#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 0.32 0.41 1.61 0.15 -1.26 -5.11 113.70 109.82 1x59 s SER 2 Ca 0.00 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 55.87 1x59 s SER 2 Cb 0.00 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 1x59 s SER 2 CO 0.00 -0.59 0.00 -0.24 1.20 0.00 0.00 173.24 173.61 1x59 n SER 3 N 0.31 -1.13 -3.59 5.45 2.88 -1.26 -5.00 113.62 111.27 1x59 n SER 3 Ca -0.16 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.41 1x59 n SER 3 Cb 0.60 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1x59 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x59 s GLY 4 N -1.58 -0.45 -0.36 0.46 0.00 -1.26 -5.10 107.32 99.03 1x59 s GLY 4 Ca 0.00 0.81 -0.29 0.00 0.00 0.00 0.00 44.72 45.24 1x59 s GLY 4 CO 0.00 0.21 1.26 -0.45 0.00 0.00 0.00 173.10 174.11 1x59 s SER 5 N -3.00 6.64 -0.42 1.64 0.15 -1.26 -4.92 113.70 112.53 1x59 s SER 5 Ca 0.15 0.98 0.07 0.00 0.70 0.00 0.00 55.95 57.84 1x59 s SER 5 Cb 0.06 -2.54 0.23 0.00 -1.71 0.00 0.00 66.02 62.06 1x59 s SER 5 CO -0.05 -1.15 0.57 -1.54 1.20 0.00 0.00 173.24 172.27 1x59 n SER 6 N 7.76 -0.88 0.00 5.45 3.41 -1.26 -5.01 113.62 123.09 1x59 n SER 6 Ca 0.14 -2.76 0.00 0.00 -0.26 0.00 0.00 58.87 55.99 1x59 n SER 6 Cb 0.47 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1x59 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x59 n GLY 7 N 1.89 0.83 0.30 5.00 0.00 -1.26 -5.02 105.19 106.93 1x59 n GLY 7 Ca 0.20 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 0.87 0.84 1.61 4.05 -2.00 -0.64 114.93 119.66 1x59 h MET 8 Ca 0.00 -0.05 -0.04 0.00 -0.28 0.00 0.00 59.70 59.33 1x59 h MET 8 Cb 0.00 -0.20 0.01 0.00 -0.80 0.00 0.00 31.60 30.61 1x59 h MET 8 CO 0.00 0.58 -0.43 0.00 0.23 0.00 0.00 176.91 177.29 1x59 h ALA 9 N 1.37 -1.17 0.00 0.39 0.00 -1.99 0.11 119.26 117.97 1x59 h ALA 9 Ca 0.34 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1x59 h ALA 9 Cb 0.12 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1x59 h ALA 9 CO -0.16 -1.16 -0.21 0.93 0.00 0.00 0.00 179.25 178.66 1x59 h GLU 10 N -1.16 0.00 0.01 0.00 4.39 -1.94 -2.27 114.58 113.60 1x59 h GLU 10 Ca -0.11 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1x59 h GLU 10 Cb 0.90 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 1x59 h GLU 10 CO 0.17 0.21 -0.00 -0.09 -1.16 0.00 0.00 179.01 178.13 1x59 h ARG 11 N 0.00 -0.01 -0.66 2.33 2.43 -0.71 -2.99 114.38 114.78 1x59 h ARG 11 Ca -0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1x59 h ARG 11 Cb 0.42 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 1x59 h ARG 11 CO 0.03 0.24 0.44 0.00 -1.51 0.00 0.00 179.97 179.16 1x59 h ALA 12 N 0.73 1.56 -0.33 2.80 0.00 -0.20 0.31 119.26 124.14 1x59 h ALA 12 Ca -0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1x59 h ALA 12 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1x59 h ALA 12 CO 0.00 0.40 -0.05 0.00 0.00 0.00 0.00 179.25 179.60 1x59 h ALA 13 N 1.60 0.45 0.00 0.00 0.00 -1.56 0.45 119.26 120.20 1x59 h ALA 13 Ca 0.25 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1x59 h ALA 13 Cb -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1x59 h ALA 13 CO -0.06 0.25 -0.49 1.25 0.00 0.00 0.00 179.25 180.20 1x59 h LEU 14 N 0.40 0.00 -0.65 0.00 6.46 -1.18 -0.71 115.31 119.63 1x59 h LEU 14 Ca 0.09 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.79 1x59 h LEU 14 Cb 0.53 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.43 1x59 h LEU 14 CO 0.03 0.49 0.18 -0.33 -0.62 0.00 0.00 178.44 178.19 1x59 h GLU 15 N 0.00 1.03 -0.36 1.25 4.39 -0.31 -0.78 114.58 119.80 1x59 h GLU 15 Ca -0.00 -0.23 0.02 0.00 0.34 0.00 0.00 59.36 59.48 1x59 h GLU 15 Cb 0.97 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.45 1x59 h GLU 15 CO 0.06 0.91 0.20 1.49 -1.16 0.00 0.00 179.01 180.51 1x59 h GLU 16 N 0.95 0.39 0.07 2.33 4.81 -0.19 0.26 114.58 123.19 1x59 h GLU 16 Ca 0.21 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1x59 h GLU 16 Cb 0.33 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1x59 h GLU 16 CO -0.00 0.26 -0.21 -0.07 -0.73 0.00 0.00 179.01 178.26 1x59 h LEU 17 N 0.40 -0.60 0.28 1.64 3.38 -0.89 0.74 115.31 120.26 1x59 h LEU 17 Ca 0.15 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1x59 h LEU 17 Cb 0.03 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1x59 h LEU 17 CO -0.08 -0.29 -0.36 0.58 0.09 0.00 0.00 178.44 178.38 1x59 h VAL 18 N -0.37 0.26 -0.08 1.22 2.07 -0.86 -0.21 116.25 118.27 1x59 h VAL 18 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1x59 h VAL 18 Cb 0.41 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1x59 h VAL 18 CO -0.14 0.00 0.05 0.50 0.02 0.00 0.00 177.57 177.99 1x59 h LYS 19 N -0.70 0.10 -0.38 1.57 3.11 -0.34 0.43 116.57 120.37 1x59 h LYS 19 Ca -0.01 -0.01 -0.15 0.00 -2.81 0.00 0.00 60.65 57.67 1x59 h LYS 19 Cb 0.66 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.86 1x59 h LYS 19 CO -0.11 0.06 -0.38 -0.07 -2.81 0.00 0.00 179.45 176.15 1x59 h LEU 20 N 0.10 0.96 -0.01 5.20 -0.00 -0.84 0.16 115.31 120.88 1x59 h LEU 20 Ca 0.03 -0.43 0.01 0.00 -0.00 0.00 0.00 57.88 57.49 1x59 h LEU 20 Cb -0.01 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 40.37 1x59 h LEU 20 CO -0.01 1.22 -0.08 -0.61 -0.00 0.00 0.00 178.44 178.96 1x59 h GLN 21 N 0.74 -0.13 -0.51 1.13 5.75 -0.85 -0.20 115.11 121.04 1x59 h GLN 21 Ca 0.06 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.55 1x59 h GLN 21 Cb 0.96 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.51 1x59 h GLN 21 CO 0.09 -0.08 0.22 0.78 -2.65 0.00 0.00 178.83 177.19 1x59 h GLY 22 N -0.13 0.81 0.98 2.39 0.00 -0.61 0.77 103.07 107.28 1x59 h GLY 22 Ca 0.03 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 46.94 1x59 h GLY 22 CO -0.08 0.40 0.18 0.83 0.00 0.00 0.00 176.54 177.87 1x59 h GLU 23 N 0.69 0.37 -0.29 4.80 4.39 -0.63 -1.82 114.58 122.09 1x59 h GLU 23 Ca 0.17 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 1x59 h GLU 23 Cb 0.16 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1x59 h GLU 23 CO -0.02 0.24 0.09 -0.09 -1.16 0.00 0.00 179.01 178.07 1x59 h ARG 24 N 0.38 0.45 -0.55 2.33 2.43 -0.70 -1.30 114.38 117.42 1x59 h ARG 24 Ca 0.11 -0.10 0.11 0.00 -0.81 0.00 0.00 59.98 59.29 1x59 h ARG 24 Cb -0.03 -0.06 -0.11 0.00 -0.42 0.00 0.00 29.97 29.35 1x59 h ARG 24 CO -0.03 0.51 -0.19 0.28 -1.51 0.00 0.00 179.97 179.02 1x59 h VAL 25 N 0.30 0.36 -0.56 0.20 2.07 -0.73 0.38 116.25 118.28 1x59 h VAL 25 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1x59 h VAL 25 Cb 0.25 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 1x59 h VAL 25 CO -0.00 0.00 0.34 -0.09 0.02 0.00 0.00 177.57 177.84 1x59 h ARG 26 N -0.06 0.76 -0.57 1.57 2.43 -0.85 -1.43 114.38 116.23 1x59 h ARG 26 Ca 0.26 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.28 1x59 h ARG 26 Cb 0.46 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 1x59 h ARG 26 CO -0.60 0.54 0.04 0.78 -1.51 0.00 0.00 179.97 179.22 1x59 h GLY 27 N 0.75 1.06 1.25 2.80 0.00 -0.49 -2.47 103.07 105.98 1x59 h GLY 27 Ca 0.20 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 1x59 h GLY 27 CO -0.04 0.69 0.14 1.41 0.00 0.00 0.00 176.54 178.74 1x59 h LEU 28 N 0.87 0.87 -0.32 3.11 3.38 0.17 0.63 115.31 124.03 1x59 h LEU 28 Ca 0.17 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1x59 h LEU 28 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1x59 h LEU 28 CO 0.02 0.86 0.15 0.11 0.09 0.00 0.00 178.44 179.67 1x59 h LYS 29 N 0.89 0.46 -0.47 1.13 1.57 -1.19 -0.93 116.57 118.04 1x59 h LYS 29 Ca 0.19 -0.07 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1x59 h LYS 29 Cb 0.33 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 1x59 h LYS 29 CO 0.00 0.44 0.14 0.37 -0.57 0.00 0.00 179.45 179.83 1x59 h GLN 30 N 0.38 0.29 0.00 3.15 4.15 -0.88 -2.08 115.11 120.12 1x59 h GLN 30 Ca 0.11 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1x59 h GLN 30 Cb 0.13 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1x59 h GLN 30 CO -0.01 0.19 0.00 0.00 -1.93 0.00 0.00 178.83 177.08 1x59 n GLN 31 N -5.04 0.43 -3.84 1.69 10.64 0.14 -4.86 117.38 116.54 1x59 n GLN 31 Ca 0.04 0.06 -0.24 0.00 -1.83 0.00 0.00 57.00 55.03 1x59 n GLN 31 Cb 0.20 -1.50 0.00 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 -1.16 -4.03 -0.77 2.61 5.02 -0.78 -4.97 118.16 114.07 1x59 n LYS 32 Ca 0.12 0.50 -0.29 0.00 -2.02 0.00 0.00 58.31 56.62 1x59 n LYS 32 Cb 0.11 -4.83 0.24 0.00 -0.02 0.00 0.00 35.03 30.54 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 -3.82 -0.01 -0.16 7.82 0.00 -0.42 -4.91 121.76 120.25 1x59 s ALA 33 Ca 0.02 -0.52 -0.38 0.00 0.00 0.00 0.00 51.96 51.08 1x59 s ALA 33 Cb -0.01 -3.07 -0.15 0.00 0.00 0.00 0.00 23.12 19.89 1x59 s ALA 33 CO 0.85 -3.74 1.72 0.43 0.00 0.00 0.00 175.76 175.02 1x59 n SER 34 N -4.88 2.59 0.19 0.00 7.64 -1.26 -4.85 113.62 113.05 1x59 n SER 34 Ca 0.07 1.06 0.03 0.00 1.01 0.00 0.00 58.87 61.04 1x59 n SER 34 Cb 0.57 -1.22 0.38 0.00 -1.01 0.00 0.00 64.21 62.94 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 7.31 1.38 0.02 -0.43 0.00 -1.99 -0.64 119.26 124.91 1x59 h ALA 35 Ca -0.47 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.12 1x59 h ALA 35 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1x59 h ALA 35 CO 0.93 0.44 -0.01 1.49 0.00 0.00 0.00 179.25 182.10 1x59 h GLU 36 N 0.00 -0.02 -0.82 0.00 4.81 -1.99 -2.93 114.58 113.63 1x59 h GLU 36 Ca -0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 1x59 h GLU 36 Cb 0.63 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.94 1x59 h GLU 36 CO 0.05 0.43 0.44 1.25 -0.73 0.00 0.00 179.01 180.45 1x59 h LEU 37 N -0.47 0.59 -0.37 1.64 5.85 -1.79 0.22 115.31 120.97 1x59 h LEU 37 Ca -0.00 0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.86 1x59 h LEU 37 Cb 0.46 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.38 1x59 h LEU 37 CO 0.00 0.30 -0.09 0.40 -0.34 0.00 0.00 178.44 178.71 1x59 h ILE 38 N 0.69 0.63 -0.02 4.05 2.04 -1.16 -0.13 117.51 123.62 1x59 h ILE 38 Ca 0.42 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 66.12 1x59 h ILE 38 Cb 0.49 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1x59 h ILE 38 CO -0.30 0.00 -0.73 -0.33 0.00 0.00 0.00 178.15 176.79 1x59 h GLU 39 N -0.00 0.13 -0.06 2.37 4.39 -0.81 -1.67 114.58 118.92 1x59 h GLU 39 Ca 0.18 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.77 1x59 h GLU 39 Cb 0.27 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1x59 h GLU 39 CO -0.38 0.80 0.00 0.93 -1.16 0.00 0.00 179.01 179.20 1x59 h GLU 40 N 0.08 0.03 0.00 2.33 5.08 -0.39 -1.08 114.58 120.63 1x59 h GLU 40 Ca -0.02 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1x59 h GLU 40 Cb 1.29 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1x59 h GLU 40 CO 0.11 0.02 -0.31 0.93 -1.00 0.00 0.00 179.01 178.75 1x59 h GLU 41 N 0.03 0.00 -0.07 2.33 4.39 -0.85 0.91 114.58 121.32 1x59 h GLU 41 Ca 0.03 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1x59 h GLU 41 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1x59 h GLU 41 CO -0.04 0.31 -0.30 0.28 -1.16 0.00 0.00 179.01 178.10 1x59 h VAL 42 N 0.00 1.43 -0.42 3.13 2.07 -1.17 -0.77 116.25 120.52 1x59 h VAL 42 Ca -0.00 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 65.81 1x59 h VAL 42 Cb 0.78 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 1x59 h VAL 42 CO 0.04 0.49 0.27 0.00 0.02 0.00 0.00 177.57 178.39 1x59 h ALA 43 N 0.43 0.54 -0.58 1.67 0.00 -0.87 0.41 119.26 120.85 1x59 h ALA 43 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1x59 h ALA 43 Cb 0.95 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1x59 h ALA 43 CO 0.06 0.00 0.38 0.87 0.00 0.00 0.00 179.25 180.57 1x59 h LYS 44 N 0.57 0.77 -0.44 0.00 1.57 -0.88 -0.48 116.57 117.68 1x59 h LYS 44 Ca 0.15 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.94 1x59 h LYS 44 Cb -0.04 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.04 1x59 h LYS 44 CO -0.03 0.52 0.15 1.25 -0.57 0.00 0.00 179.45 180.77 1x59 h LEU 45 N 0.79 0.16 0.41 2.94 5.85 -0.83 -0.64 115.31 123.98 1x59 h LEU 45 Ca 0.21 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1x59 h LEU 45 Cb -0.08 0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1x59 h LEU 45 CO -0.05 0.12 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.91 1x59 h LEU 46 N 0.32 -0.46 -1.54 2.25 3.38 -0.14 -0.74 115.31 118.37 1x59 h LEU 46 Ca 0.21 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1x59 h LEU 46 Cb 0.20 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1x59 h LEU 46 CO -0.21 -0.17 -0.17 0.07 0.09 0.00 0.00 178.44 178.05 1x59 h LYS 47 N -0.77 0.08 0.55 1.13 2.10 -1.13 -1.32 116.57 117.21 1x59 h LYS 47 Ca -0.06 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 1x59 h LYS 47 Cb 0.53 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.83 1x59 h LYS 47 CO 0.09 0.25 -0.40 -0.07 -2.00 0.00 0.00 179.45 177.33 1x59 h LEU 48 N 0.08 -1.03 -1.09 7.07 3.38 -0.91 -3.01 115.31 119.80 1x59 h LEU 48 Ca 0.02 0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.18 1x59 h LEU 48 Cb 0.35 0.32 -0.08 0.00 0.09 0.00 0.00 40.66 41.34 1x59 h LEU 48 CO 0.02 -0.59 0.61 0.11 0.09 0.00 0.00 178.44 178.69 1x59 h LYS 49 N -0.92 0.90 -0.21 1.13 1.57 -0.41 -1.78 116.57 116.84 1x59 h LYS 49 Ca -0.06 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1x59 h LYS 49 Cb 0.77 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1x59 h LYS 49 CO 0.02 0.60 0.16 0.00 -0.57 0.00 0.00 179.45 179.66 1x59 h ALA 50 N 1.55 2.17 -0.09 3.86 0.00 -1.13 -2.12 119.26 123.50 1x59 h ALA 50 Ca 0.48 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.25 1x59 h ALA 50 Cb 0.51 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1x59 h ALA 50 CO -0.24 -0.27 -0.52 1.96 0.00 0.00 0.00 179.25 180.18 1x59 h GLN 51 N 0.00 0.25 0.00 0.00 4.20 -1.30 -3.01 115.11 115.25 1x59 h GLN 51 Ca 0.10 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1x59 h GLN 51 Cb 0.42 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1x59 h GLN 51 CO -0.00 0.71 0.00 -0.07 -0.67 0.00 0.00 178.83 178.80 1x59 h LEU 52 N 0.20 0.00 -2.85 1.46 -0.00 -1.48 -3.47 115.31 109.17 1x59 h LEU 52 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 1x59 h LEU 52 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 1x59 h LEU 52 CO 0.08 0.00 -0.11 0.61 -0.00 0.00 0.00 178.44 179.02 1x59 n GLY 53 N -0.94 -1.08 0.12 0.83 0.00 -1.14 -4.99 105.19 98.00 1x59 n GLY 53 Ca -0.01 0.14 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 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 0.43 0.00 0.00 1.61 0.13 -1.75 -3.46 132.00 128.96 1x59 h PRO 54 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1x59 h PRO 54 Cb 0.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.31 1x59 h PRO 54 CO 0.04 0.69 0.00 -3.47 -0.23 0.00 0.00 178.00 175.03 1x59 n ASP 55 N -3.45 -2.54 -4.79 1.44 2.03 -1.26 -5.11 116.55 102.86 1x59 n ASP 55 Ca 0.00 0.60 -0.35 0.00 0.52 0.00 0.00 54.79 55.56 1x59 n ASP 55 Cb 0.75 2.53 -0.04 0.00 -0.72 0.00 0.00 41.12 43.64 1x59 n ASP 55 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1x59 s GLU 56 N -1.68 3.90 0.32 -0.67 0.41 -1.26 -5.09 118.70 114.64 1x59 s GLU 56 Ca 0.00 1.42 0.09 0.00 -0.41 0.00 0.00 54.97 56.07 1x59 s GLU 56 Cb 0.00 -2.23 -0.06 0.00 -1.78 0.00 0.00 34.13 30.05 1x59 s GLU 56 CO 0.00 -0.35 -0.10 -1.12 -0.49 0.00 0.00 175.26 173.20 1x59 s SER 57 N -1.84 3.52 -0.86 -0.19 0.01 -1.26 -4.46 113.70 108.62 1x59 s SER 57 Ca 0.64 -1.18 -0.05 0.00 1.31 0.00 0.00 55.95 56.67 1x59 s SER 57 Cb -0.18 -0.31 0.01 0.00 0.21 0.00 0.00 66.02 65.75 1x59 s SER 57 CO 0.23 -0.21 0.59 1.17 0.41 0.00 0.00 173.24 175.43 1x59 n LYS 58 N -0.73 -1.30 -1.69 12.44 4.81 -1.26 -4.87 118.16 125.56 1x59 n LYS 58 Ca -0.05 0.61 -0.42 0.00 -0.87 0.00 0.00 58.31 57.58 1x59 n LYS 58 Cb 0.63 -2.16 -0.03 0.00 0.02 0.00 0.00 35.03 33.49 1x59 n LYS 58 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1x59 s GLN 59 N -5.28 4.14 0.02 1.64 -0.21 -1.26 -4.94 119.66 113.77 1x59 s GLN 59 Ca 0.07 2.60 -0.30 0.00 0.02 0.00 0.00 55.36 57.76 1x59 s GLN 59 Cb -0.04 -3.94 -0.07 0.00 1.00 0.00 0.00 33.01 29.96 1x59 s GLN 59 CO 0.88 -0.91 1.62 0.21 -2.12 0.00 0.00 175.29 174.97 1x59 s LYS 60 N 3.78 4.21 0.09 2.91 2.20 -1.26 -5.00 119.74 126.66 1x59 s LYS 60 Ca 0.85 2.23 -0.01 0.00 -0.36 0.00 0.00 55.97 58.69 1x59 s LYS 60 Cb -0.44 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.12 1x59 s LYS 60 CO 0.39 -0.74 0.00 0.12 -0.36 0.00 0.00 175.35 174.76 1x59 s PHE 61 N 3.05 0.69 0.12 4.03 5.36 -1.26 -5.13 117.98 124.84 1x59 s PHE 61 Ca 0.72 -1.13 -0.31 0.00 -0.96 0.00 0.00 56.93 55.26 1x59 s PHE 61 Cb -0.36 -0.44 -0.08 0.00 -0.34 0.00 0.00 43.02 41.80 1x59 s PHE 61 CO 0.31 -0.42 1.36 0.14 -1.46 0.00 0.00 175.22 175.14 1x59 s VAL 62 N -3.95 3.36 0.38 3.12 -7.23 -1.26 -5.02 120.40 109.81 1x59 s VAL 62 Ca 0.14 1.00 -0.26 0.00 -1.81 0.00 0.00 61.98 61.06 1x59 s VAL 62 Cb 0.08 -3.64 -0.09 0.00 0.56 0.00 0.00 36.38 33.29 1x59 s VAL 62 CO -0.05 0.09 1.15 -0.76 -0.31 0.00 0.00 175.10 175.22 1x59 s LEU 63 N 0.89 4.25 -0.85 1.32 1.02 -1.26 -4.19 118.68 119.86 1x59 s LEU 63 Ca 0.63 2.31 -0.05 0.00 0.02 0.00 0.00 54.13 57.04 1x59 s LEU 63 Cb -0.36 -3.96 0.01 0.00 0.02 0.00 0.00 46.19 41.89 1x59 s LEU 63 CO 0.31 -0.56 0.58 2.29 0.02 0.00 0.00 176.35 179.00 1x59 n LYS 64 N 0.26 -1.29 -1.61 1.70 2.85 -1.26 -4.86 118.16 113.95 1x59 n LYS 64 Ca 0.03 0.61 -0.45 0.00 -1.05 0.00 0.00 58.31 57.45 1x59 n LYS 64 Cb 0.46 -2.13 -0.02 0.00 -0.65 0.00 0.00 35.03 32.69 1x59 n LYS 64 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1x59 n THR 65 N -2.90 1.75 0.88 0.58 5.66 -1.26 -4.88 114.28 114.11 1x59 n THR 65 Ca -0.28 -0.44 0.10 0.00 -3.05 0.00 0.00 64.05 60.38 1x59 n THR 65 Cb 0.65 -1.07 0.49 0.00 -1.55 0.00 0.00 70.33 68.85 1x59 n THR 65 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1x59 n PRO 66 N 0.96 0.17 -2.29 1.09 -0.04 -1.26 -4.56 135.00 129.07 1x59 n PRO 66 Ca 0.10 0.11 -0.35 0.00 -0.04 0.00 0.00 63.50 63.33 1x59 n PRO 66 Cb 0.31 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.23 1x59 n PRO 66 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1x59 s LYS 67 N -2.75 3.02 -0.18 0.54 2.36 -1.26 -4.86 119.74 116.61 1x59 s LYS 67 Ca 0.16 -0.53 -0.04 0.00 -2.55 0.00 0.00 55.97 53.01 1x59 s LYS 67 Cb 0.14 -5.04 0.06 0.00 -1.05 0.00 0.00 37.83 31.94 1x59 s LYS 67 CO 0.34 -2.75 0.06 -1.12 1.55 0.00 0.00 175.35 173.43 1x59 s SER 68 N 6.47 2.55 -0.58 1.43 0.01 -1.26 -5.10 113.70 117.22 1x59 s SER 68 Ca 0.57 -0.68 0.06 0.00 1.31 0.00 0.00 55.95 57.21 1x59 s SER 68 Cb -0.05 -0.40 0.20 0.00 0.21 0.00 0.00 66.02 65.98 1x59 s SER 68 CO -0.01 -0.32 0.54 0.61 0.41 0.00 0.00 173.24 174.47 1x59 n GLY 69 N 5.17 3.69 0.00 3.44 0.00 -1.26 -4.98 105.19 111.25 1x59 n GLY 69 Ca -0.08 -2.23 0.10 0.00 0.00 0.00 0.00 46.02 43.82 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 1.74 0.05 0.00 1.61 -0.04 -1.26 -4.94 135.00 132.16 1x59 n PRO 70 Ca 0.25 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 1x59 n PRO 70 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.47 0.00 0.00 3.54 7.64 -1.26 -3.84 113.62 118.23 1x59 n SER 71 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1x59 n SER 71 Cb 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 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 4.42 0.00 0.00 6.43 2.88 -1.26 -5.33 113.62 120.76 1x59 n SER 72 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x59 n SER 72 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42