#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 -0.14 0.00 1.61 0.01 -1.26 -5.07 113.70 108.85 1x59 s SER 2 Ca 0.00 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.70 1x59 s SER 2 Cb 0.00 0.49 0.00 0.00 0.21 0.00 0.00 66.02 66.72 1x59 s SER 2 CO 0.00 -0.93 0.42 -1.20 0.41 0.00 0.00 173.24 171.93 1x59 n SER 3 N -0.25 0.00 0.00 2.44 7.64 -1.26 -5.09 113.62 117.10 1x59 n SER 3 Ca -0.11 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.25 1x59 n SER 3 Cb 0.63 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 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 0.48 -2.20 0.00 0.23 0.00 -1.26 -4.84 105.19 97.60 1x59 n GLY 4 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1x59 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x59 n SER 5 N 0.33 0.00 0.00 1.61 2.88 -1.26 -4.90 113.62 112.28 1x59 n SER 5 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x59 n SER 5 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1x59 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x59 n SER 6 N -0.33 0.00 -0.64 -3.46 7.64 -1.26 -5.07 113.62 110.50 1x59 n SER 6 Ca 0.00 0.43 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1x59 n SER 6 Cb 0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 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 1.04 0.36 0.38 0.23 0.00 -1.26 -4.86 105.19 101.08 1x59 n GLY 7 Ca 0.00 -0.51 0.20 0.00 0.00 0.00 0.00 46.02 45.71 1x59 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x59 h MET 8 N 0.00 0.00 0.16 1.61 -0.00 -1.97 -0.64 114.93 114.08 1x59 h MET 8 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 59.70 59.41 1x59 h MET 8 Cb 0.42 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.04 1x59 h MET 8 CO 0.00 0.00 -1.29 0.00 -0.00 0.00 0.00 176.91 175.62 1x59 h ALA 9 N 1.73 0.04 -0.50 -3.00 0.00 -1.98 0.11 119.26 115.66 1x59 h ALA 9 Ca 0.25 -0.87 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 1x59 h ALA 9 Cb 1.00 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1x59 h ALA 9 CO -0.00 0.89 0.21 0.93 0.00 0.00 0.00 179.25 181.28 1x59 h GLU 10 N 0.10 0.72 0.31 0.00 5.08 -1.51 -0.97 114.58 118.31 1x59 h GLU 10 Ca -0.16 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1x59 h GLU 10 Cb 2.01 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 31.13 1x59 h GLU 10 CO 0.22 0.59 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.58 1x59 h ARG 11 N 0.71 -0.40 -0.97 2.33 2.43 -1.22 -2.89 114.38 114.37 1x59 h ARG 11 Ca 0.17 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.51 1x59 h ARG 11 Cb 0.13 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 29.69 1x59 h ARG 11 CO -0.02 -0.07 0.61 0.00 -1.51 0.00 0.00 179.97 178.99 1x59 h ALA 12 N -0.39 1.63 -0.59 2.80 0.00 -0.57 0.20 119.26 122.34 1x59 h ALA 12 Ca -0.04 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1x59 h ALA 12 Cb 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1x59 h ALA 12 CO 0.07 0.11 0.05 0.00 0.00 0.00 0.00 179.25 179.48 1x59 h ALA 13 N 1.57 0.79 -0.33 0.00 0.00 -1.27 -0.79 119.26 119.24 1x59 h ALA 13 Ca 0.49 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 1x59 h ALA 13 Cb 0.60 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1x59 h ALA 13 CO -0.26 0.58 -0.48 1.25 0.00 0.00 0.00 179.25 180.35 1x59 h LEU 14 N 0.90 0.99 -2.29 0.00 6.46 -0.92 -2.84 115.31 117.61 1x59 h LEU 14 Ca 0.17 -0.50 -0.00 0.00 -0.12 0.00 0.00 57.88 57.43 1x59 h LEU 14 Cb 0.48 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1x59 h LEU 14 CO 0.02 1.30 -0.02 -0.33 -0.62 0.00 0.00 178.44 178.79 1x59 h GLU 15 N 0.70 0.00 -0.38 1.25 4.39 -0.55 -0.94 114.58 119.05 1x59 h GLU 15 Ca 0.03 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.66 1x59 h GLU 15 Cb 1.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 1x59 h GLU 15 CO 0.11 0.02 -0.04 1.49 -1.16 0.00 0.00 179.01 179.43 1x59 h GLU 16 N 0.00 0.70 -0.36 2.33 4.81 -0.90 0.89 114.58 122.05 1x59 h GLU 16 Ca -0.00 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1x59 h GLU 16 Cb 0.03 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1x59 h GLU 16 CO 0.00 0.82 0.22 -0.07 -0.73 0.00 0.00 179.01 179.25 1x59 h LEU 17 N 0.51 0.43 -0.18 1.64 3.38 -1.12 -0.76 115.31 119.20 1x59 h LEU 17 Ca 0.10 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1x59 h LEU 17 Cb 0.53 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1x59 h LEU 17 CO 0.03 0.35 -0.04 0.58 0.09 0.00 0.00 178.44 179.45 1x59 h VAL 18 N 0.47 0.83 0.76 1.22 2.07 -1.12 0.47 116.25 120.94 1x59 h VAL 18 Ca 0.13 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 1x59 h VAL 18 Cb 0.00 0.82 0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1x59 h VAL 18 CO -0.02 0.00 -0.36 0.50 0.02 0.00 0.00 177.57 177.70 1x59 h LYS 19 N 0.00 -0.98 -0.56 1.57 3.64 -0.63 -0.87 116.57 118.73 1x59 h LYS 19 Ca 0.09 0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1x59 h LYS 19 Cb 0.13 0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1x59 h LYS 19 CO -0.18 -0.64 0.24 -0.07 -2.27 0.00 0.00 179.45 176.53 1x59 h LEU 20 N -1.09 0.73 -0.52 5.20 -0.00 -1.08 0.18 115.31 118.74 1x59 h LEU 20 Ca -0.10 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 57.69 1x59 h LEU 20 Cb 0.80 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 41.24 1x59 h LEU 20 CO 0.17 0.65 0.30 -0.61 -0.00 0.00 0.00 178.44 178.95 1x59 h GLN 21 N 0.80 0.71 0.26 1.13 5.75 -0.84 0.16 115.11 123.08 1x59 h GLN 21 Ca 0.19 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.62 1x59 h GLN 21 Cb 0.13 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 1x59 h GLN 21 CO -0.02 0.52 -0.18 0.78 -2.65 0.00 0.00 178.83 177.29 1x59 h GLY 22 N 0.69 -0.44 0.68 2.39 0.00 -0.10 -1.64 103.07 104.65 1x59 h GLY 22 Ca 0.18 0.20 0.06 0.00 0.00 0.00 0.00 47.33 47.77 1x59 h GLY 22 CO -0.03 -0.18 0.34 -2.09 0.00 0.00 0.00 176.54 174.58 1x59 h GLU 23 N -0.43 0.62 0.46 4.80 4.57 -0.49 -1.35 114.58 122.76 1x59 h GLU 23 Ca -0.02 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 1x59 h GLU 23 Cb 0.37 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1x59 h GLU 23 CO 0.01 0.41 -0.22 -0.09 -1.18 0.00 0.00 179.01 177.94 1x59 h ARG 24 N 0.64 -0.59 -0.22 1.92 2.43 -0.55 0.20 114.38 118.20 1x59 h ARG 24 Ca 0.28 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.54 1x59 h ARG 24 Cb 0.18 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 1x59 h ARG 24 CO -0.18 -0.39 -0.09 0.28 -1.51 0.00 0.00 179.97 178.08 1x59 h VAL 25 N -0.63 0.70 -0.31 0.20 2.07 -1.01 0.51 116.25 117.77 1x59 h VAL 25 Ca -0.06 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1x59 h VAL 25 Cb 0.48 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1x59 h VAL 25 CO 0.10 0.00 0.11 -0.09 0.02 0.00 0.00 177.57 177.72 1x59 h ARG 26 N -0.06 0.44 0.14 1.57 2.43 -1.07 -1.52 114.38 116.30 1x59 h ARG 26 Ca 0.12 -0.05 -0.30 0.00 -0.81 0.00 0.00 59.98 58.93 1x59 h ARG 26 Cb 0.23 -0.08 0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1x59 h ARG 26 CO -0.26 0.38 -1.27 0.78 -1.51 0.00 0.00 179.97 178.09 1x59 h GLY 27 N 0.60 0.64 0.99 2.80 0.00 0.23 -2.94 103.07 105.39 1x59 h GLY 27 Ca 0.11 -1.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.06 1x59 h GLY 27 CO -0.01 1.21 0.32 1.41 0.00 0.00 0.00 176.54 179.47 1x59 h LEU 28 N 0.23 0.68 -0.02 3.11 3.38 0.41 0.11 115.31 123.21 1x59 h LEU 28 Ca -0.19 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.75 1x59 h LEU 28 Cb 1.94 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 42.47 1x59 h LEU 28 CO 0.24 0.55 -0.29 0.11 0.09 0.00 0.00 178.44 179.14 1x59 h LYS 29 N 0.75 -0.41 -0.97 1.13 1.57 -1.37 -0.93 116.57 116.34 1x59 h LYS 29 Ca 0.20 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.03 1x59 h LYS 29 Cb 0.01 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 1x59 h LYS 29 CO -0.04 -0.27 0.64 0.37 -0.57 0.00 0.00 179.45 179.58 1x59 h GLN 30 N -0.42 1.22 0.00 3.15 4.15 -1.23 -1.95 115.11 120.02 1x59 h GLN 30 Ca 0.07 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1x59 h GLN 30 Cb 0.52 -0.27 0.00 0.00 0.21 0.00 0.00 27.48 27.94 1x59 h GLN 30 CO -0.26 0.81 0.00 1.04 -1.93 0.00 0.00 178.83 178.48 1x59 n GLN 31 N -4.42 0.42 -4.14 1.69 1.13 0.33 -4.83 117.38 107.56 1x59 n GLN 31 Ca 0.13 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.83 1x59 n GLN 31 Cb 0.07 -1.26 -0.04 0.00 0.11 0.00 0.00 30.24 29.12 1x59 n GLN 31 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1x59 n LYS 32 N -0.76 -2.40 -0.79 -1.09 2.85 -0.73 -4.94 118.16 110.29 1x59 n LYS 32 Ca 0.05 0.29 -0.30 0.00 -1.05 0.00 0.00 58.31 57.30 1x59 n LYS 32 Cb 0.02 -4.96 0.18 0.00 -0.65 0.00 0.00 35.03 29.62 1x59 n LYS 32 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1x59 s ALA 33 N -3.16 0.95 0.02 0.58 0.00 -0.40 -4.92 121.76 114.83 1x59 s ALA 33 Ca 0.70 0.23 -0.34 0.00 0.00 0.00 0.00 51.96 52.55 1x59 s ALA 33 Cb -0.39 -3.33 -0.12 0.00 0.00 0.00 0.00 23.12 19.28 1x59 s ALA 33 CO 0.86 -2.94 1.78 0.43 0.00 0.00 0.00 175.76 175.89 1x59 n SER 34 N -4.32 3.44 -0.30 0.00 7.64 -1.26 -4.88 113.62 113.93 1x59 n SER 34 Ca 0.08 1.01 0.10 0.00 1.01 0.00 0.00 58.87 61.07 1x59 n SER 34 Cb 0.53 -1.42 0.27 0.00 -1.01 0.00 0.00 64.21 62.58 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 8.13 1.36 -0.09 -0.43 0.00 -1.99 -1.37 119.26 124.87 1x59 h ALA 35 Ca -0.47 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 1x59 h ALA 35 Cb 1.26 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1x59 h ALA 35 CO 0.93 -0.20 -0.52 1.49 0.00 0.00 0.00 179.25 180.94 1x59 h GLU 36 N 0.53 0.26 0.14 0.00 4.81 -1.99 -2.08 114.58 116.24 1x59 h GLU 36 Ca 0.51 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.58 1x59 h GLU 36 Cb 0.85 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.24 1x59 h GLU 36 CO -0.44 0.72 -0.06 1.25 -0.73 0.00 0.00 179.01 179.74 1x59 h LEU 37 N 0.20 -0.15 -0.53 1.64 5.85 -1.63 -0.24 115.31 120.44 1x59 h LEU 37 Ca 0.01 -0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.75 1x59 h LEU 37 Cb 0.99 0.04 -0.11 0.00 0.37 0.00 0.00 40.66 41.95 1x59 h LEU 37 CO 0.08 -0.03 -0.34 0.40 -0.34 0.00 0.00 178.44 178.22 1x59 h ILE 38 N -0.27 0.19 0.00 4.05 5.03 -1.47 -0.90 117.51 124.13 1x59 h ILE 38 Ca -0.02 0.00 -0.13 0.00 -0.12 0.00 0.00 64.86 64.59 1x59 h ILE 38 Cb 0.22 0.19 -0.02 0.00 -3.03 0.00 0.00 36.82 34.17 1x59 h ILE 38 CO 0.03 0.00 -0.61 -0.33 -0.68 0.00 0.00 178.15 176.56 1x59 h GLU 39 N -0.19 0.00 -0.38 2.37 5.08 -0.90 0.12 114.58 120.67 1x59 h GLU 39 Ca 0.21 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.42 1x59 h GLU 39 Cb 0.55 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1x59 h GLU 39 CO -0.64 0.61 -0.37 1.49 -1.00 0.00 0.00 179.01 179.11 1x59 h GLU 40 N 0.00 0.93 0.00 2.33 4.22 -0.88 -1.91 114.58 119.28 1x59 h GLU 40 Ca -0.01 -0.49 -0.07 0.00 0.08 0.00 0.00 59.36 58.88 1x59 h GLU 40 Cb 1.13 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1x59 h GLU 40 CO 0.08 1.14 -0.34 0.93 -2.18 0.00 0.00 179.01 178.64 1x59 h GLU 41 N 0.75 0.00 -0.33 1.92 4.39 -0.79 -1.10 114.58 119.42 1x59 h GLU 41 Ca 0.06 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.70 1x59 h GLU 41 Cb 0.96 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.60 1x59 h GLU 41 CO 0.09 0.34 -0.04 0.28 -1.16 0.00 0.00 179.01 178.52 1x59 h VAL 42 N 0.00 1.27 -0.60 3.13 2.07 -0.59 0.14 116.25 121.67 1x59 h VAL 42 Ca -0.00 -1.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.45 1x59 h VAL 42 Cb 0.61 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1x59 h VAL 42 CO 0.04 0.34 0.28 0.00 0.02 0.00 0.00 177.57 178.26 1x59 h ALA 43 N 0.83 0.77 -0.63 1.67 0.00 -1.01 -0.06 119.26 120.82 1x59 h ALA 43 Ca 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1x59 h ALA 43 Cb 0.51 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1x59 h ALA 43 CO 0.02 0.34 0.37 0.87 0.00 0.00 0.00 179.25 180.85 1x59 h LYS 44 N 0.81 0.86 -0.67 0.00 1.57 -1.10 0.37 116.57 118.42 1x59 h LYS 44 Ca 0.20 -0.09 0.10 0.00 -1.87 0.00 0.00 60.65 59.00 1x59 h LYS 44 Cb 0.13 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 32.19 1x59 h LYS 44 CO -0.02 0.63 0.29 1.25 -0.57 0.00 0.00 179.45 181.03 1x59 h LEU 45 N 0.85 0.34 -0.03 2.94 5.85 -0.40 -1.31 115.31 123.55 1x59 h LEU 45 Ca 0.22 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 1x59 h LEU 45 Cb -0.00 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1x59 h LEU 45 CO -0.04 0.19 0.01 -0.07 -0.34 0.00 0.00 178.44 178.19 1x59 h LEU 46 N 0.50 0.05 -0.28 2.25 3.38 -0.38 -1.57 115.31 119.26 1x59 h LEU 46 Ca 0.34 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.17 1x59 h LEU 46 Cb 0.41 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1x59 h LEU 46 CO -0.30 0.23 -0.01 0.11 0.09 0.00 0.00 178.44 178.56 1x59 h LYS 47 N -0.14 0.07 -0.30 1.13 1.79 -0.39 0.86 116.57 119.60 1x59 h LYS 47 Ca 0.01 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1x59 h LYS 47 Cb 0.20 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1x59 h LYS 47 CO -0.00 0.05 0.17 -0.07 -1.08 0.00 0.00 179.45 178.52 1x59 h LEU 48 N 0.07 0.38 -1.34 2.94 3.38 -1.29 -2.22 115.31 117.23 1x59 h LEU 48 Ca 0.14 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1x59 h LEU 48 Cb 0.18 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1x59 h LEU 48 CO -0.24 0.35 0.49 0.11 0.09 0.00 0.00 178.44 179.24 1x59 h LYS 49 N 0.38 0.79 0.00 1.13 1.57 -0.64 -0.61 116.57 119.18 1x59 h LYS 49 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1x59 h LYS 49 Cb 0.05 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1x59 h LYS 49 CO -0.02 0.52 0.00 0.00 -0.57 0.00 0.00 179.45 179.38 1x59 n ALA 50 N -2.44 1.75 -0.06 3.86 0.00 0.24 -0.85 120.51 123.00 1x59 n ALA 50 Ca 0.11 -0.05 -0.12 0.00 0.00 0.00 0.00 53.44 53.38 1x59 n ALA 50 Cb 0.21 -1.27 -0.11 0.00 0.00 0.00 0.00 19.45 18.28 1x59 n ALA 50 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1x59 h GLN 51 N 0.00 -0.01 -0.74 0.00 4.20 -0.78 -3.38 115.11 114.40 1x59 h GLN 51 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1x59 h GLN 51 Cb 0.28 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 1x59 h GLN 51 CO 0.00 0.81 0.48 -0.07 -0.67 0.00 0.00 178.83 179.38 1x59 h LEU 52 N -0.97 0.86 -8.92 1.46 -0.00 -1.21 -3.43 115.31 103.11 1x59 h LEU 52 Ca -0.00 -0.04 -0.57 0.00 -0.00 0.00 0.00 57.88 57.27 1x59 h LEU 52 Cb 0.82 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 41.23 1x59 h LEU 52 CO 0.00 0.64 1.13 -0.83 -0.00 0.00 0.00 178.44 179.38 1x59 s GLY 53 N -2.91 1.11 0.00 0.83 0.00 -0.03 -4.92 107.32 101.40 1x59 s GLY 53 Ca -0.13 0.22 0.28 0.00 0.00 0.00 0.00 44.72 45.09 1x59 s GLY 53 CO 0.78 2.95 1.98 -1.55 0.00 0.00 0.00 173.10 177.27 1x59 n PRO 54 N 7.90 0.51 -3.82 2.90 -0.04 -1.26 -4.54 135.00 136.66 1x59 n PRO 54 Ca 0.19 0.02 -0.30 0.00 -0.04 0.00 0.00 63.50 63.37 1x59 n PRO 54 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 1x59 n PRO 54 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1x59 s ASP 55 N -2.44 4.10 -0.48 3.54 2.15 -1.26 -5.00 116.67 117.28 1x59 s ASP 55 Ca 0.30 -2.29 0.06 0.00 0.43 0.00 0.00 52.55 51.06 1x59 s ASP 55 Cb 0.19 -1.20 0.21 0.00 -0.30 0.00 0.00 42.92 41.82 1x59 s ASP 55 CO 0.40 -0.33 0.72 1.21 -0.17 0.00 0.00 175.17 177.00 1x59 n GLU 56 N 4.02 0.60 -3.58 4.34 4.07 -1.26 -5.08 120.64 123.75 1x59 n GLU 56 Ca 0.04 -2.21 -0.27 0.00 -0.06 0.00 0.00 57.16 54.66 1x59 n GLU 56 Cb 0.38 -1.46 -0.10 0.00 -0.06 0.00 0.00 31.44 30.20 1x59 n GLU 56 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1x59 n SER 57 N 2.26 2.37 -4.31 4.31 2.88 -1.26 -5.00 113.62 114.87 1x59 n SER 57 Ca 0.17 -3.09 -0.34 0.00 -1.33 0.00 0.00 58.87 54.27 1x59 n SER 57 Cb 0.57 -0.68 -0.05 0.00 -0.75 0.00 0.00 64.21 63.30 1x59 n SER 57 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1x59 n LYS 58 N 1.67 1.81 0.00 -1.46 5.02 -1.26 -4.77 118.16 119.17 1x59 n LYS 58 Ca 0.25 -2.42 0.00 0.00 -2.02 0.00 0.00 58.31 54.12 1x59 n LYS 58 Cb 0.41 -3.48 0.00 0.00 -0.02 0.00 0.00 35.03 31.94 1x59 n LYS 58 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1x59 n GLN 59 N 7.89 0.00 -3.94 1.97 6.02 -1.26 -4.60 117.38 123.46 1x59 n GLN 59 Ca 0.47 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 57.32 1x59 n GLN 59 Cb 0.45 0.00 -0.15 0.00 1.02 0.00 0.00 30.24 31.56 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 0.16 -0.12 -1.09 1.02 -1.26 -5.14 119.74 113.32 1x59 s LYS 60 Ca 0.00 -0.01 -0.06 0.00 0.02 0.00 0.00 55.97 55.92 1x59 s LYS 60 Cb 0.00 -0.22 0.05 0.00 -0.52 0.00 0.00 37.83 37.14 1x59 s LYS 60 CO 0.00 -0.02 0.27 -0.59 -0.92 0.00 0.00 175.35 174.09 1x59 s PHE 61 N 0.29 -0.37 -0.49 3.18 -0.71 -1.26 -5.12 117.98 113.49 1x59 s PHE 61 Ca -0.03 0.87 0.05 0.00 -1.04 0.00 0.00 56.93 56.79 1x59 s PHE 61 Cb -0.05 0.08 0.19 0.00 -1.21 0.00 0.00 43.02 42.04 1x59 s PHE 61 CO -0.01 -0.25 0.77 0.14 -1.34 0.00 0.00 175.22 174.53 1x59 s VAL 62 N 1.30 -0.91 0.00 -2.49 -7.23 -1.26 -5.01 120.40 104.80 1x59 s VAL 62 Ca -0.09 -0.85 0.00 0.00 -1.81 0.00 0.00 61.98 59.23 1x59 s VAL 62 Cb -0.10 0.00 0.00 0.00 0.56 0.00 0.00 36.38 36.84 1x59 s VAL 62 CO -0.09 0.00 0.00 -0.11 -0.31 0.00 0.00 175.10 174.59 1x59 n LEU 63 N 2.99 0.41 -3.14 1.32 0.00 -1.26 -5.12 117.00 112.20 1x59 n LEU 63 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 56.01 55.99 1x59 n LEU 63 Cb 0.57 0.00 0.02 0.00 0.00 0.00 0.00 43.42 44.01 1x59 n LEU 63 CO -0.03 -0.13 -0.21 0.29 0.00 0.00 0.00 177.39 177.31 1x59 n LYS 64 N -2.31 -2.08 -5.10 1.96 5.02 -1.26 -5.02 118.16 109.37 1x59 n LYS 64 Ca 0.00 1.76 -0.32 0.00 -2.02 0.00 0.00 58.31 57.73 1x59 n LYS 64 Cb 0.16 -3.63 -0.15 0.00 -0.02 0.00 0.00 35.03 31.39 1x59 n LYS 64 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1x59 s THR 65 N -1.85 2.45 0.76 -0.18 -1.32 -1.26 -5.14 115.64 109.10 1x59 s THR 65 Ca 0.25 -0.92 -0.12 0.00 -1.21 0.00 0.00 61.69 59.69 1x59 s THR 65 Cb -0.04 -1.93 0.05 0.00 -1.51 0.00 0.00 72.50 69.06 1x59 s THR 65 CO 0.72 0.57 1.14 -2.16 -2.21 0.00 0.00 174.62 172.68 1x59 s PRO 66 N -0.20 2.41 0.03 7.08 0.04 -1.26 -5.11 135.00 137.99 1x59 s PRO 66 Ca -0.02 0.28 -0.00 0.00 0.04 0.00 0.00 61.00 61.30 1x59 s PRO 66 Cb -0.13 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 1x59 s PRO 66 CO 0.03 -1.32 -0.03 0.21 0.04 0.00 0.00 177.00 175.94 1x59 s LYS 67 N -5.47 0.42 0.22 4.56 2.20 -1.26 -5.16 119.74 115.24 1x59 s LYS 67 Ca 0.60 -0.81 -0.05 0.00 -0.36 0.00 0.00 55.97 55.34 1x59 s LYS 67 Cb -0.11 0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.33 1x59 s LYS 67 CO 0.50 -0.07 0.26 -1.12 -0.36 0.00 0.00 175.35 174.56 1x59 s SER 68 N -1.96 0.06 1.16 1.43 0.01 -1.26 -5.19 113.70 107.95 1x59 s SER 68 Ca -0.08 -1.22 -0.12 0.00 1.31 0.00 0.00 55.95 55.84 1x59 s SER 68 Cb -0.04 0.46 0.18 0.00 0.21 0.00 0.00 66.02 66.83 1x59 s SER 68 CO -0.04 -0.96 0.61 0.61 0.41 0.00 0.00 173.24 173.88 1x59 n GLY 69 N -0.31 -2.75 1.28 3.44 0.00 -1.26 -4.89 105.19 100.70 1x59 n GLY 69 Ca 0.01 -1.45 -0.01 0.00 0.00 0.00 0.00 46.02 44.56 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 -3.48 1.04 -1.64 1.61 -0.04 -1.26 -4.76 135.00 126.47 1x59 n PRO 70 Ca 0.09 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1x59 n PRO 70 Cb 0.34 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 1x59 n PRO 70 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x59 n SER 71 N 0.95 -7.18 -1.98 3.54 7.64 -1.26 -5.04 113.62 110.29 1x59 n SER 71 Ca 0.02 1.02 -0.02 0.00 1.01 0.00 0.00 58.87 60.89 1x59 n SER 71 Cb 0.52 -3.97 -0.02 0.00 -1.01 0.00 0.00 64.21 59.73 1x59 n SER 71 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x59 n SER 72 N 1.32 -2.28 0.00 6.43 2.88 -1.26 -5.26 113.62 115.45 1x59 n SER 72 Ca 0.00 0.78 0.00 0.00 -1.33 0.00 0.00 58.87 58.32 1x59 n SER 72 Cb 0.00 -3.25 0.00 0.00 -0.75 0.00 0.00 64.21 60.21 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42