#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x59 s SER 2 N 0.00 6.26 -0.50 1.61 0.15 -1.26 -4.96 113.70 115.00 1x59 s SER 2 Ca 0.00 -0.81 -0.26 0.00 0.70 0.00 0.00 55.95 55.58 1x59 s SER 2 Cb 0.00 -2.56 -0.07 0.00 -1.71 0.00 0.00 66.02 61.67 1x59 s SER 2 CO 0.00 -1.74 2.42 -1.20 1.20 0.00 0.00 173.24 173.93 1x59 n SER 3 N 9.31 2.28 -3.14 5.45 7.64 -1.26 -4.84 113.62 129.06 1x59 n SER 3 Ca 0.15 -0.48 -0.23 0.00 1.01 0.00 0.00 58.87 59.32 1x59 n SER 3 Cb 0.50 -1.57 -0.05 0.00 -1.01 0.00 0.00 64.21 62.08 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 6.02 4.31 3.65 0.23 0.00 -1.26 -5.06 105.19 113.08 1x59 n GLY 4 Ca 0.38 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 1x59 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x59 s SER 5 N -2.59 3.72 -0.29 1.61 0.15 -1.26 -5.09 113.70 109.96 1x59 s SER 5 Ca 0.42 -1.51 0.19 0.00 0.70 0.00 0.00 55.95 55.76 1x59 s SER 5 Cb 0.27 0.07 0.49 0.00 -1.71 0.00 0.00 66.02 65.15 1x59 s SER 5 CO -0.09 -0.67 1.08 -1.20 1.20 0.00 0.00 173.24 173.56 1x59 n SER 6 N -1.08 2.01 -4.60 5.45 7.64 -1.26 -5.09 113.62 116.69 1x59 n SER 6 Ca -0.10 -2.44 -0.52 0.00 1.01 0.00 0.00 58.87 56.82 1x59 n SER 6 Cb 0.67 -0.48 -0.06 0.00 -1.01 0.00 0.00 64.21 63.33 1x59 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x59 n GLY 7 N -0.47 0.51 0.06 0.23 0.00 -1.26 -4.89 105.19 99.38 1x59 n GLY 7 Ca 0.13 0.70 -0.12 0.00 0.00 0.00 0.00 46.02 46.72 1x59 n GLY 7 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1x59 h MET 8 N 4.64 0.06 0.00 1.61 1.85 -1.99 -0.87 114.93 120.23 1x59 h MET 8 Ca -0.47 -0.02 -0.12 0.00 -0.61 0.00 0.00 59.70 58.48 1x59 h MET 8 Cb 1.33 -0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.34 1x59 h MET 8 CO 0.78 0.36 -0.56 0.00 -0.40 0.00 0.00 176.91 177.10 1x59 h ALA 9 N 0.69 0.94 0.14 0.39 0.00 -1.98 -1.35 119.26 118.09 1x59 h ALA 9 Ca 0.01 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1x59 h ALA 9 Cb 0.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1x59 h ALA 9 CO 0.00 0.70 -0.07 0.93 0.00 0.00 0.00 179.25 180.82 1x59 h GLU 10 N 0.00 -0.18 -0.72 0.00 5.08 -1.91 -1.21 114.58 115.63 1x59 h GLU 10 Ca -0.01 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.48 1x59 h GLU 10 Cb 1.08 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.29 1x59 h GLU 10 CO 0.07 0.00 0.32 -0.09 -1.00 0.00 0.00 179.01 178.32 1x59 h ARG 11 N -0.34 0.51 0.00 2.33 2.43 -1.05 -0.23 114.38 118.02 1x59 h ARG 11 Ca -0.02 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1x59 h ARG 11 Cb 0.27 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1x59 h ARG 11 CO 0.03 0.34 -0.10 0.00 -1.51 0.00 0.00 179.97 178.72 1x59 h ALA 12 N 1.48 1.39 0.00 2.80 0.00 -0.90 0.76 119.26 124.78 1x59 h ALA 12 Ca 0.37 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1x59 h ALA 12 Cb 0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1x59 h ALA 12 CO -0.33 0.13 -1.15 0.00 0.00 0.00 0.00 179.25 177.90 1x59 h ALA 13 N 1.90 0.59 -0.05 0.00 0.00 0.05 -2.52 119.26 119.23 1x59 h ALA 13 Ca -0.00 -0.42 -0.20 0.00 0.00 0.00 0.00 54.91 54.29 1x59 h ALA 13 Cb 0.26 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1x59 h ALA 13 CO 0.01 0.46 -0.76 -0.07 0.00 0.00 0.00 179.25 178.90 1x59 h LEU 14 N 0.00 0.75 -1.39 0.00 3.38 -0.63 -3.13 115.31 114.29 1x59 h LEU 14 Ca -0.08 -0.70 0.05 0.00 0.09 0.00 0.00 57.88 57.24 1x59 h LEU 14 Cb 1.29 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.78 1x59 h LEU 14 CO 0.02 1.35 0.45 -0.33 0.09 0.00 0.00 178.44 180.03 1x59 h GLU 15 N 0.22 0.74 -0.38 1.13 4.39 -0.95 -1.68 114.58 118.05 1x59 h GLU 15 Ca -0.08 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.62 1x59 h GLU 15 Cb 1.42 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.86 1x59 h GLU 15 CO 0.15 0.49 0.13 1.49 -1.16 0.00 0.00 179.01 180.11 1x59 h GLU 16 N 0.76 0.28 -0.83 2.33 4.81 -1.41 0.18 114.58 120.69 1x59 h GLU 16 Ca 0.29 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 1x59 h GLU 16 Cb 0.17 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1x59 h GLU 16 CO -0.09 0.18 0.55 -0.07 -0.73 0.00 0.00 179.01 178.85 1x59 h LEU 17 N 0.28 0.94 -0.44 1.64 3.38 -1.27 0.10 115.31 119.93 1x59 h LEU 17 Ca 0.18 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1x59 h LEU 17 Cb 0.16 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1x59 h LEU 17 CO -0.18 0.67 -0.08 0.58 0.09 0.00 0.00 178.44 179.51 1x59 h VAL 18 N 1.10 1.27 0.51 1.22 2.07 -0.90 0.76 116.25 122.29 1x59 h VAL 18 Ca 0.31 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 1x59 h VAL 18 Cb -0.09 1.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1x59 h VAL 18 CO -0.08 0.40 -0.25 0.50 0.02 0.00 0.00 177.57 178.17 1x59 h LYS 19 N 0.68 -0.66 -0.22 1.57 3.64 -0.26 -0.67 116.57 120.64 1x59 h LYS 19 Ca 0.12 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1x59 h LYS 19 Cb 0.62 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1x59 h LYS 19 CO 0.04 -0.39 0.11 -0.07 -2.27 0.00 0.00 179.45 176.86 1x59 h LEU 20 N -0.80 0.28 -0.59 5.20 -0.00 -0.81 0.14 115.31 118.73 1x59 h LEU 20 Ca -0.07 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 57.69 1x59 h LEU 20 Cb 0.58 -0.07 -0.03 0.00 -0.00 0.00 0.00 40.66 41.14 1x59 h LEU 20 CO 0.12 0.32 0.35 -0.61 -0.00 0.00 0.00 178.44 178.62 1x59 h GLN 21 N 0.23 0.80 -0.18 1.13 5.75 -0.89 0.19 115.11 122.14 1x59 h GLN 21 Ca 0.08 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1x59 h GLN 21 Cb 0.11 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 1x59 h GLN 21 CO -0.01 0.59 0.11 0.78 -2.65 0.00 0.00 178.83 177.65 1x59 h GLY 22 N 0.79 0.25 0.34 2.39 0.00 -0.77 0.03 103.07 106.11 1x59 h GLY 22 Ca 0.21 -0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.49 1x59 h GLY 22 CO -0.04 0.10 -0.19 0.83 0.00 0.00 0.00 176.54 177.24 1x59 h GLU 23 N 0.23 -0.21 -0.10 4.80 5.08 -0.42 -1.88 114.58 122.07 1x59 h GLU 23 Ca 0.06 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1x59 h GLU 23 Cb -0.01 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1x59 h GLU 23 CO -0.01 -0.14 -0.13 -0.09 -1.00 0.00 0.00 179.01 177.64 1x59 h ARG 24 N -0.22 -0.17 -0.14 2.33 2.43 -0.34 -0.91 114.38 117.37 1x59 h ARG 24 Ca 0.11 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1x59 h ARG 24 Cb 0.38 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1x59 h ARG 24 CO -0.30 -0.11 0.08 0.28 -1.51 0.00 0.00 179.97 178.42 1x59 h VAL 25 N -0.17 1.06 -0.82 0.20 2.07 -0.82 0.39 116.25 118.16 1x59 h VAL 25 Ca 0.08 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1x59 h VAL 25 Cb 0.29 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1x59 h VAL 25 CO -0.20 0.05 0.52 0.03 0.02 0.00 0.00 177.57 177.99 1x59 h ARG 26 N 0.16 0.96 -0.29 1.57 3.08 -1.17 -1.09 114.38 117.59 1x59 h ARG 26 Ca 0.05 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1x59 h ARG 26 Cb 0.02 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1x59 h ARG 26 CO -0.01 0.64 0.18 0.78 -1.07 0.00 0.00 179.97 180.48 1x59 h GLY 27 N 0.99 0.41 1.46 0.04 0.00 -0.18 -1.01 103.07 104.77 1x59 h GLY 27 Ca 0.34 -0.13 -0.16 0.00 0.00 0.00 0.00 47.33 47.38 1x59 h GLY 27 CO -0.13 0.12 -0.53 1.41 0.00 0.00 0.00 176.54 177.41 1x59 h LEU 28 N 0.36 0.63 -0.77 3.11 3.38 0.22 0.16 115.31 122.41 1x59 h LEU 28 Ca 0.11 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1x59 h LEU 28 Cb -0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1x59 h LEU 28 CO -0.05 1.05 0.47 0.11 0.09 0.00 0.00 178.44 180.11 1x59 h LYS 29 N 0.44 1.04 -0.85 1.13 1.57 -1.15 -0.91 116.57 117.85 1x59 h LYS 29 Ca 0.01 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1x59 h LYS 29 Cb 1.08 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.12 1x59 h LYS 29 CO 0.10 0.72 0.46 0.37 -0.57 0.00 0.00 179.45 180.54 1x59 h GLN 30 N 1.05 1.19 0.00 3.15 4.15 -0.73 -0.43 115.11 123.49 1x59 h GLN 30 Ca 0.28 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1x59 h GLN 30 Cb -0.06 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.40 1x59 h GLN 30 CO -0.05 0.88 0.00 1.04 -1.93 0.00 0.00 178.83 178.76 1x59 n GLN 31 N -4.37 0.51 -4.31 1.69 1.13 0.01 -4.89 117.38 107.14 1x59 n GLN 31 Ca 0.09 0.04 -0.32 0.00 -1.94 0.00 0.00 57.00 54.86 1x59 n GLN 31 Cb 0.10 -1.50 -0.08 0.00 0.11 0.00 0.00 30.24 28.86 1x59 n GLN 31 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1x59 n LYS 32 N -1.11 -1.27 -0.75 -1.09 5.02 -0.17 -4.95 118.16 113.84 1x59 n LYS 32 Ca 0.13 0.15 -0.29 0.00 -2.02 0.00 0.00 58.31 56.27 1x59 n LYS 32 Cb 0.11 -3.92 0.25 0.00 -0.02 0.00 0.00 35.03 31.45 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 -4.13 -0.05 0.32 7.82 0.00 -0.45 -4.94 121.76 120.33 1x59 s ALA 33 Ca 0.15 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.20 1x59 s ALA 33 Cb -0.09 -3.03 -0.11 0.00 0.00 0.00 0.00 23.12 19.89 1x59 s ALA 33 CO 0.99 -3.86 1.56 -1.12 0.00 0.00 0.00 175.76 173.33 1x59 s SER 34 N -3.25 6.36 0.47 0.00 0.01 -1.26 -4.87 113.70 111.15 1x59 s SER 34 Ca 0.69 2.99 0.16 0.00 1.31 0.00 0.00 55.95 61.09 1x59 s SER 34 Cb -0.16 -2.65 1.11 0.00 0.21 0.00 0.00 66.02 64.53 1x59 s SER 34 CO 0.59 -0.90 2.04 0.00 0.41 0.00 0.00 173.24 175.38 1x59 h ALA 35 N 4.20 1.75 0.21 1.44 0.00 -1.99 -1.71 119.26 123.16 1x59 h ALA 35 Ca -0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1x59 h ALA 35 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1x59 h ALA 35 CO 0.74 0.16 -0.10 0.93 0.00 0.00 0.00 179.25 180.98 1x59 h GLU 36 N 0.00 -0.27 -0.24 0.00 5.08 -1.98 -0.52 114.58 116.65 1x59 h GLU 36 Ca -0.00 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1x59 h GLU 36 Cb 0.24 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.49 1x59 h GLU 36 CO 0.02 -0.01 -0.15 1.25 -1.00 0.00 0.00 179.01 179.12 1x59 h LEU 37 N -0.52 -0.49 -0.68 1.33 5.85 -1.86 -0.63 115.31 118.32 1x59 h LEU 37 Ca -0.03 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1x59 h LEU 37 Cb 0.39 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1x59 h LEU 37 CO 0.05 -0.19 0.43 0.40 -0.34 0.00 0.00 178.44 178.79 1x59 h ILE 38 N -0.13 1.10 0.00 4.05 2.04 -1.26 -1.02 117.51 122.28 1x59 h ILE 38 Ca 0.13 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.66 1x59 h ILE 38 Cb 0.33 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1x59 h ILE 38 CO -0.32 0.15 -0.21 -0.33 0.00 0.00 0.00 178.15 177.44 1x59 h GLU 39 N 0.84 0.00 0.45 2.37 4.39 -0.65 0.73 114.58 122.71 1x59 h GLU 39 Ca 0.27 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.95 1x59 h GLU 39 Cb 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1x59 h GLU 39 CO -0.10 0.21 -0.22 1.49 -1.16 0.00 0.00 179.01 179.23 1x59 h GLU 40 N 0.00 -0.59 -0.03 2.33 4.22 -0.08 -1.76 114.58 118.68 1x59 h GLU 40 Ca -0.00 0.04 -0.12 0.00 0.08 0.00 0.00 59.36 59.36 1x59 h GLU 40 Cb 0.72 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1x59 h GLU 40 CO 0.03 -0.28 -0.55 1.05 -2.18 0.00 0.00 179.01 177.08 1x59 h GLU 41 N -0.89 0.09 -0.07 1.92 4.11 -1.07 -1.93 114.58 116.74 1x59 h GLU 41 Ca -0.06 -0.06 -0.02 0.00 0.07 0.00 0.00 59.36 59.29 1x59 h GLU 41 Cb 0.57 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1x59 h GLU 41 CO 0.10 0.62 -0.02 0.28 0.07 0.00 0.00 179.01 180.06 1x59 h VAL 42 N 0.07 1.29 -0.84 -1.06 2.07 -0.93 0.75 116.25 117.61 1x59 h VAL 42 Ca -0.00 -0.92 0.06 0.00 0.82 0.00 0.00 66.70 66.66 1x59 h VAL 42 Cb 0.99 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.45 1x59 h VAL 42 CO 0.08 0.26 0.51 0.00 0.02 0.00 0.00 177.57 178.44 1x59 h ALA 43 N 0.67 1.16 -0.64 1.67 0.00 -1.22 0.17 119.26 121.07 1x59 h ALA 43 Ca 0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1x59 h ALA 43 Cb 0.41 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1x59 h ALA 43 CO 0.01 0.24 0.07 0.87 0.00 0.00 0.00 179.25 180.44 1x59 h LYS 44 N 0.93 1.08 -0.16 0.00 1.57 -1.26 -1.20 116.57 117.54 1x59 h LYS 44 Ca 0.37 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1x59 h LYS 44 Cb 0.19 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1x59 h LYS 44 CO -0.18 1.02 0.09 1.25 -0.57 0.00 0.00 179.45 181.05 1x59 h LEU 45 N 0.99 0.20 0.61 2.94 5.85 -0.01 -1.19 115.31 124.70 1x59 h LEU 45 Ca 0.19 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1x59 h LEU 45 Cb 0.49 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1x59 h LEU 45 CO 0.02 0.22 -0.30 -0.07 -0.34 0.00 0.00 178.44 177.97 1x59 h LEU 46 N 0.16 -0.72 -1.26 2.25 3.38 -0.50 -1.02 115.31 117.59 1x59 h LEU 46 Ca 0.06 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1x59 h LEU 46 Cb 0.07 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1x59 h LEU 46 CO -0.01 -0.51 -0.36 0.07 0.09 0.00 0.00 178.44 177.72 1x59 h LYS 47 N -0.83 0.00 0.16 1.13 2.10 -1.27 -1.81 116.57 116.05 1x59 h LYS 47 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1x59 h LYS 47 Cb 0.64 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.96 1x59 h LYS 47 CO 0.13 0.36 -0.14 -0.07 -2.00 0.00 0.00 179.45 177.73 1x59 h LEU 48 N 0.00 -0.37 -1.37 7.07 3.38 -0.98 -2.77 115.31 120.28 1x59 h LEU 48 Ca -0.00 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1x59 h LEU 48 Cb 0.67 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1x59 h LEU 48 CO 0.05 -0.22 0.46 0.11 0.09 0.00 0.00 178.44 178.93 1x59 h LYS 49 N -0.32 0.79 0.00 1.13 1.57 -0.51 -0.70 116.57 118.53 1x59 h LYS 49 Ca -0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1x59 h LYS 49 Cb 0.29 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1x59 h LYS 49 CO -0.03 0.52 -0.03 0.00 -0.57 0.00 0.00 179.45 179.34 1x59 h ALA 50 N 1.60 1.10 0.03 3.86 0.00 -1.11 -1.99 119.26 122.75 1x59 h ALA 50 Ca 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1x59 h ALA 50 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1x59 h ALA 50 CO -0.08 0.04 -0.01 1.96 0.00 0.00 0.00 179.25 181.15 1x59 h GLN 51 N 0.00 -0.04 -0.54 0.00 4.20 -0.88 -3.39 115.11 114.45 1x59 h GLN 51 Ca -0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.79 1x59 h GLN 51 Cb 0.23 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1x59 h GLN 51 CO 0.00 0.61 0.36 -0.07 -0.67 0.00 0.00 178.83 179.06 1x59 h LEU 52 N -0.95 0.37 -8.49 1.46 -0.00 -0.72 -3.36 115.31 103.62 1x59 h LEU 52 Ca -0.00 0.00 -0.59 0.00 -0.00 0.00 0.00 57.88 57.29 1x59 h LEU 52 Cb 0.66 -0.07 -0.11 0.00 -0.00 0.00 0.00 40.66 41.14 1x59 h LEU 52 CO 0.01 0.23 0.70 -0.83 -0.00 0.00 0.00 178.44 178.55 1x59 s GLY 53 N -3.79 1.30 0.95 0.83 0.00 -0.96 -5.05 107.32 100.60 1x59 s GLY 53 Ca -0.08 -1.19 -0.12 0.00 0.00 0.00 0.00 44.72 43.33 1x59 s GLY 53 CO 0.74 2.21 1.11 2.56 0.00 0.00 0.00 173.10 179.72 1x59 s PRO 54 N 4.34 0.84 0.28 2.90 0.04 -1.26 -4.92 135.00 137.21 1x59 s PRO 54 Ca 0.33 0.43 -0.28 0.00 0.04 0.00 0.00 61.00 61.52 1x59 s PRO 54 Cb -0.11 -1.79 -0.14 0.00 0.04 0.00 0.00 34.50 32.49 1x59 s PRO 54 CO 0.20 -2.44 1.00 -0.40 0.04 0.00 0.00 177.00 175.41 1x59 n ASP 55 N -3.96 1.21 -4.70 6.66 5.75 -1.26 -4.95 116.55 115.30 1x59 n ASP 55 Ca 0.06 1.17 -0.42 0.00 -0.01 0.00 0.00 54.79 55.59 1x59 n ASP 55 Cb 0.58 -1.27 -0.00 0.00 -1.03 0.00 0.00 41.12 39.40 1x59 n ASP 55 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1x59 n GLU 56 N 0.82 2.07 0.00 0.11 1.02 -1.26 -4.86 120.64 118.53 1x59 n GLU 56 Ca 0.10 0.73 0.06 0.00 -0.02 0.00 0.00 57.16 58.04 1x59 n GLU 56 Cb 0.31 -2.35 0.39 0.00 -0.02 0.00 0.00 31.44 29.77 1x59 n GLU 56 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1x59 n SER 57 N 0.59 0.00 -4.75 1.62 7.64 -1.26 -4.73 113.62 112.73 1x59 n SER 57 Ca 0.05 -0.67 -0.41 0.00 1.01 0.00 0.00 58.87 58.85 1x59 n SER 57 Cb 0.37 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.55 1x59 n SER 57 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1x59 s LYS 58 N -2.00 4.24 -0.61 1.43 2.20 -1.26 -4.94 119.74 118.80 1x59 s LYS 58 Ca 0.19 2.36 -0.26 0.00 -0.36 0.00 0.00 55.97 57.90 1x59 s LYS 58 Cb 0.09 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.30 1x59 s LYS 58 CO 0.15 -0.43 2.00 -1.14 -0.36 0.00 0.00 175.35 175.57 1x59 s GLN 59 N -0.78 2.48 -0.41 4.03 0.74 -1.26 -4.86 119.66 119.60 1x59 s GLN 59 Ca 0.58 0.70 0.06 0.00 0.05 0.00 0.00 55.36 56.75 1x59 s GLN 59 Cb -0.43 -4.49 0.21 0.00 1.10 0.00 0.00 33.01 29.40 1x59 s GLN 59 CO 0.47 -2.94 0.48 1.17 -0.55 0.00 0.00 175.29 173.92 1x59 n LYS 60 N 9.12 0.48 -3.76 1.67 4.81 -1.26 -4.98 118.16 124.23 1x59 n LYS 60 Ca 0.26 -3.03 -0.29 0.00 -0.87 0.00 0.00 58.31 54.37 1x59 n LYS 60 Cb 0.52 -1.44 0.03 0.00 0.02 0.00 0.00 35.03 34.16 1x59 n LYS 60 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1x59 n PHE 61 N 2.14 -1.83 -3.39 5.64 3.01 -1.26 -4.98 117.46 116.79 1x59 n PHE 61 Ca 0.24 0.55 -0.27 0.00 1.01 0.00 0.00 57.45 58.98 1x59 n PHE 61 Cb 0.52 -3.59 -0.10 0.00 -0.01 0.00 0.00 39.48 36.30 1x59 n PHE 61 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1x59 n VAL 62 N -4.27 -1.19 -3.39 -4.37 3.14 -1.26 -5.10 118.33 101.89 1x59 n VAL 62 Ca -0.17 -3.44 0.00 0.00 -2.96 0.00 0.00 64.34 57.77 1x59 n VAL 62 Cb 0.62 -1.66 0.00 0.00 -1.06 0.00 0.00 33.84 31.74 1x59 n VAL 62 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1x59 n LEU 63 N 2.82 0.00 -3.17 6.55 4.32 -1.26 -4.17 117.00 122.08 1x59 n LEU 63 Ca 0.30 0.00 -0.22 0.00 -0.02 0.00 0.00 56.01 56.06 1x59 n LEU 63 Cb 0.48 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.23 1x59 n LEU 63 CO 0.08 0.00 -0.15 2.29 -1.22 0.00 0.00 177.39 178.39 1x59 n LYS 64 N 5.65 1.47 -1.41 3.23 2.85 -1.26 -5.04 118.16 123.65 1x59 n LYS 64 Ca 0.00 -3.74 0.00 0.00 -1.05 0.00 0.00 58.31 53.52 1x59 n LYS 64 Cb 0.00 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 32.66 1x59 n LYS 64 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1x59 n THR 65 N 0.58 -3.21 0.20 0.58 -1.04 -1.26 -4.90 114.28 105.23 1x59 n THR 65 Ca 0.25 1.53 -0.09 0.00 -2.04 0.00 0.00 64.05 63.71 1x59 n THR 65 Cb 0.55 -2.38 -0.04 0.00 -1.82 0.00 0.00 70.33 66.63 1x59 n THR 65 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1x59 h PRO 66 N 0.51 -0.54 -3.57 -2.82 0.13 -1.98 -3.49 132.00 120.24 1x59 h PRO 66 Ca 0.00 0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.11 1x59 h PRO 66 Cb 0.63 0.12 -0.12 0.00 0.13 0.00 0.00 31.00 31.77 1x59 h PRO 66 CO 0.00 -0.36 -0.14 -1.59 -0.23 0.00 0.00 178.00 175.68 1x59 s LYS 67 N -3.39 1.22 0.68 0.86 0.00 -1.26 -5.18 119.74 112.67 1x59 s LYS 67 Ca -0.08 -0.97 -0.10 0.00 0.00 0.00 0.00 55.97 54.81 1x59 s LYS 67 Cb 0.01 0.45 0.01 0.00 0.00 0.00 0.00 37.83 38.30 1x59 s LYS 67 CO 0.24 -0.48 1.06 0.45 0.00 0.00 0.00 175.35 176.62 1x59 s SER 68 N -2.90 5.49 0.00 0.03 0.15 -1.26 -5.03 113.70 110.18 1x59 s SER 68 Ca 0.11 1.06 0.00 0.00 0.70 0.00 0.00 55.95 57.82 1x59 s SER 68 Cb 0.01 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 1x59 s SER 68 CO -0.03 -1.28 0.00 0.61 1.20 0.00 0.00 173.24 173.74 1x59 n GLY 69 N -2.93 2.90 3.59 9.45 0.00 -1.26 -5.10 105.19 111.85 1x59 n GLY 69 Ca 0.06 -1.98 -0.30 0.00 0.00 0.00 0.00 46.02 43.80 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 -2.15 -1.15 0.03 1.61 0.04 -1.26 -5.10 135.00 127.03 1x59 s PRO 70 Ca 0.00 -0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.09 1x59 s PRO 70 Cb 0.00 -1.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.91 1x59 s PRO 70 CO 0.00 -3.67 -0.24 -1.12 0.04 0.00 0.00 177.00 172.01 1x59 s SER 71 N -3.86 2.87 0.35 6.66 0.01 -1.26 -5.06 113.70 113.42 1x59 s SER 71 Ca 0.71 -0.54 0.00 0.00 1.31 0.00 0.00 55.95 57.42 1x59 s SER 71 Cb -0.10 -0.26 0.00 0.00 0.21 0.00 0.00 66.02 65.86 1x59 s SER 71 CO 0.56 0.23 0.00 -1.20 0.41 0.00 0.00 173.24 173.24 1x59 n SER 72 N 1.91 -7.41 0.00 2.44 7.64 -1.26 -5.29 113.62 111.65 1x59 n SER 72 Ca -0.17 0.69 0.00 0.00 1.01 0.00 0.00 58.87 60.40 1x59 n SER 72 Cb 0.52 -4.04 0.00 0.00 -1.01 0.00 0.00 64.21 59.68 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64