GLN 21 CO 0.05 0.96 0.04 0.78 -2.65 0.00 0.00 178.83 178.01 1x59 h GLY 22 N 1.01 0.27 0.43 2.39 0.00 -0.57 -0.23 103.07 106.37 1x59 h GLY 22 Ca 0.21 -0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.39 1x59 h GLY 22 CO 0.00 0.16 -0.32 0.83 0.00 0.00 0.00 176.54 177.21 1x59 h GLU 23 N 0.06 -0.51 -0.61 4.80 4.39 -0.94 -0.92 114.58 120.84 1x59 h GLU 23 Ca 0.05 0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.84 1x59 h GLU 23 Cb 0.26 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 1x59 h GLU 23 CO 0.00 -0.34 0.32 -0.09 -1.16 0.00 0.00 179.01 177.74 1x59 h ARG 24 N -0.53 0.58 -0.17 2.33 2.43 -0.67 0.17 114.38 118.52 1x59 h ARG 24 Ca 0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1x59 h ARG 24 Cb 0.57 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1x59 h ARG 24 CO -0.19 0.39 0.11 0.28 -1.51 0.00 0.00 179.97 179.04 1x59 h VAL 25 N 0.60 1.03 -0.18 0.20 2.07 -0.80 0.47 116.25 119.64 1x59 h VAL 25 Ca 0.27 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1x59 h VAL 25 Cb 0.18 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1x59 h VAL 25 CO -0.18 0.04 0.04 -0.09 0.02 0.00 0.00 177.57 177.40 1x59 h ARG 26 N 0.22 0.25 0.11 1.57 2.43 -0.18 -1.17 114.38 117.60 1x59 h ARG 26 Ca 0.07 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 58.96 1x59 h ARG 26 Cb -0.02 -0.05 0.03 0.00 -0.42 0.00 0.00 29.97 29.51 1x59 h ARG 26 CO -0.02 0.23 -1.03 0.78 -1.51 0.00 0.00 179.97 178.42 1x59 h GLY 27 N 0.42 0.58 1.02 2.80 0.00 -0.23 -3.09 103.07 104.56 1x59 h GLY 27 Ca 0.06 -1.22 -0.00 0.00 0.00 0.00 0.00 47.33 46.17 1x59 h GLY 27 CO -0.00 1.07 0.56 1.41 0.00 0.00 0.00 176.54 179.58 1x59 h LEU 28 N 0.06 1.09 -0.02 3.11 3.38 0.42 0.13 115.31 123.47 1x59 h LEU 28 Ca -0.16 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1x59 h LEU 28 Cb 1.75 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.21 1x59 h LEU 28 CO 0.20 0.83 -0.05 0.11 0.09 0.00 0.00 178.44 179.61 1x59 h LYS 29 N 1.26 -0.08 -0.82 1.13 1.57 -1.34 -1.21 116.57 117.07 1x59 h LYS 29 Ca 0.33 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.16 1x59 h LYS 29 Cb -0.07 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.20 1x59 h LYS 29 CO -0.06 -0.06 0.51 0.37 -0.57 0.00 0.00 179.45 179.64 1x59 h GLN 30 N -0.09 0.93 0.00 3.15 4.15 -1.26 -2.12 115.11 119.87 1x59 h GLN 30 Ca 0.03 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1x59 h GLN 30 Cb 0.13 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.61 1x59 h GLN 30 CO -0.07 0.62 0.00 0.00 -1.93 0.00 0.00 178.83 177.44 1x59 n GLN 31 N -4.62 0.08 -3.72 1.69 10.64 0.37 -4.88 117.38 116.95 1x59 n GLN 31 Ca 0.11 0.19 -0.23 0.00 -1.83 0.00 0.00 57.00 55.25 1x59 n GLN 31 Cb 0.14 -1.50 0.03 0.00 -0.86 0.00 0.00 30.24 28.04 1x59 n GLN 31 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1x59 n LYS 32 N -1.42 -4.24 -1.12 2.61 5.02 -0.80 -5.01 118.16 113.19 1x59 n LYS 32 Ca 0.05 0.58 -0.29 0.00 -2.02 0.00 0.00 58.31 56.63 1x59 n LYS 32 Cb 0.17 -5.00 0.16 0.00 -0.02 0.00 0.00 35.03 30.33 1x59 n LYS 32 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x59 s ALA 33 N -3.69 1.27 0.55 7.82 0.00 -0.52 -5.00 121.76 122.19 1x59 s ALA 33 Ca 0.06 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.72 1x59 s ALA 33 Cb -0.02 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1x59 s ALA 33 CO 0.83 -2.58 1.24 -1.12 0.00 0.00 0.00 175.76 174.12 1x59 s SER 34 N -3.32 5.40 0.19 0.00 0.01 -1.26 -4.89 113.70 109.83 1x59 s SER 34 Ca 0.64 2.47 -0.11 0.00 1.31 0.00 0.00 55.95 60.27 1x59 s SER 34 Cb -0.19 -2.61 0.12 0.00 0.21 0.00 0.00 66.02 63.55 1x59 s SER 34 CO 0.58 -1.46 1.81 0.00 0.41 0.00 0.00 173.24 174.58 1x59 h ALA 35 N 1.26 0.88 -0.53 1.44 0.00 -1.99 -2.21 119.26 118.11 1x59 h ALA 35 Ca -0.50 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 1x59 h ALA 35 Cb 1.29 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1x59 h ALA 35 CO 0.57 0.39 0.30 0.93 0.00 0.00 0.00 179.25 181.44 1x59 h GLU 36 N 0.95 0.74 -0.12 0.00 4.39 -1.99 0.13 114.58 118.68 1x59 h GLU 36 Ca 0.24 -0.08 0.02 0.00 0.34 0.00 0.00 59.36 59.87 1x59 h GLU 36 Cb 0.03 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 1x59 h GLU 36 CO -0.04 0.57 0.02 1.25 -1.16 0.00 0.00 179.01 179.65 1x59 h LEU 37 N 0.72 -0.01 -0.65 1.33 5.85 -1.90 -1.38 115.31 119.28 1x59 h LEU 37 Ca 0.19 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1x59 h LEU 37 Cb 0.04 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1x59 h LEU 37 CO -0.03 0.02 0.22 0.40 -0.34 0.00 0.00 178.44 178.71 1x59 h ILE 38 N 0.07 1.25 -0.87 4.05 2.04 -0.97 0.72 117.51 123.79 1x59 h ILE 38 Ca 0.05 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 1x59 h ILE 38 Cb 0.05 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 1x59 h ILE 38 CO -0.08 0.32 0.48 -0.33 0.00 0.00 0.00 178.15 178.54 1x59 h GLU 39 N 0.93 1.21 -0.09 2.37 4.39 -0.84 0.66 114.58 123.22 1x59 h GLU 39 Ca 0.21 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1x59 h GLU 39 Cb 0.26 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1x59 h GLU 39 CO -0.01 0.88 0.00 0.93 -1.16 0.00 0.00 179.01 179.65 1x59 h GLU 40 N 1.22 0.16 -0.25 2.33 4.39 -0.75 -1.28 114.58 120.40 1x59 h GLU 40 Ca 0.31 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.90 1x59 h GLU 40 Cb 0.02 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1x59 h GLU 40 CO -0.05 0.42 -0.08 0.93 -1.16 0.00 0.00 179.01 179.06 1x59 h GLU 41 N -0.11 0.39 -0.04 2.33 4.39 -0.61 0.22 114.58 121.15 1x59 h GLU 41 Ca 0.03 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 1x59 h GLU 41 Cb 0.34 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1x59 h GLU 41 CO 0.00 0.49 -0.13 0.28 -1.16 0.00 0.00 179.01 178.50 1x59 h VAL 42 N 0.37 1.46 -0.52 3.13 2.07 -0.84 -0.06 116.25 121.87 1x59 h VAL 42 Ca 0.08 -1.54 0.05 0.00 0.82 0.00 0.00 66.70 66.10 1x59 h VAL 42 Cb 0.38 2.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 1x59 h VAL 42 CO 0.02 0.42 0.26 0.00 0.02 0.00 0.00 177.57 178.30 1x59 h ALA 43 N 0.42 0.66 -0.20 1.67 0.00 -0.99 0.19 119.26 121.02 1x59 h ALA 43 Ca -0.00 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1x59 h ALA 43 Cb 0.75 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1x59 h ALA 43 CO 0.03 -0.08 -0.20 0.87 0.00 0.00 0.00 179.25 179.87 1x59 h LYS 44 N 0.51 0.34 -0.04 0.00 1.57 -0.98 -1.00 116.57 116.98 1x59 h LYS 44 Ca 0.23 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1x59 h LYS 44 Cb 0.13 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1x59 h LYS 44 CO -0.16 0.53 0.01 1.25 -0.57 0.00 0.00 179.45 180.51 1x59 h LEU 45 N 0.31 0.05 -0.14 2.94 5.85 -0.40 -2.91 115.31 121.02 1x59 h LEU 45 Ca 0.05 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1x59 h LEU 45 Cb 0.53 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1x59 h LEU 45 CO 0.04 0.27 0.05 -0.07 -0.34 0.00 0.00 178.44 178.38 1x59 h LEU 46 N -0.17 0.20 -1.11 2.25 3.38 -0.23 -1.08 115.31 118.56 1x59 h LEU 46 Ca 0.01 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1x59 h LEU 46 Cb 0.24 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1x59 h LEU 46 CO 0.00 0.34 -0.26 0.07 0.09 0.00 0.00 178.44 178.68 1x59 h LYS 47 N 0.05 0.00 0.87 1.13 2.10 -1.32 -1.84 116.57 117.56 1x59 h LYS 47 Ca 0.04 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.65 1x59 h LYS 47 Cb 0.21 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.55 1x59 h LYS 47 CO -0.00 0.26 -0.43 -0.07 -2.00 0.00 0.00 179.45 177.21 1x59 h LEU 48 N 0.00 -1.02 -1.09 7.07 3.38 -1.27 -3.22 115.31 119.16 1x59 h LEU 48 Ca -0.00 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.18 1x59 h LEU 48 Cb 0.76 0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 1x59 h LEU 48 CO 0.03 -0.72 0.61 0.11 0.09 0.00 0.00 178.44 178.57 1x59 h LYS 49 N -1.18 0.74 0.00 1.13 1.57 -0.68 -0.85 116.57 117.30 1x59 h LYS 49 Ca -0.12 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1x59 h LYS 49 Cb 0.91 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1x59 h LYS 49 CO 0.19 0.49 0.00 0.00 -0.57 0.00 0.00 179.45 179.56 1x59 h ALA 50 N 1.61 1.00 0.00 3.86 0.00 -1.36 0.13 119.26 124.50 1x59 h ALA 50 Ca 0.54 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 55.19 1x59 h ALA 50 Cb 0.84 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1x59 h ALA 50 CO -0.32 0.00 -1.88 1.04 0.00 0.00 0.00 179.25 178.09 1x59 n GLN 51 N -2.79 0.65 0.43 0.00 6.02 -0.34 -3.91 117.38 117.45 1x59 n GLN 51 Ca -0.02 0.13 -0.19 0.00 -0.01 0.00 0.00 57.00 56.92 1x59 n GLN 51 Cb 0.10 -1.68 -0.09 0.00 1.02 0.00 0.00 30.24 29.58 1x59 n GLN 51 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1x59 h LEU 52 N 0.00 -1.17 0.00 1.08 -0.00 -1.27 -3.50 115.31 110.46 1x59 h LEU 52 Ca -0.32 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 1x59 h LEU 52 Cb 1.89 0.33 0.00 0.00 -0.00 0.00 0.00 40.66 42.89 1x59 h LEU 52 CO 0.05 -0.73 0.00 0.61 -0.00 0.00 0.00 178.44 178.37 1x59 n GLY 53 N -1.60 -0.60 3.74 0.83 0.00 -0.04 -5.12 105.19 102.40 1x59 n GLY 53 Ca -0.14 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 1x59 n GLY 53 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x59 s PRO 54 N -0.07 4.51 -0.12 1.61 0.04 -1.26 -3.79 135.00 135.93 1x59 s PRO 54 Ca 0.00 1.89 0.14 0.00 0.04 0.00 0.00 61.00 63.07 1x59 s PRO 54 Cb 0.00 -3.22 -0.20 0.00 0.04 0.00 0.00 34.50 31.12 1x59 s PRO 54 CO 0.00 -0.03 0.13 -3.47 0.04 0.00 0.00 177.00 173.67 1x59 n ASP 55 N 2.09 1.32 -3.51 6.66 2.03 -1.26 -5.01 116.55 118.87 1x59 n ASP 55 Ca 0.03 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.16 1x59 n ASP 55 Cb 0.44 1.08 0.01 0.00 -0.72 0.00 0.00 41.12 41.94 1x59 n ASP 55 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1x59 n GLU 56 N -2.43 -1.38 -1.63 -0.67 1.02 -1.26 -4.94 120.64 109.36 1x59 n GLU 56 Ca -0.19 0.96 -0.43 0.00 -0.02 0.00 0.00 57.16 57.48 1x59 n GLU 56 Cb 0.84 -3.88 -0.03 0.00 -0.02 0.00 0.00 31.44 28.35 1x59 n GLU 56 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1x59 n SER 57 N -2.32 3.64 -4.77 1.62 3.41 -1.26 -4.98 113.62 108.96 1x59 n SER 57 Ca -0.16 0.54 -0.40 0.00 -0.26 0.00 0.00 58.87 58.58 1x59 n SER 57 Cb 0.60 -1.53 -0.02 0.00 -0.26 0.00 0.00 64.21 63.00 1x59 n SER 57 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1x59 s LYS 58 N 5.46 4.38 1.52 4.33 0.00 -1.26 -4.78 119.74 129.39 1x59 s LYS 58 Ca 0.96 2.11 0.00 0.00 0.00 0.00 0.00 55.97 59.04 1x59 s LYS 58 Cb -0.40 -3.06 0.00 0.00 0.00 0.00 0.00 37.83 34.37 1x59 s LYS 58 CO 0.39 -0.13 0.00 1.04 0.00 0.00 0.00 175.35 176.65 1x59 n GLN 59 N 0.81 0.00 -4.01 1.78 1.13 -1.26 -4.91 117.38 110.92 1x59 n GLN 59 Ca 0.00 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.70 1x59 n GLN 59 Cb 0.43 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.77 1x59 n GLN 59 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1x59 n LYS 60 N -1.13 -1.22 -1.89 -1.09 0.00 -1.26 -4.86 118.16 106.72 1x59 n LYS 60 Ca 0.00 0.23 -0.42 0.00 0.00 0.00 0.00 58.31 58.12 1x59 n LYS 60 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 35.03 31.50 1x59 n LYS 60 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 1x59 s PHE 61 N -3.77 1.72 0.72 5.64 0.08 -1.26 -4.98 117.98 116.12 1x59 s PHE 61 Ca 0.29 0.03 -0.15 0.00 0.12 0.00 0.00 56.93 57.22 1x59 s PHE 61 Cb -0.14 -4.03 0.03 0.00 -0.57 0.00 0.00 43.02 38.31 1x59 s PHE 61 CO 0.94 -4.33 1.22 0.14 -0.10 0.00 0.00 175.22 173.08 1x59 s VAL 62 N 4.53 2.27 -0.40 -0.44 -7.23 -1.26 -5.01 120.40 112.86 1x59 s VAL 62 Ca 0.80 0.14 0.03 0.00 -1.81 0.00 0.00 61.98 61.13 1x59 s VAL 62 Cb -0.35 -2.76 0.11 0.00 0.56 0.00 0.00 36.38 33.94 1x59 s VAL 62 CO 0.34 -0.06 0.13 -0.22 -0.31 0.00 0.00 175.10 174.97 1x59 s LEU 63 N -5.03 4.13 0.25 1.32 1.98 -1.26 -5.09 118.68 114.98 1x59 s LEU 63 Ca 0.76 -2.38 -0.30 0.00 -2.89 0.00 0.00 54.13 49.32 1x59 s LEU 63 Cb -0.30 -1.48 -0.09 0.00 0.66 0.00 0.00 46.19 44.98 1x59 s LEU 63 CO 0.44 -0.33 1.13 -0.54 -1.89 0.00 0.00 176.35 175.16 1x59 s LYS 64 N 0.61 4.59 -0.08 1.98 1.02 -1.26 -5.06 119.74 121.54 1x59 s LYS 64 Ca 0.13 1.83 -0.05 0.00 0.02 0.00 0.00 55.97 57.90 1x59 s LYS 64 Cb -0.21 -3.21 0.03 0.00 -0.52 0.00 0.00 37.83 33.92 1x59 s LYS 64 CO -0.07 0.11 0.19 0.99 -0.92 0.00 0.00 175.35 175.66 1x59 s THR 65 N -0.81 -0.03 0.62 2.17 2.01 -1.26 -5.16 115.64 113.19 1x59 s THR 65 Ca 0.47 0.10 -0.15 0.00 0.31 0.00 0.00 61.69 62.41 1x59 s THR 65 Cb -0.32 -0.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1x59 s THR 65 CO 0.40 0.04 1.08 -2.16 -0.69 0.00 0.00 174.62 173.29 1x59 s PRO 66 N 0.76 3.09 -0.39 4.92 0.04 -1.26 -5.02 135.00 137.14 1x59 s PRO 66 Ca -0.05 1.28 0.08 0.00 0.04 0.00 0.00 61.00 62.35 1x59 s PRO 66 Cb -0.07 -2.00 0.25 0.00 0.04 0.00 0.00 34.50 32.73 1x59 s PRO 66 CO -0.04 -1.00 0.53 0.36 0.04 0.00 0.00 177.00 176.88 1x59 n LYS 67 N -2.22 0.75 -1.44 4.56 2.85 -1.26 -5.12 118.16 116.27 1x59 n LYS 67 Ca 0.09 -3.25 -0.37 0.00 -1.05 0.00 0.00 58.31 53.74 1x59 n LYS 67 Cb 0.52 -1.24 0.07 0.00 -0.65 0.00 0.00 35.03 33.73 1x59 n LYS 67 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1x59 n SER 68 N 1.37 0.01 0.00 -5.58 7.64 -1.26 -4.97 113.62 110.83 1x59 n SER 68 Ca 0.21 0.70 0.00 0.00 1.01 0.00 0.00 58.87 60.80 1x59 n SER 68 Cb 0.53 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1x59 n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x59 n GLY 69 N 1.38 2.93 0.55 0.23 0.00 -1.26 -5.00 105.19 104.02 1x59 n GLY 69 Ca 0.13 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1x59 n GLY 69 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x59 n PRO 70 N -1.52 0.66 -1.59 1.61 -0.04 -1.26 -4.91 135.00 127.94 1x59 n PRO 70 Ca 0.00 0.00 -0.52 0.00 -0.04 0.00 0.00 63.50 62.94 1x59 n PRO 70 Cb 0.00 -1.31 -0.06 0.00 -0.04 0.00 0.00 33.50 32.09 1x59 n PRO 70 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x59 n SER 71 N 0.22 1.69 -4.64 3.54 2.88 -1.26 -4.88 113.62 111.18 1x59 n SER 71 Ca 0.00 1.12 -0.43 0.00 -1.33 0.00 0.00 58.87 58.23 1x59 n SER 71 Cb 0.18 -1.20 -0.03 0.00 -0.75 0.00 0.00 64.21 62.42 1x59 n SER 71 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x59 s SER 72 N 0.53 6.53 0.00 -3.46 1.04 -1.26 -5.24 113.70 111.83 1x59 s SER 72 Ca 0.84 1.89 0.00 0.00 0.48 0.00 0.00 55.95 59.16 1x59 s SER 72 Cb -0.95 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 62.64 1x59 s SER 72 CO 0.47 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 174.21