#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 0.67 0.00 1.61 0.15 -1.26 -5.00 113.70 109.87 1x59 s SER 2 Ca 0.00 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 55.80 1x59 s SER 2 Cb 0.00 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1x59 s SER 2 CO 0.00 -0.45 0.00 -0.24 1.20 0.00 0.00 173.24 173.75 1x59 n SER 3 N 0.53 0.00 0.00 5.45 2.88 -1.26 -4.94 113.62 116.28 1x59 n SER 3 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1x59 n SER 3 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1x59 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x59 n GLY 4 N 0.00 -1.96 3.76 0.46 0.00 -1.26 -5.07 105.19 101.12 1x59 n GLY 4 Ca 0.00 0.58 -0.39 0.00 0.00 0.00 0.00 46.02 46.20 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 1.31 5.77 -0.51 1.61 0.01 -1.26 -4.99 113.70 115.64 1x59 s SER 5 Ca 0.00 2.83 -0.02 0.00 1.31 0.00 0.00 55.95 60.07 1x59 s SER 5 Cb 0.00 -2.65 0.13 0.00 0.21 0.00 0.00 66.02 63.72 1x59 s SER 5 CO 0.00 -1.24 0.30 -0.94 0.41 0.00 0.00 173.24 171.77 1x59 s SER 6 N -0.68 5.16 -0.27 2.44 1.04 -1.26 -4.91 113.70 115.22 1x59 s SER 6 Ca 0.63 -2.46 -0.29 0.00 0.48 0.00 0.00 55.95 54.31 1x59 s SER 6 Cb -0.42 -1.82 0.00 0.00 0.10 0.00 0.00 66.02 63.89 1x59 s SER 6 CO 0.52 -0.44 1.25 -0.83 0.98 0.00 0.00 173.24 174.73 1x59 s GLY 7 N 1.15 1.47 0.55 7.32 0.00 -1.26 -4.93 107.32 111.62 1x59 s GLY 7 Ca 0.13 0.16 0.23 0.00 0.00 0.00 0.00 44.72 45.24 1x59 s GLY 7 CO -0.04 2.51 2.11 0.00 0.00 0.00 0.00 173.10 177.68 1x59 h MET 8 N 8.83 0.00 0.66 2.90 -0.00 -1.98 0.14 114.93 125.49 1x59 h MET 8 Ca -0.25 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.42 1x59 h MET 8 Cb 1.09 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.70 1x59 h MET 8 CO 1.02 0.00 -0.32 0.00 -0.00 0.00 0.00 176.91 177.61 1x59 h ALA 9 N 1.87 -0.89 -0.05 -3.00 0.00 -2.00 -2.12 119.26 113.06 1x59 h ALA 9 Ca 0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1x59 h ALA 9 Cb 0.40 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1x59 h ALA 9 CO -0.00 -0.98 -0.26 0.93 0.00 0.00 0.00 179.25 178.94 1x59 h GLU 10 N -0.94 0.09 0.32 0.00 5.08 -1.63 -1.73 114.58 115.78 1x59 h GLU 10 Ca -0.09 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1x59 h GLU 10 Cb 0.70 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1x59 h GLU 10 CO 0.15 0.35 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.27 1x59 h ARG 11 N 0.09 -0.41 -0.64 2.33 9.65 -0.74 -0.67 114.38 123.99 1x59 h ARG 11 Ca 0.01 0.03 0.05 0.00 -1.10 0.00 0.00 59.98 58.97 1x59 h ARG 11 Cb 0.51 0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 29.13 1x59 h ARG 11 CO 0.04 -0.25 0.36 0.00 2.80 0.00 0.00 179.97 182.92 1x59 h ALA 12 N 0.22 0.85 -0.04 2.80 0.00 -0.89 0.21 119.26 122.42 1x59 h ALA 12 Ca -0.04 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1x59 h ALA 12 Cb 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1x59 h ALA 12 CO 0.07 0.05 -0.36 0.00 0.00 0.00 0.00 179.25 179.01 1x59 h ALA 13 N 1.33 1.34 0.05 0.00 0.00 -1.17 0.00 119.26 120.81 1x59 h ALA 13 Ca 0.28 -0.34 -0.28 0.00 0.00 0.00 0.00 54.91 54.57 1x59 h ALA 13 Cb 0.15 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.90 1x59 h ALA 13 CO -0.17 0.48 -1.12 -0.07 0.00 0.00 0.00 179.25 178.38 1x59 h LEU 14 N 0.06 0.90 -1.54 0.00 3.38 -0.57 -3.22 115.31 114.33 1x59 h LEU 14 Ca 0.01 -0.77 -0.01 0.00 0.09 0.00 0.00 57.88 57.19 1x59 h LEU 14 Cb 0.66 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1x59 h LEU 14 CO 0.05 1.57 0.15 -0.33 0.09 0.00 0.00 178.44 179.97 1x59 h GLU 15 N 0.35 0.46 -0.25 1.13 4.39 -0.75 -2.96 114.58 116.95 1x59 h GLU 15 Ca -0.15 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.53 1x59 h GLU 15 Cb 1.78 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 30.31 1x59 h GLU 15 CO 0.22 0.37 0.07 1.49 -1.16 0.00 0.00 179.01 180.00 1x59 h GLU 16 N 0.47 0.18 -0.52 2.33 4.81 -1.00 0.18 114.58 121.02 1x59 h GLU 16 Ca 0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1x59 h GLU 16 Cb 0.06 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1x59 h GLU 16 CO -0.02 0.12 0.34 -0.07 -0.73 0.00 0.00 179.01 178.65 1x59 h LEU 17 N 0.18 0.60 0.34 1.64 3.38 -1.62 0.14 115.31 119.97 1x59 h LEU 17 Ca 0.11 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1x59 h LEU 17 Cb 0.09 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1x59 h LEU 17 CO -0.12 0.44 -0.17 0.58 0.09 0.00 0.00 178.44 179.25 1x59 h VAL 18 N 0.71 0.64 0.63 1.22 2.07 -1.33 -0.67 116.25 119.51 1x59 h VAL 18 Ca 0.19 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.69 1x59 h VAL 18 Cb -0.08 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1x59 h VAL 18 CO -0.04 0.00 -0.49 0.50 0.02 0.00 0.00 177.57 177.56 1x59 h LYS 19 N -0.47 -1.04 -0.58 1.57 3.64 -0.34 -0.73 116.57 118.61 1x59 h LYS 19 Ca -0.04 0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1x59 h LYS 19 Cb 0.37 0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 1x59 h LYS 19 CO 0.07 -0.69 0.23 -0.07 -2.27 0.00 0.00 179.45 176.71 1x59 h LEU 20 N -1.08 0.77 0.10 5.20 -0.00 -1.02 0.11 115.31 119.38 1x59 h LEU 20 Ca -0.08 -0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 57.70 1x59 h LEU 20 Cb 0.90 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 41.36 1x59 h LEU 20 CO 0.02 0.70 -0.06 -0.61 -0.00 0.00 0.00 178.44 178.49 1x59 h GLN 21 N 0.83 -0.14 -0.38 1.13 5.75 -0.88 0.15 115.11 121.57 1x59 h GLN 21 Ca 0.20 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.68 1x59 h GLN 21 Cb 0.17 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 1x59 h GLN 21 CO -0.02 -0.10 0.12 0.78 -2.65 0.00 0.00 178.83 176.97 1x59 h GLY 22 N -0.15 0.64 2.00 2.39 0.00 -0.52 0.29 103.07 107.72 1x59 h GLY 22 Ca -0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1x59 h GLY 22 CO 0.01 0.36 -0.10 0.83 0.00 0.00 0.00 176.54 177.64 1x59 h GLU 23 N 0.47 0.00 -0.09 4.80 4.39 -0.71 -0.88 114.58 122.57 1x59 h GLU 23 Ca 0.12 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.60 1x59 h GLU 23 Cb 0.25 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.92 1x59 h GLU 23 CO -0.00 0.10 -0.81 -0.09 -1.16 0.00 0.00 179.01 177.04 1x59 h ARG 24 N 0.00 0.70 -0.21 2.33 2.43 -0.29 -2.90 114.38 116.45 1x59 h ARG 24 Ca -0.00 -0.64 0.01 0.00 -0.81 0.00 0.00 59.98 58.54 1x59 h ARG 24 Cb 0.18 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1x59 h ARG 24 CO 0.01 1.24 0.12 0.28 -1.51 0.00 0.00 179.97 180.12 1x59 h VAL 25 N 0.39 1.03 -0.80 0.20 2.07 0.24 0.33 116.25 119.70 1x59 h VAL 25 Ca -0.08 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1x59 h VAL 25 Cb 1.46 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1x59 h VAL 25 CO 0.16 0.05 0.53 0.03 0.02 0.00 0.00 177.57 178.36 1x59 h ARG 26 N 0.26 1.03 -0.26 1.57 3.08 -1.31 -0.46 114.38 118.29 1x59 h ARG 26 Ca 0.08 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.08 1x59 h ARG 26 Cb -0.01 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 1x59 h ARG 26 CO -0.04 0.68 0.14 0.78 -1.07 0.00 0.00 179.97 180.46 1x59 h GLY 27 N 1.06 0.35 0.99 0.04 0.00 -1.17 -1.78 103.07 102.56 1x59 h GLY 27 Ca 0.30 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 1x59 h GLY 27 CO -0.08 0.09 0.02 1.41 0.00 0.00 0.00 176.54 177.98 1x59 h LEU 28 N 0.29 0.80 -0.83 3.11 3.38 0.40 0.17 115.31 122.62 1x59 h LEU 28 Ca 0.11 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.82 1x59 h LEU 28 Cb 0.02 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1x59 h LEU 28 CO -0.06 0.90 0.53 0.11 0.09 0.00 0.00 178.44 180.00 1x59 h LYS 29 N 0.67 0.97 -0.48 1.13 1.57 -1.10 -0.43 116.57 118.90 1x59 h LYS 29 Ca 0.14 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 1x59 h LYS 29 Cb 0.47 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1x59 h LYS 29 CO 0.02 0.64 -0.00 0.37 -0.57 0.00 0.00 179.45 179.91 1x59 h GLN 30 N 1.00 0.85 0.00 3.15 4.15 -0.68 -2.58 115.11 121.01 1x59 h GLN 30 Ca 0.34 -0.27 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1x59 h GLN 30 Cb 0.06 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1x59 h GLN 30 CO -0.13 0.89 0.00 1.04 -1.93 0.00 0.00 178.83 178.70 1x59 n GLN 31 N -4.34 0.38 -3.97 1.69 1.13 0.55 -4.85 117.38 107.96 1x59 n GLN 31 Ca 0.01 0.03 -0.32 0.00 -1.94 0.00 0.00 57.00 54.77 1x59 n GLN 31 Cb 0.31 -1.50 0.01 0.00 0.11 0.00 0.00 30.24 29.17 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 -1.04 -4.65 -0.58 -1.09 5.02 -0.82 -4.95 118.16 110.06 1x59 n LYS 32 Ca 0.09 0.52 -0.30 0.00 -2.02 0.00 0.00 58.31 56.61 1x59 n LYS 32 Cb 0.05 -5.36 0.21 0.00 -0.02 0.00 0.00 35.03 29.92 1x59 n LYS 32 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x59 n ALA 33 N -4.51 -2.22 -1.69 7.82 0.00 -0.24 -4.90 120.51 114.76 1x59 n ALA 33 Ca 0.05 -0.94 -0.44 0.00 0.00 0.00 0.00 53.44 52.12 1x59 n ALA 33 Cb 0.51 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 1x59 n ALA 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x59 n SER 34 N -4.31 3.46 -0.16 0.00 7.64 -1.26 -4.88 113.62 114.11 1x59 n SER 34 Ca 0.06 1.09 0.14 0.00 1.01 0.00 0.00 58.87 61.17 1x59 n SER 34 Cb 0.54 -1.50 0.49 0.00 -1.01 0.00 0.00 64.21 62.73 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 5.95 2.06 0.64 -0.43 0.00 -1.99 -1.92 119.26 123.57 1x59 h ALA 35 Ca -0.44 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1x59 h ALA 35 Cb 1.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1x59 h ALA 35 CO 0.89 -0.25 -0.43 1.49 0.00 0.00 0.00 179.25 180.95 1x59 h GLU 36 N 0.46 -0.99 -1.01 0.00 4.57 -1.99 -1.13 114.58 114.49 1x59 h GLU 36 Ca 0.36 0.07 0.08 0.00 -1.18 0.00 0.00 59.36 58.69 1x59 h GLU 36 Cb 0.77 0.22 -0.07 0.00 -0.16 0.00 0.00 28.75 29.51 1x59 h GLU 36 CO -0.12 -0.66 0.65 1.25 -1.18 0.00 0.00 179.01 178.95 1x59 h LEU 37 N -1.02 1.02 -0.20 1.64 5.85 -1.77 0.87 115.31 121.69 1x59 h LEU 37 Ca -0.08 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1x59 h LEU 37 Cb 0.84 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1x59 h LEU 37 CO 0.06 0.62 0.05 0.40 -0.34 0.00 0.00 178.44 179.23 1x59 h ILE 38 N 1.14 1.21 0.00 4.05 2.04 -1.19 0.43 117.51 125.18 1x59 h ILE 38 Ca 0.45 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 1x59 h ILE 38 Cb 0.25 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1x59 h ILE 38 CO -0.20 0.21 -0.34 -0.33 0.00 0.00 0.00 178.15 177.49 1x59 h GLU 39 N 0.13 0.00 0.37 2.37 4.39 -0.39 0.75 114.58 122.21 1x59 h GLU 39 Ca 0.06 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1x59 h GLU 39 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1x59 h GLU 39 CO 0.00 0.34 -0.18 0.93 -1.16 0.00 0.00 179.01 178.94 1x59 h GLU 40 N 0.00 -0.48 -0.05 2.33 5.08 -0.69 -2.13 114.58 118.64 1x59 h GLU 40 Ca -0.00 0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1x59 h GLU 40 Cb 0.70 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1x59 h GLU 40 CO 0.04 -0.29 -0.51 0.93 -1.00 0.00 0.00 179.01 178.19 1x59 h GLU 41 N -0.56 0.12 -0.21 2.33 4.39 -0.34 0.84 114.58 121.15 1x59 h GLU 41 Ca -0.05 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 1x59 h GLU 41 Cb 0.42 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1x59 h GLU 41 CO 0.08 0.60 -0.09 0.28 -1.16 0.00 0.00 179.01 178.73 1x59 h VAL 42 N 0.10 1.30 -0.43 3.13 2.07 -0.95 0.85 116.25 122.32 1x59 h VAL 42 Ca 0.00 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.40 1x59 h VAL 42 Cb 0.93 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1x59 h VAL 42 CO 0.07 0.34 0.28 0.00 0.02 0.00 0.00 177.57 178.29 1x59 h ALA 43 N 0.72 0.54 0.13 1.67 0.00 -0.92 0.60 119.26 122.00 1x59 h ALA 43 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1x59 h ALA 43 Cb 0.57 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1x59 h ALA 43 CO 0.03 -0.02 -0.25 0.87 0.00 0.00 0.00 179.25 179.88 1x59 h LYS 44 N 0.57 -0.45 -0.76 0.00 1.57 -0.82 -0.49 116.57 116.20 1x59 h LYS 44 Ca 0.16 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.06 1x59 h LYS 44 Cb -0.06 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.28 1x59 h LYS 44 CO -0.04 -0.30 0.40 1.25 -0.57 0.00 0.00 179.45 180.20 1x59 h LEU 45 N -0.46 0.55 0.54 2.94 5.85 -0.40 0.58 115.31 124.91 1x59 h LEU 45 Ca 0.03 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1x59 h LEU 45 Cb 0.48 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1x59 h LEU 45 CO -0.13 0.31 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.93 1x59 h LEU 46 N 0.68 -0.66 -1.61 2.25 3.38 -0.59 -0.70 115.31 118.06 1x59 h LEU 46 Ca 0.37 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.35 1x59 h LEU 46 Cb 0.38 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1x59 h LEU 46 CO -0.26 -0.45 0.03 0.07 0.09 0.00 0.00 178.44 177.92 1x59 h LYS 47 N -0.74 0.28 0.14 1.13 2.10 -0.89 -0.88 116.57 117.71 1x59 h LYS 47 Ca -0.07 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.53 1x59 h LYS 47 Cb 0.58 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 1x59 h LYS 47 CO 0.11 0.28 -0.07 -0.07 -2.00 0.00 0.00 179.45 177.70 1x59 h LEU 48 N 0.28 -0.16 -2.40 7.07 3.38 -0.89 -2.96 115.31 119.63 1x59 h LEU 48 Ca 0.07 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1x59 h LEU 48 Cb 0.14 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1x59 h LEU 48 CO -0.00 -0.03 -0.01 0.11 0.09 0.00 0.00 178.44 178.60 1x59 h LYS 49 N -0.29 0.00 -0.86 1.13 1.57 0.21 -2.53 116.57 115.80 1x59 h LYS 49 Ca -0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1x59 h LYS 49 Cb 0.23 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1x59 h LYS 49 CO 0.03 0.01 0.46 0.00 -0.57 0.00 0.00 179.45 179.39 1x59 h ALA 50 N 1.99 1.11 -0.71 3.86 0.00 -1.13 -2.99 119.26 121.39 1x59 h ALA 50 Ca -0.00 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1x59 h ALA 50 Cb 0.03 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.42 1x59 h ALA 50 CO 0.00 0.63 0.41 1.96 0.00 0.00 0.00 179.25 182.25 1x59 h GLN 51 N 1.21 0.74 0.00 0.00 4.20 -1.53 -1.90 115.11 117.84 1x59 h GLN 51 Ca 0.30 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1x59 h GLN 51 Cb 0.05 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.66 1x59 h GLN 51 CO -0.05 0.49 0.00 1.28 -0.67 0.00 0.00 178.83 179.89 1x59 n LEU 52 N -4.74 0.02 -0.33 1.46 7.99 -1.13 -4.91 117.00 115.37 1x59 n LEU 52 Ca 0.09 0.51 0.00 0.00 -0.01 0.00 0.00 56.01 56.60 1x59 n LEU 52 Cb 0.16 -0.51 0.00 0.00 -0.11 0.00 0.00 43.42 42.97 1x59 n LEU 52 CO 0.30 -0.39 0.00 0.61 -1.51 0.00 0.00 177.39 176.40 1x59 n GLY 53 N -0.77 -0.53 3.75 -0.72 0.00 -0.71 -5.03 105.19 101.18 1x59 n GLY 53 Ca 0.02 -0.71 -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 -0.17 4.38 0.74 1.61 0.04 -1.26 -5.00 135.00 135.33 1x59 s PRO 54 Ca 0.00 2.14 -0.14 0.00 0.04 0.00 0.00 61.00 63.05 1x59 s PRO 54 Cb 0.00 -3.13 0.04 0.00 0.04 0.00 0.00 34.50 31.46 1x59 s PRO 54 CO 0.00 -0.21 1.15 -0.51 0.04 0.00 0.00 177.00 177.47 1x59 s ASP 55 N -0.13 4.37 -0.42 6.66 1.01 -1.26 -5.00 116.67 121.90 1x59 s ASP 55 Ca 0.53 2.13 0.02 0.00 0.71 0.00 0.00 52.55 55.93 1x59 s ASP 55 Cb -0.38 -2.56 0.15 0.00 1.01 0.00 0.00 42.92 41.13 1x59 s ASP 55 CO 0.46 -2.14 0.27 -1.83 0.21 0.00 0.00 175.17 172.14 1x59 s GLU 56 N -4.24 1.00 0.00 8.23 -1.05 -1.26 -4.92 118.70 116.46 1x59 s GLU 56 Ca 0.69 -1.86 0.00 0.00 -0.15 0.00 0.00 54.97 53.64 1x59 s GLU 56 Cb -0.23 -1.81 0.00 0.00 -0.44 0.00 0.00 34.13 31.64 1x59 s GLU 56 CO 0.47 -1.24 0.00 -1.13 0.95 0.00 0.00 175.26 174.32 1x59 n SER 57 N 3.47 0.00 -4.65 0.83 3.41 -1.26 -4.90 113.62 110.52 1x59 n SER 57 Ca 0.15 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.34 1x59 n SER 57 Cb 0.38 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.31 1x59 n SER 57 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1x59 s LYS 58 N 0.00 4.07 -0.73 4.33 2.36 -1.26 -3.29 119.74 125.22 1x59 s LYS 58 Ca 0.00 2.25 -0.08 0.00 -2.55 0.00 0.00 55.97 55.59 1x59 s LYS 58 Cb 0.00 -4.07 0.01 0.00 -1.05 0.00 0.00 37.83 32.73 1x59 s LYS 58 CO 0.00 -1.00 0.48 1.04 1.55 0.00 0.00 175.35 177.43 1x59 n GLN 59 N 7.40 -0.95 -2.26 4.03 6.02 -1.26 -4.99 117.38 125.37 1x59 n GLN 59 Ca 0.19 0.37 -0.30 0.00 -0.01 0.00 0.00 57.00 57.25 1x59 n GLN 59 Cb 0.43 -1.69 -0.00 0.00 1.02 0.00 0.00 30.24 29.99 1x59 n GLN 59 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1x59 s LYS 60 N -5.11 3.65 -0.29 -1.09 -2.85 -1.21 -5.08 119.74 107.76 1x59 s LYS 60 Ca 0.12 0.59 0.04 0.00 -1.00 0.00 0.00 55.97 55.72 1x59 s LYS 60 Cb -0.07 -2.20 0.18 0.00 -2.06 0.00 0.00 37.83 33.68 1x59 s LYS 60 CO 0.71 -0.37 0.51 0.12 0.10 0.00 0.00 175.35 176.42 1x59 s PHE 61 N -2.90 -1.48 -0.01 1.78 2.19 -1.26 -5.05 117.98 111.25 1x59 s PHE 61 Ca 0.53 0.78 -0.01 0.00 0.33 0.00 0.00 56.93 58.56 1x59 s PHE 61 Cb -0.11 0.12 0.00 0.00 -1.31 0.00 0.00 43.02 41.73 1x59 s PHE 61 CO 0.46 -1.03 0.03 0.14 1.83 0.00 0.00 175.22 176.65 1x59 s VAL 62 N 2.71 -0.00 0.00 3.12 -7.23 -1.26 -5.10 120.40 112.63 1x59 s VAL 62 Ca 0.10 0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 1x59 s VAL 62 Cb -0.11 -0.05 0.00 0.00 0.56 0.00 0.00 36.38 36.78 1x59 s VAL 62 CO -0.27 0.01 0.00 -0.11 -0.31 0.00 0.00 175.10 174.41 1x59 n LEU 63 N 3.15 0.00 -3.42 1.32 7.94 -1.26 -5.07 117.00 119.66 1x59 n LEU 63 Ca -0.13 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.50 1x59 n LEU 63 Cb 0.59 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.44 1x59 n LEU 63 CO 0.25 0.00 -0.31 -0.54 -1.11 0.00 0.00 177.39 175.68 1x59 s LYS 64 N 0.35 0.95 -0.30 1.96 1.02 -1.26 -5.07 119.74 117.38 1x59 s LYS 64 Ca 0.00 -2.11 -0.02 0.00 0.02 0.00 0.00 55.97 53.86 1x59 s LYS 64 Cb 0.00 -1.49 0.12 0.00 -0.52 0.00 0.00 37.83 35.93 1x59 s LYS 64 CO 0.00 -1.37 0.18 0.95 -0.92 0.00 0.00 175.35 174.19 1x59 s THR 65 N 0.07 -0.11 0.39 2.17 -4.23 -1.26 -4.98 115.64 107.69 1x59 s THR 65 Ca 0.32 -0.89 0.10 0.00 -1.18 0.00 0.00 61.69 60.04 1x59 s THR 65 Cb 0.02 -0.99 0.14 0.00 1.34 0.00 0.00 72.50 73.01 1x59 s THR 65 CO -0.18 -0.72 1.90 1.55 -0.54 0.00 0.00 174.62 176.62 1x59 h PRO 66 N 8.08 0.17 -6.93 3.99 0.13 -1.97 -3.47 132.00 132.00 1x59 h PRO 66 Ca -0.13 -0.04 -0.59 0.00 -0.87 0.00 0.00 66.00 64.37 1x59 h PRO 66 Cb 1.02 -0.02 -0.20 0.00 0.13 0.00 0.00 31.00 31.92 1x59 h PRO 66 CO 0.38 0.36 -0.92 1.17 -0.23 0.00 0.00 178.00 178.76 1x59 n LYS 67 N -4.24 -1.72 -3.95 0.86 4.81 -1.26 -4.95 118.16 107.71 1x59 n LYS 67 Ca -0.01 0.21 -0.09 0.00 -0.87 0.00 0.00 58.31 57.55 1x59 n LYS 67 Cb 0.30 -4.18 -0.09 0.00 0.02 0.00 0.00 35.03 31.08 1x59 n LYS 67 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1x59 s SER 68 N -4.06 0.24 -0.29 3.14 0.15 -1.26 -5.13 113.70 106.49 1x59 s SER 68 Ca 0.23 -0.70 0.02 0.00 0.70 0.00 0.00 55.95 56.20 1x59 s SER 68 Cb -0.13 0.26 0.18 0.00 -1.71 0.00 0.00 66.02 64.62 1x59 s SER 68 CO 0.97 -0.61 0.52 -0.83 1.20 0.00 0.00 173.24 174.49 1x59 s GLY 69 N -2.60 -0.93 -0.06 9.45 0.00 -1.26 -5.07 107.32 106.84 1x59 s GLY 69 Ca 0.02 1.03 -0.16 0.00 0.00 0.00 0.00 44.72 45.60 1x59 s GLY 69 CO -0.08 3.34 0.66 -0.56 0.00 0.00 0.00 173.10 176.45 1x59 h PRO 70 N 8.06 -0.25 0.00 2.90 0.13 -2.02 -3.48 132.00 137.34 1x59 h PRO 70 Ca -0.10 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1x59 h PRO 70 Cb 1.16 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1x59 h PRO 70 CO 0.22 0.07 0.00 0.45 -0.23 0.00 0.00 178.00 178.51 1x59 n SER 71 N -4.94 0.00 -0.55 1.44 2.88 -1.26 -5.05 113.62 106.14 1x59 n SER 71 Ca -0.06 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.40 1x59 n SER 71 Cb 0.22 0.36 -0.03 0.00 -0.75 0.00 0.00 64.21 64.01 1x59 n SER 71 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x59 n SER 72 N -2.35 -4.87 -0.26 -3.46 7.64 -1.26 -5.28 113.62 103.77 1x59 n SER 72 Ca 0.00 0.18 0.03 0.00 1.01 0.00 0.00 58.87 60.09 1x59 n SER 72 Cb 0.00 -3.01 0.03 0.00 -1.01 0.00 0.00 64.21 60.22 1x59 n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64