#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 -3.25 -3.91 1.61 2.88 -1.26 -4.93 113.62 104.77 1x59 n SER 2 Ca 0.00 0.08 -0.21 0.00 -1.33 0.00 0.00 58.87 57.41 1x59 n SER 2 Cb 0.00 -2.77 -0.16 0.00 -0.75 0.00 0.00 64.21 60.53 1x59 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x59 s SER 3 N -2.23 1.17 0.00 -3.46 0.15 -1.26 -5.06 113.70 103.02 1x59 s SER 3 Ca 0.12 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1x59 s SER 3 Cb -0.06 -0.53 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 1x59 s SER 3 CO 0.15 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.15 1x59 n GLY 4 N 4.11 0.66 3.83 9.45 0.00 -1.26 -5.13 105.19 116.85 1x59 n GLY 4 Ca -0.23 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.01 1x59 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x59 s SER 5 N -4.00 -0.15 -0.95 1.61 0.01 -1.26 -5.07 113.70 103.89 1x59 s SER 5 Ca 0.00 -0.81 -0.07 0.00 1.31 0.00 0.00 55.95 56.38 1x59 s SER 5 Cb 0.00 0.77 -0.02 0.00 0.21 0.00 0.00 66.02 66.97 1x59 s SER 5 CO 0.00 -1.46 0.79 -1.20 0.41 0.00 0.00 173.24 171.78 1x59 n SER 6 N -0.78 -6.52 -3.59 2.44 7.64 -1.26 -5.01 113.62 106.53 1x59 n SER 6 Ca -0.05 -0.61 -0.10 0.00 1.01 0.00 0.00 58.87 59.12 1x59 n SER 6 Cb 0.59 -4.43 -0.02 0.00 -1.01 0.00 0.00 64.21 59.34 1x59 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x59 s GLY 7 N -3.24 -0.41 -0.00 0.23 0.00 -1.26 -5.05 107.32 97.58 1x59 s GLY 7 Ca 0.27 0.20 -0.25 0.00 0.00 0.00 0.00 44.72 44.94 1x59 s GLY 7 CO 0.79 0.07 1.34 -0.33 0.00 0.00 0.00 173.10 174.97 1x59 h MET 8 N 2.00 -0.05 -0.38 2.90 0.00 -1.98 -1.34 114.93 116.09 1x59 h MET 8 Ca -0.28 0.00 -0.04 0.00 0.00 0.00 0.00 59.70 59.39 1x59 h MET 8 Cb 1.28 0.01 -0.02 0.00 0.00 0.00 0.00 31.60 32.88 1x59 h MET 8 CO 0.32 0.34 0.10 0.00 0.00 0.00 0.00 176.91 177.66 1x59 h ALA 9 N 0.50 0.50 0.60 6.32 0.00 -1.97 0.18 119.26 125.38 1x59 h ALA 9 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1x59 h ALA 9 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1x59 h ALA 9 CO 0.01 0.17 -0.45 0.93 0.00 0.00 0.00 179.25 179.90 1x59 h GLU 10 N 0.47 -0.98 0.00 0.00 4.39 -1.96 -1.47 114.58 115.03 1x59 h GLU 10 Ca 0.12 0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.83 1x59 h GLU 10 Cb 0.29 0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1x59 h GLU 10 CO 0.00 -0.65 -0.28 -0.09 -1.16 0.00 0.00 179.01 176.83 1x59 h ARG 11 N -1.02 0.00 -0.45 2.33 2.43 -1.15 -1.59 114.38 114.93 1x59 h ARG 11 Ca -0.07 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 1x59 h ARG 11 Cb 0.85 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 1x59 h ARG 11 CO 0.02 0.28 0.06 0.00 -1.51 0.00 0.00 179.97 178.81 1x59 h ALA 12 N 1.72 1.27 -0.65 2.80 0.00 -0.43 0.92 119.26 124.89 1x59 h ALA 12 Ca -0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1x59 h ALA 12 Cb 0.49 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1x59 h ALA 12 CO 0.04 0.50 0.25 0.00 0.00 0.00 0.00 179.25 180.04 1x59 h ALA 13 N 1.40 0.84 -0.30 0.00 0.00 -0.27 -0.94 119.26 120.00 1x59 h ALA 13 Ca 0.14 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1x59 h ALA 13 Cb 0.33 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1x59 h ALA 13 CO 0.01 0.47 -0.31 -0.07 0.00 0.00 0.00 179.25 179.35 1x59 h LEU 14 N 0.92 0.80 -1.45 0.00 3.38 -1.10 -2.92 115.31 114.93 1x59 h LEU 14 Ca 0.21 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1x59 h LEU 14 Cb 0.23 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1x59 h LEU 14 CO -0.02 1.11 0.04 -0.33 0.09 0.00 0.00 178.44 179.33 1x59 h GLU 15 N 0.50 0.40 0.17 1.13 4.39 -0.71 -2.35 114.58 118.11 1x59 h GLU 15 Ca 0.05 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1x59 h GLU 15 Cb 0.89 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1x59 h GLU 15 CO 0.08 0.40 -0.08 0.93 -1.16 0.00 0.00 179.01 179.17 1x59 h GLU 16 N 0.39 -0.22 -0.55 2.33 5.08 -1.05 -1.25 114.58 119.32 1x59 h GLU 16 Ca 0.09 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1x59 h GLU 16 Cb 0.20 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 1x59 h GLU 16 CO 0.00 -0.06 0.20 -0.07 -1.00 0.00 0.00 179.01 178.08 1x59 h LEU 17 N -0.33 0.20 -0.21 1.33 3.38 -1.27 0.14 115.31 118.55 1x59 h LEU 17 Ca -0.02 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1x59 h LEU 17 Cb 0.26 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1x59 h LEU 17 CO 0.04 0.13 0.08 0.58 0.09 0.00 0.00 178.44 179.36 1x59 h VAL 18 N 0.38 1.17 0.50 1.22 2.07 -1.40 -0.29 116.25 119.90 1x59 h VAL 18 Ca 0.27 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1x59 h VAL 18 Cb 0.31 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1x59 h VAL 18 CO -0.27 0.17 -0.24 0.50 0.02 0.00 0.00 177.57 177.74 1x59 h LYS 19 N 0.19 -0.65 -0.29 1.57 3.64 -0.37 -0.68 116.57 119.97 1x59 h LYS 19 Ca 0.07 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1x59 h LYS 19 Cb 0.18 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 1x59 h LYS 19 CO -0.01 -0.40 0.01 -0.07 -2.27 0.00 0.00 179.45 176.72 1x59 h LEU 20 N -0.76 -0.09 -1.07 5.20 -0.00 -0.77 0.19 115.31 118.01 1x59 h LEU 20 Ca -0.07 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1x59 h LEU 20 Cb 0.55 0.11 -0.04 0.00 -0.00 0.00 0.00 40.66 41.28 1x59 h LEU 20 CO 0.11 -0.01 0.55 -0.61 -0.00 0.00 0.00 178.44 178.48 1x59 h GLN 21 N 0.10 1.18 0.15 1.13 5.75 -0.99 0.13 115.11 122.56 1x59 h GLN 21 Ca 0.14 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 1x59 h GLN 21 Cb 0.18 -0.26 0.00 0.00 1.07 0.00 0.00 27.48 28.47 1x59 h GLN 21 CO -0.22 0.81 -0.07 0.78 -2.65 0.00 0.00 178.83 177.47 1x59 h GLY 22 N 1.22 -0.21 0.52 2.39 0.00 -0.30 -0.25 103.07 106.43 1x59 h GLY 22 Ca 0.32 0.08 0.08 0.00 0.00 0.00 0.00 47.33 47.81 1x59 h GLY 22 CO -0.06 -0.08 0.29 1.05 0.00 0.00 0.00 176.54 177.74 1x59 h GLU 23 N -0.38 0.51 0.20 4.80 -0.00 -0.29 -1.93 114.58 117.49 1x59 h GLU 23 Ca -0.02 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.36 59.30 1x59 h GLU 23 Cb 0.30 -0.11 0.00 0.00 -0.00 0.00 0.00 28.75 28.94 1x59 h GLU 23 CO 0.03 0.33 -0.10 -0.09 -0.00 0.00 0.00 179.01 179.19 1x59 h ARG 24 N 0.52 -0.26 -0.88 1.06 2.43 -0.70 -1.66 114.38 114.88 1x59 h ARG 24 Ca 0.30 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.61 1x59 h ARG 24 Cb 0.30 0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.82 1x59 h ARG 24 CO -0.25 0.00 0.51 0.28 -1.51 0.00 0.00 179.97 179.00 1x59 h VAL 25 N -0.51 0.84 -0.01 0.20 2.07 -0.67 0.47 116.25 118.64 1x59 h VAL 25 Ca -0.03 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1x59 h VAL 25 Cb 0.38 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1x59 h VAL 25 CO 0.05 0.14 -0.00 0.03 0.02 0.00 0.00 177.57 177.80 1x59 h ARG 26 N 0.78 -0.00 -0.66 1.57 2.47 -1.25 -1.59 114.38 115.70 1x59 h ARG 26 Ca 0.45 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 59.31 1x59 h ARG 26 Cb 0.52 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 28.73 1x59 h ARG 26 CO -0.30 -0.00 0.03 0.78 0.56 0.00 0.00 179.97 181.04 1x59 h GLY 27 N -0.00 0.74 0.91 0.04 0.00 0.14 -0.41 103.07 104.49 1x59 h GLY 27 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 1x59 h GLY 27 CO -0.01 -0.22 0.09 1.41 0.00 0.00 0.00 176.54 177.82 1x59 h LEU 28 N 0.14 0.47 -1.36 3.11 3.38 0.16 0.24 115.31 121.45 1x59 h LEU 28 Ca 0.35 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1x59 h LEU 28 Cb 0.59 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1x59 h LEU 28 CO -0.55 0.56 -0.09 0.11 0.09 0.00 0.00 178.44 178.56 1x59 h LYS 29 N 0.36 0.31 -0.16 1.13 1.57 -0.86 -1.34 116.57 117.58 1x59 h LYS 29 Ca 0.10 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1x59 h LYS 29 Cb 0.27 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1x59 h LYS 29 CO -0.00 0.42 0.02 0.37 -0.57 0.00 0.00 179.45 179.69 1x59 h GLN 30 N 0.30 0.26 0.00 3.15 4.15 -0.58 -3.30 115.11 119.10 1x59 h GLN 30 Ca 0.06 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1x59 h GLN 30 Cb 0.35 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.01 1x59 h GLN 30 CO 0.02 0.45 0.00 0.00 -1.93 0.00 0.00 178.83 177.37 1x59 n GLN 31 N -4.78 0.01 -3.66 1.69 10.64 0.81 -4.89 117.38 117.21 1x59 n GLN 31 Ca -0.05 0.19 -0.26 0.00 -1.83 0.00 0.00 57.00 55.05 1x59 n GLN 31 Cb 0.19 -1.52 0.04 0.00 -0.86 0.00 0.00 30.24 28.08 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 -1.55 -2.52 -0.96 2.61 4.76 -0.68 -5.02 118.16 114.80 1x59 n LYS 32 Ca 0.04 0.55 -0.30 0.00 -2.87 0.00 0.00 58.31 55.74 1x59 n LYS 32 Cb 0.23 -4.67 0.24 0.00 -1.84 0.00 0.00 35.03 28.98 1x59 n LYS 32 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x59 s ALA 33 N -3.56 0.38 0.07 7.82 0.00 -1.06 -4.96 121.76 120.44 1x59 s ALA 33 Ca 0.30 -0.77 -0.37 0.00 0.00 0.00 0.00 51.96 51.12 1x59 s ALA 33 Cb -0.09 -2.96 -0.17 0.00 0.00 0.00 0.00 23.12 19.90 1x59 s ALA 33 CO 0.83 -3.63 1.36 0.43 0.00 0.00 0.00 175.76 174.76 1x59 n SER 34 N -4.80 1.67 -0.13 0.00 7.64 -1.26 -4.86 113.62 111.88 1x59 n SER 34 Ca 0.11 1.12 0.05 0.00 1.01 0.00 0.00 58.87 61.15 1x59 n SER 34 Cb 0.59 -1.19 0.36 0.00 -1.01 0.00 0.00 64.21 62.96 1x59 n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x59 h ALA 35 N 4.69 1.68 -0.27 -0.43 0.00 -1.99 -1.27 119.26 121.68 1x59 h ALA 35 Ca -0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1x59 h ALA 35 Cb 1.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1x59 h ALA 35 CO 0.79 0.24 0.08 1.49 0.00 0.00 0.00 179.25 181.85 1x59 h GLU 36 N 0.73 0.42 -0.49 0.00 4.81 -1.99 -2.28 114.58 115.78 1x59 h GLU 36 Ca 0.26 -0.09 0.08 0.00 -0.13 0.00 0.00 59.36 59.47 1x59 h GLU 36 Cb 0.12 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.38 1x59 h GLU 36 CO -0.07 0.50 0.13 1.25 -0.73 0.00 0.00 179.01 180.08 1x59 h LEU 37 N 0.26 0.07 -0.15 1.64 5.85 -1.61 0.22 115.31 121.59 1x59 h LEU 37 Ca 0.09 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.90 1x59 h LEU 37 Cb 0.26 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1x59 h LEU 37 CO -0.00 0.07 0.00 0.40 -0.34 0.00 0.00 178.44 178.57 1x59 h ILE 38 N 0.28 0.90 -0.51 4.05 2.04 -1.38 -0.23 117.51 122.65 1x59 h ILE 38 Ca 0.24 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 66.11 1x59 h ILE 38 Cb 0.30 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1x59 h ILE 38 CO -0.29 0.01 0.31 -0.08 0.00 0.00 0.00 178.15 178.10 1x59 h GLU 39 N 0.06 0.59 -0.51 2.37 4.22 -0.60 0.01 114.58 120.71 1x59 h GLU 39 Ca 0.07 -0.04 -0.11 0.00 0.08 0.00 0.00 59.36 59.37 1x59 h GLU 39 Cb 0.08 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1x59 h GLU 39 CO -0.11 0.39 -0.11 0.93 -2.18 0.00 0.00 179.01 177.92 1x59 h GLU 40 N 0.61 0.96 -0.32 1.92 4.39 -0.39 0.14 114.58 121.88 1x59 h GLU 40 Ca 0.21 -0.35 -0.17 0.00 0.34 0.00 0.00 59.36 59.39 1x59 h GLU 40 Cb 0.03 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1x59 h GLU 40 CO -0.10 1.01 -0.48 0.93 -1.16 0.00 0.00 179.01 179.22 1x59 h GLU 41 N 0.85 0.87 -0.57 2.33 4.39 -0.86 -1.82 114.58 119.78 1x59 h GLU 41 Ca 0.13 -0.51 -0.04 0.00 0.34 0.00 0.00 59.36 59.29 1x59 h GLU 41 Cb 0.66 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 1x59 h GLU 41 CO 0.05 1.15 0.22 0.28 -1.16 0.00 0.00 179.01 179.54 1x59 h VAL 42 N 0.69 1.23 -0.54 3.13 2.07 -0.79 -0.10 116.25 121.93 1x59 h VAL 42 Ca 0.03 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 1x59 h VAL 42 Cb 1.07 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1x59 h VAL 42 CO 0.11 0.28 0.30 0.00 0.02 0.00 0.00 177.57 178.28 1x59 h ALA 43 N 1.07 0.69 -0.56 1.67 0.00 -0.62 0.19 119.26 121.71 1x59 h ALA 43 Ca 0.19 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1x59 h ALA 43 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1x59 h ALA 43 CO -0.01 0.21 -0.01 0.87 0.00 0.00 0.00 179.25 180.30 1x59 h LYS 44 N 0.73 0.99 -0.31 0.00 1.57 -1.20 -2.45 116.57 115.90 1x59 h LYS 44 Ca 0.19 -0.32 0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1x59 h LYS 44 Cb 0.04 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1x59 h LYS 44 CO -0.03 1.00 0.10 1.25 -0.57 0.00 0.00 179.45 181.20 1x59 h LEU 45 N 0.87 0.11 0.32 2.94 5.85 -0.59 0.55 115.31 125.37 1x59 h LEU 45 Ca 0.16 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1x59 h LEU 45 Cb 0.56 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1x59 h LEU 45 CO 0.03 0.10 -0.37 -0.07 -0.34 0.00 0.00 178.44 177.78 1x59 h LEU 46 N 0.24 -1.03 -0.28 2.25 3.38 -0.41 -0.95 115.31 118.51 1x59 h LEU 46 Ca 0.14 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1x59 h LEU 46 Cb 0.11 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1x59 h LEU 46 CO -0.14 -0.51 0.00 0.07 0.09 0.00 0.00 178.44 177.95 1x59 h LYS 47 N -0.74 0.00 0.23 1.13 2.10 -1.42 -2.29 116.57 115.57 1x59 h LYS 47 Ca -0.02 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.62 1x59 h LYS 47 Cb 0.68 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.01 1x59 h LYS 47 CO -0.09 0.00 -0.13 -0.07 -2.00 0.00 0.00 179.45 177.16 1x59 h LEU 48 N 0.00 -0.31 -2.19 7.07 3.38 -0.52 -2.44 115.31 120.30 1x59 h LEU 48 Ca 0.00 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1x59 h LEU 48 Cb 0.86 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1x59 h LEU 48 CO 0.00 -0.21 0.04 0.11 0.09 0.00 0.00 178.44 178.47 1x59 h LYS 49 N -0.33 0.00 0.00 1.13 1.57 -0.91 -0.18 116.57 117.85 1x59 h LYS 49 Ca -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1x59 h LYS 49 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1x59 h LYS 49 CO 0.03 0.00 -0.04 0.00 -0.57 0.00 0.00 179.45 178.88 1x59 h ALA 50 N 1.97 1.08 -0.05 3.86 0.00 -0.92 0.28 119.26 125.47 1x59 h ALA 50 Ca 0.02 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 1x59 h ALA 50 Cb 0.09 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1x59 h ALA 50 CO -0.00 0.04 -0.81 1.96 0.00 0.00 0.00 179.25 180.45 1x59 h GLN 51 N 0.00 0.63 0.53 0.00 4.20 -0.88 -3.37 115.11 116.22 1x59 h GLN 51 Ca -0.00 -0.62 -0.03 0.00 0.06 0.00 0.00 58.65 58.07 1x59 h GLN 51 Cb 0.28 0.16 0.01 0.00 0.30 0.00 0.00 27.48 28.23 1x59 h GLN 51 CO 0.00 1.22 -0.25 -0.07 -0.67 0.00 0.00 178.83 179.07 1x59 h LEU 52 N 0.27 -0.60 -8.29 1.46 -0.00 -1.21 -3.42 115.31 103.51 1x59 h LEU 52 Ca -0.09 -0.05 -0.25 0.00 -0.00 0.00 0.00 57.88 57.49 1x59 h LEU 52 Cb 1.47 0.15 -0.03 0.00 -0.00 0.00 0.00 40.66 42.25 1x59 h LEU 52 CO 0.16 -0.30 1.05 0.61 -0.00 0.00 0.00 178.44 179.96 1x59 n GLY 53 N -0.85 -0.18 0.11 0.83 0.00 -0.01 -4.78 105.19 100.30 1x59 n GLY 53 Ca -0.12 0.43 -0.02 0.00 0.00 0.00 0.00 46.02 46.32 1x59 n GLY 53 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x59 h PRO 54 N 13.98 0.00 0.00 1.61 0.13 -1.89 -3.43 132.00 142.39 1x59 h PRO 54 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1x59 h PRO 54 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1x59 h PRO 54 CO 1.22 0.74 0.00 -3.47 -0.23 0.00 0.00 178.00 176.26 1x59 n ASP 55 N -3.47 0.00 0.08 1.44 2.03 -1.26 -5.14 116.55 110.22 1x59 n ASP 55 Ca -0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1x59 n ASP 55 Cb 0.77 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.17 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 0.00 0.00 0.00 -0.67 1.02 -1.26 -5.16 120.64 114.56 1x59 n GLU 56 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1x59 n GLU 56 Cb 0.00 -0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 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 -3.01 -1.15 -3.56 1.62 3.41 -1.26 -5.02 113.62 104.65 1x59 n SER 57 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1x59 n SER 57 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 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 0.00 0.73 1.07 4.33 -2.85 -1.26 -5.09 119.74 116.68 1x59 s LYS 58 Ca 0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 55.97 54.67 1x59 s LYS 58 Cb 0.00 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 1x59 s LYS 58 CO 0.00 -0.32 0.00 1.04 0.10 0.00 0.00 175.35 176.17 1x59 n GLN 59 N -0.25 0.00 -1.54 1.78 6.02 -1.26 -4.74 117.38 117.38 1x59 n GLN 59 Ca -0.06 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.57 1x59 n GLN 59 Cb 0.61 0.00 0.09 0.00 1.02 0.00 0.00 30.24 31.95 1x59 n GLN 59 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1x59 s LYS 60 N 0.00 2.27 -0.07 -1.09 3.01 -1.26 -5.00 119.74 117.59 1x59 s LYS 60 Ca 0.00 1.91 0.03 0.00 -1.01 0.00 0.00 55.97 56.90 1x59 s LYS 60 Cb 0.00 -1.83 -0.02 0.00 -1.01 0.00 0.00 37.83 34.97 1x59 s LYS 60 CO 0.00 -1.77 -0.14 -0.59 0.51 0.00 0.00 175.35 173.35 1x59 s PHE 61 N -1.71 2.72 -1.66 3.18 -0.12 -1.26 -4.65 117.98 114.48 1x59 s PHE 61 Ca 0.78 -0.33 -0.11 0.00 -0.05 0.00 0.00 56.93 57.22 1x59 s PHE 61 Cb -0.33 -1.69 0.11 0.00 -0.63 0.00 0.00 43.02 40.47 1x59 s PHE 61 CO 0.43 0.05 0.41 1.33 -0.05 0.00 0.00 175.22 177.39 1x59 n VAL 62 N 2.71 -1.03 -1.86 -2.49 0.24 -1.26 -4.83 118.33 109.81 1x59 n VAL 62 Ca -0.17 -0.24 -0.37 0.00 -2.04 0.00 0.00 64.34 61.52 1x59 n VAL 62 Cb 0.52 -1.25 -0.04 0.00 -1.47 0.00 0.00 33.84 31.59 1x59 n VAL 62 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1x59 n LEU 63 N -4.36 4.05 -4.77 1.34 7.94 -1.26 -4.94 117.00 115.00 1x59 n LEU 63 Ca -0.10 -3.32 -0.39 0.00 -1.11 0.00 0.00 56.01 51.08 1x59 n LEU 63 Cb 0.58 -1.55 -0.00 0.00 0.53 0.00 0.00 43.42 42.97 1x59 n LEU 63 CO 0.87 -0.78 0.97 -1.59 -1.11 0.00 0.00 177.39 175.75 1x59 s LYS 64 N 5.34 3.97 0.14 1.96 -2.85 -1.26 -5.02 119.74 122.02 1x59 s LYS 64 Ca 0.61 2.17 0.06 0.00 -1.00 0.00 0.00 55.97 57.81 1x59 s LYS 64 Cb 0.06 -2.76 -0.04 0.00 -2.06 0.00 0.00 37.83 33.03 1x59 s LYS 64 CO 0.10 -0.50 0.01 0.95 0.10 0.00 0.00 175.35 176.01 1x59 s THR 65 N -1.26 3.89 -0.27 3.79 -4.23 -1.26 -5.07 115.64 111.24 1x59 s THR 65 Ca 0.57 -1.24 -0.29 0.00 -1.18 0.00 0.00 61.69 59.55 1x59 s THR 65 Cb -0.38 -2.93 -0.00 0.00 1.34 0.00 0.00 72.50 70.53 1x59 s THR 65 CO 0.49 -0.03 1.27 -2.16 -0.54 0.00 0.00 174.62 173.65 1x59 s PRO 66 N -2.74 4.00 0.00 3.99 0.04 -1.26 -4.93 135.00 134.10 1x59 s PRO 66 Ca 0.27 1.32 -0.03 0.00 0.04 0.00 0.00 61.00 62.59 1x59 s PRO 66 Cb -0.10 -3.84 -0.16 0.00 0.04 0.00 0.00 34.50 30.45 1x59 s PRO 66 CO 0.19 -1.00 2.45 1.63 0.04 0.00 0.00 177.00 180.31 1x59 n LYS 67 N 7.10 1.27 -0.20 4.56 4.76 -1.26 -4.61 118.16 129.78 1x59 n LYS 67 Ca 0.14 -0.58 -0.07 0.00 -2.87 0.00 0.00 58.31 54.94 1x59 n LYS 67 Cb 0.46 -1.74 0.03 0.00 -1.84 0.00 0.00 35.03 31.94 1x59 n LYS 67 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1x59 h SER 68 N 3.65 0.70 0.00 4.39 0.87 -2.07 -3.48 113.55 117.61 1x59 h SER 68 Ca 0.11 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1x59 h SER 68 Cb 0.99 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1x59 h SER 68 CO 0.27 0.55 0.00 0.61 -0.53 0.00 0.00 176.83 177.73 1x59 n GLY 69 N -1.15 2.26 3.69 5.77 0.00 -1.26 -5.06 105.19 109.44 1x59 n GLY 69 Ca 0.04 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1x59 n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x59 s PRO 70 N -0.66 4.21 -0.21 1.61 0.04 -1.26 -4.96 135.00 133.77 1x59 s PRO 70 Ca 0.00 2.25 -0.27 0.00 0.04 0.00 0.00 61.00 63.02 1x59 s PRO 70 Cb 0.00 -3.60 0.07 0.00 0.04 0.00 0.00 34.50 31.02 1x59 s PRO 70 CO 0.00 -0.70 0.73 0.45 0.04 0.00 0.00 177.00 177.52 1x59 s SER 71 N 2.30 -0.70 0.00 6.66 0.15 -1.26 -5.12 113.70 115.73 1x59 s SER 71 Ca 0.72 1.20 0.00 0.00 0.70 0.00 0.00 55.95 58.57 1x59 s SER 71 Cb -0.38 1.17 0.00 0.00 -1.71 0.00 0.00 66.02 65.10 1x59 s SER 71 CO 0.31 -0.34 0.00 -0.24 1.20 0.00 0.00 173.24 174.17 1x59 n SER 72 N 2.15 0.00 0.00 5.45 2.88 -1.26 -5.29 113.62 117.54 1x59 n SER 72 Ca -0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.39 1x59 n SER 72 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42