#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pra h ILE 2 N 0.00 0.57 -0.22 0.44 5.03 -1.91 -1.22 117.51 120.19 1pra h ILE 2 Ca 0.00 -0.08 0.04 0.00 -0.12 0.00 0.00 64.86 64.70 1pra h ILE 2 Cb 0.00 0.30 -0.07 0.00 -3.03 0.00 0.00 36.82 34.02 1pra h ILE 2 CO 0.00 0.04 -0.50 -1.28 -0.68 0.00 0.00 178.15 175.73 1pra h SER 3 N 0.24 -1.62 -0.36 1.72 0.87 -1.79 0.10 113.55 112.70 1pra h SER 3 Ca 0.51 0.21 -0.13 0.00 -1.23 0.00 0.00 61.79 61.14 1pra h SER 3 Cb 1.55 0.65 -0.01 0.00 -0.44 0.00 0.00 62.40 64.16 1pra h SER 3 CO -0.14 -0.45 -0.29 0.28 -0.53 0.00 0.00 176.83 175.70 1pra h SER 4 N -0.50 0.89 0.41 6.23 0.02 -1.60 0.13 113.55 119.14 1pra h SER 4 Ca 0.06 -0.45 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1pra h SER 4 Cb 0.65 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 1pra h SER 4 CO -0.48 1.15 -0.38 0.03 -1.14 0.00 0.00 176.83 176.01 1pra h ARG 5 N 0.64 -0.78 0.66 3.45 3.08 -1.17 0.12 114.38 120.37 1pra h ARG 5 Ca 0.07 0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 1pra h ARG 5 Cb 0.87 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 1pra h ARG 5 CO 0.08 -0.52 -0.41 0.28 -1.07 0.00 0.00 179.97 178.33 1pra h VAL 6 N -0.81 0.17 -0.32 2.04 2.07 -0.76 -1.98 116.25 116.66 1pra h VAL 6 Ca -0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1pra h VAL 6 Cb 0.71 0.17 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1pra h VAL 6 CO -0.04 0.00 -0.53 0.50 0.02 0.00 0.00 177.57 177.51 1pra h LYS 7 N -1.01 -0.42 -0.33 1.57 3.64 -0.69 0.27 116.57 119.60 1pra h LYS 7 Ca -0.08 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1pra h LYS 7 Cb 0.81 0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.65 1pra h LYS 7 CO 0.08 -0.28 -0.29 1.03 -2.27 0.00 0.00 179.45 177.72 1pra h SER 8 N -0.43 -0.96 -0.66 4.20 0.87 -0.72 0.54 113.55 116.40 1pra h SER 8 Ca 0.06 0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.76 1pra h SER 8 Cb 0.59 0.45 -0.03 0.00 -0.44 0.00 0.00 62.40 62.97 1pra h SER 8 CO -0.53 -0.31 0.31 0.50 -0.53 0.00 0.00 176.83 176.27 1pra h LYS 9 N -0.26 0.98 -0.23 2.24 1.63 -0.81 -0.87 116.57 119.25 1pra h LYS 9 Ca 0.16 -0.14 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 1pra h LYS 9 Cb 0.51 -0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 31.92 1pra h LYS 9 CO -0.48 0.76 -0.05 -0.09 -3.45 0.00 0.00 179.45 176.15 1pra h ARG 10 N 0.97 0.01 0.23 1.90 2.43 0.14 0.24 114.38 120.31 1pra h ARG 10 Ca 0.24 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1pra h ARG 10 Cb 0.12 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1pra h ARG 10 CO -0.03 0.01 -0.23 0.82 -1.51 0.00 0.00 179.97 179.03 1pra h ILE 11 N 0.01 0.51 -0.74 1.20 5.03 -0.44 0.23 117.51 123.30 1pra h ILE 11 Ca 0.11 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.94 1pra h ILE 11 Cb 0.16 0.51 -0.05 0.00 -3.03 0.00 0.00 36.82 34.41 1pra h ILE 11 CO -0.23 0.00 0.49 -0.61 -0.68 0.00 0.00 178.15 177.12 1pra h GLN 12 N -0.49 0.65 0.00 2.37 4.15 -0.57 0.24 115.11 121.46 1pra h GLN 12 Ca -0.00 -0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.27 1pra h GLN 12 Cb 0.46 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 1pra h GLN 12 CO -0.05 0.43 -0.50 -0.07 -1.93 0.00 0.00 178.83 176.71 1pra h LEU 13 N 0.67 0.00 0.81 -2.39 -0.00 -0.26 -3.48 115.31 110.66 1pra h LEU 13 Ca 0.34 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 58.09 1pra h LEU 13 Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.08 1pra h LEU 13 CO -0.12 0.50 -0.15 0.61 -0.00 0.00 0.00 178.44 179.28 1pra n GLY 14 N 0.33 0.22 3.84 0.83 0.00 0.84 -5.05 105.19 106.20 1pra n GLY 14 Ca -0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 45.10 1pra n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pra s LEU 15 N -1.75 2.73 0.40 0.99 1.43 -0.86 -5.02 118.68 116.61 1pra s LEU 15 Ca 0.00 -1.27 0.07 0.00 -1.03 0.00 0.00 54.13 51.90 1pra s LEU 15 Cb 0.00 -1.19 -0.08 0.00 0.03 0.00 0.00 46.19 44.96 1pra s LEU 15 CO 0.00 -0.92 0.01 0.54 0.23 0.00 0.00 176.35 176.21 1pra s ASN 16 N -4.11 3.77 0.42 2.29 2.20 -1.26 -4.56 114.94 113.69 1pra s ASN 16 Ca 0.30 -1.36 0.14 0.00 -0.94 0.00 0.00 52.86 51.00 1pra s ASN 16 Cb -0.00 -0.38 0.92 0.00 -2.00 0.00 0.00 41.25 39.79 1pra s ASN 16 CO 0.18 -0.44 1.94 1.56 -2.94 0.00 0.00 177.10 177.40 1pra h GLN 17 N 1.81 0.00 0.12 3.55 4.20 -1.99 0.29 115.11 123.09 1pra h GLN 17 Ca -0.44 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.27 1pra h GLN 17 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 1pra h GLN 17 CO 0.80 0.24 -0.06 0.00 -0.67 0.00 0.00 178.83 179.14 1pra h ALA 18 N 1.76 -0.16 -0.36 3.87 0.00 -1.97 0.81 119.26 123.21 1pra h ALA 18 Ca -0.00 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.76 1pra h ALA 18 Cb 0.43 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1pra h ALA 18 CO 0.03 -0.35 -0.04 0.93 0.00 0.00 0.00 179.25 179.82 1pra h GLU 19 N -0.64 0.05 -0.27 0.00 5.08 -1.93 0.03 114.58 116.91 1pra h GLU 19 Ca -0.02 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1pra h GLU 19 Cb 0.49 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 1pra h GLU 19 CO 0.03 0.03 -0.01 1.25 -1.00 0.00 0.00 179.01 179.31 1pra h LEU 20 N 0.05 -0.13 -0.56 1.33 5.85 -0.88 0.16 115.31 121.13 1pra h LEU 20 Ca 0.17 0.06 0.10 0.00 0.84 0.00 0.00 57.88 59.05 1pra h LEU 20 Cb 0.26 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.32 1pra h LEU 20 CO -0.33 -0.03 0.13 0.00 -0.34 0.00 0.00 178.44 177.87 1pra h ALA 21 N 1.23 0.66 -0.43 1.25 0.00 -0.33 0.84 119.26 122.47 1pra h ALA 21 Ca 0.13 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1pra h ALA 21 Cb 0.17 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1pra h ALA 21 CO -0.22 -0.29 0.22 1.96 0.00 0.00 0.00 179.25 180.92 1pra h GLN 22 N 0.27 0.44 -0.48 0.00 1.08 -0.04 0.38 115.11 116.76 1pra h GLN 22 Ca 0.29 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.43 1pra h GLN 22 Cb 0.40 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.70 1pra h GLN 22 CO -0.36 0.29 0.18 0.87 -0.95 0.00 0.00 178.83 178.87 1pra h LYS 23 N 0.45 0.68 -0.07 1.46 1.79 0.34 -0.62 116.57 120.61 1pra h LYS 23 Ca 0.18 -0.10 -0.14 0.00 -2.18 0.00 0.00 60.65 58.42 1pra h LYS 23 Cb 0.08 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 1pra h LYS 23 CO -0.12 0.57 -0.57 0.28 -1.08 0.00 0.00 179.45 178.53 1pra h VAL 24 N 0.68 1.38 -0.65 0.50 2.07 -0.43 -3.47 116.25 116.33 1pra h VAL 24 Ca 0.16 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1pra h VAL 24 Cb 0.15 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1pra h VAL 24 CO -0.01 0.57 0.00 0.61 0.02 0.00 0.00 177.57 178.75 1pra n GLY 25 N 0.19 0.92 0.00 2.17 0.00 0.11 -4.97 105.19 103.62 1pra n GLY 25 Ca -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1pra n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1pra n THR 26 N -2.21 0.00 -4.30 2.61 5.66 -0.11 -5.01 114.28 110.92 1pra n THR 26 Ca 0.00 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.71 1pra n THR 26 Cb 0.39 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.07 1pra n THR 26 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1pra s THR 27 N 0.43 2.96 0.36 1.09 -4.23 -1.26 -4.05 115.64 110.93 1pra s THR 27 Ca 0.00 -1.56 0.17 0.00 -1.18 0.00 0.00 61.69 59.11 1pra s THR 27 Cb 0.00 -2.39 0.36 0.00 1.34 0.00 0.00 72.50 71.80 1pra s THR 27 CO 0.00 0.03 1.68 -0.61 -0.54 0.00 0.00 174.62 175.18 1pra h GLN 28 N 3.45 0.33 -0.84 3.99 4.15 -1.87 0.21 115.11 124.53 1pra h GLN 28 Ca -0.49 -0.02 0.21 0.00 0.77 0.00 0.00 58.65 59.13 1pra h GLN 28 Cb 1.18 -0.07 -0.13 0.00 0.21 0.00 0.00 27.48 28.66 1pra h GLN 28 CO 0.49 0.22 0.22 0.37 -1.93 0.00 0.00 178.83 178.19 1pra h GLN 29 N 0.34 0.22 -0.56 1.69 5.75 -1.95 0.25 115.11 120.84 1pra h GLN 29 Ca 0.72 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 59.10 1pra h GLN 29 Cb 1.71 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 30.20 1pra h GLN 29 CO -0.52 0.15 -0.06 0.77 -2.65 0.00 0.00 178.83 176.51 1pra h SER 30 N 0.23 1.02 0.17 -0.69 0.02 -1.36 -0.53 113.55 112.41 1pra h SER 30 Ca 0.51 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1pra h SER 30 Cb 0.99 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1pra h SER 30 CO -0.62 1.10 -0.08 0.40 -1.14 0.00 0.00 176.83 176.49 1pra h ILE 31 N 0.93 0.93 -0.67 3.27 1.08 -0.94 -0.72 117.51 121.39 1pra h ILE 31 Ca 0.15 -0.47 0.14 0.00 -0.39 0.00 0.00 64.86 64.29 1pra h ILE 31 Cb 0.62 1.21 -0.12 0.00 -3.07 0.00 0.00 36.82 35.46 1pra h ILE 31 CO 0.04 0.11 -0.08 -0.08 -0.69 0.00 0.00 178.15 177.45 1pra h GLU 32 N -0.46 0.05 -0.05 2.37 4.57 -0.55 0.22 114.58 120.74 1pra h GLU 32 Ca -0.02 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1pra h GLU 32 Cb 0.35 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.89 1pra h GLU 32 CO 0.04 0.03 -0.23 0.37 -1.18 0.00 0.00 179.01 178.05 1pra h GLN 33 N 0.05 -0.32 -0.61 1.92 4.15 -0.78 0.30 115.11 119.83 1pra h GLN 33 Ca 0.34 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.79 1pra h GLN 33 Cb 0.55 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.28 1pra h GLN 33 CO -0.63 -0.21 0.40 1.25 -1.93 0.00 0.00 178.83 177.71 1pra h LEU 34 N -0.33 0.69 -1.69 -2.39 5.85 0.46 -2.31 115.31 115.60 1pra h LEU 34 Ca 0.08 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1pra h LEU 34 Cb 0.44 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1pra h LEU 34 CO -0.24 0.50 -0.17 -0.33 -0.34 0.00 0.00 178.44 177.86 1pra h GLU 35 N 0.82 0.00 0.00 1.25 3.07 -0.35 0.23 114.58 119.60 1pra h GLU 35 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1pra h GLU 35 Cb -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 1pra h GLU 35 CO -0.05 0.17 0.00 0.09 -1.40 0.00 0.00 179.01 177.82 1pra n ASN 36 N -3.70 0.00 -2.27 1.42 3.02 0.10 -4.09 115.26 109.75 1pra n ASN 36 Ca -0.02 0.35 -0.18 0.00 -0.03 0.00 0.00 54.58 54.70 1pra n ASN 36 Cb 0.29 -0.43 0.01 0.00 -0.61 0.00 0.00 39.78 39.04 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pra n GLY 37 N 0.15 -0.35 0.75 7.41 0.00 0.80 -4.89 105.19 109.06 1pra n GLY 37 Ca 0.05 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1pra n GLY 37 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pra n LYS 38 N -3.07 1.83 -4.74 1.61 2.85 -1.24 -4.88 118.16 110.52 1pra n LYS 38 Ca -0.16 -1.50 -0.30 0.00 -1.05 0.00 0.00 58.31 55.29 1pra n LYS 38 Cb 0.63 -1.47 -0.17 0.00 -0.65 0.00 0.00 35.03 33.38 1pra n LYS 38 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1pra s THR 39 N -2.21 1.79 0.02 0.58 2.01 -1.26 -5.03 115.64 111.54 1pra s THR 39 Ca 0.24 -0.84 -0.18 0.00 0.31 0.00 0.00 61.69 61.23 1pra s THR 39 Cb 0.19 -1.59 -0.30 0.00 0.01 0.00 0.00 72.50 70.81 1pra s THR 39 CO 0.42 0.50 1.03 0.07 -0.69 0.00 0.00 174.62 175.95 1pra h LYS 40 N 7.16 0.50 -1.86 4.92 2.10 -1.99 -3.44 116.57 123.96 1pra h LYS 40 Ca -0.28 -0.71 -0.37 0.00 -2.00 0.00 0.00 60.65 57.29 1pra h LYS 40 Cb 1.20 0.24 -0.30 0.00 -0.90 0.00 0.00 32.23 32.47 1pra h LYS 40 CO 0.50 1.31 -0.70 0.50 -2.00 0.00 0.00 179.45 179.07 1pra s ARG 41 N -2.82 0.75 0.96 0.07 3.52 -1.26 -4.96 118.95 115.22 1pra s ARG 41 Ca -0.11 -1.09 -0.12 0.00 -0.13 0.00 0.00 55.73 54.28 1pra s ARG 41 Cb 0.04 -0.73 0.17 0.00 -1.56 0.00 0.00 34.95 32.87 1pra s ARG 41 CO 0.89 -1.25 1.10 -1.25 -0.81 0.00 0.00 175.30 173.99 1pra s PRO 42 N 1.13 0.72 0.17 5.12 0.04 -1.26 -4.97 135.00 135.94 1pra s PRO 42 Ca 0.21 0.50 -0.10 0.00 0.04 0.00 0.00 61.00 61.66 1pra s PRO 42 Cb -0.10 -1.77 0.02 0.00 0.04 0.00 0.00 34.50 32.69 1pra s PRO 42 CO -0.06 -2.53 1.56 -0.09 0.04 0.00 0.00 177.00 175.92 1pra h ARG 43 N -1.75 1.00 -0.83 4.56 1.12 -2.03 -3.07 114.38 113.38 1pra h ARG 43 Ca -0.53 -0.42 -0.02 0.00 -1.11 0.00 0.00 59.98 57.90 1pra h ARG 43 Cb 1.32 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.23 1pra h ARG 43 CO 0.58 1.10 0.03 1.97 -3.11 0.00 0.00 179.97 180.54 1pra n PHE 44 N -4.12 0.98 -0.05 2.20 1.16 -1.26 -4.48 117.46 111.90 1pra n PHE 44 Ca 0.00 -0.40 -0.08 0.00 -1.87 0.00 0.00 57.45 55.10 1pra n PHE 44 Cb 0.45 -0.31 -0.02 0.00 -1.61 0.00 0.00 39.48 37.99 1pra n PHE 44 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 1pra h LEU 45 N 1.71 -0.37 -0.50 5.98 7.12 -1.92 0.15 115.31 127.48 1pra h LEU 45 Ca 0.03 0.09 -0.06 0.00 0.13 0.00 0.00 57.88 58.06 1pra h LEU 45 Cb 1.23 0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 41.55 1pra h LEU 45 CO 0.25 -0.14 0.06 1.55 -0.13 0.00 0.00 178.44 180.03 1pra h PRO 46 N -0.08 0.84 -0.26 5.25 0.13 -1.88 -0.07 132.00 135.94 1pra h PRO 46 Ca 0.12 -0.24 0.03 0.00 -0.87 0.00 0.00 66.00 65.05 1pra h PRO 46 Cb 0.27 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.27 1pra h PRO 46 CO -0.28 0.85 0.08 0.93 -0.23 0.00 0.00 178.00 179.34 1pra h GLU 47 N 0.72 0.18 0.11 0.86 5.08 -1.80 0.12 114.58 119.85 1pra h GLU 47 Ca 0.15 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1pra h GLU 47 Cb 0.43 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1pra h GLU 47 CO 0.01 0.12 -0.05 1.25 -1.00 0.00 0.00 179.01 179.34 1pra h LEU 48 N 0.19 -0.12 -0.50 1.33 7.12 -0.59 0.19 115.31 122.93 1pra h LEU 48 Ca 0.12 -0.20 0.10 0.00 0.13 0.00 0.00 57.88 58.02 1pra h LEU 48 Cb 0.10 0.03 -0.09 0.00 -0.53 0.00 0.00 40.66 40.16 1pra h LEU 48 CO -0.13 0.14 -0.11 0.00 -0.13 0.00 0.00 178.44 178.21 1pra h ALA 49 N 0.47 0.35 -0.52 1.25 0.00 -0.82 -1.07 119.26 118.91 1pra h ALA 49 Ca -0.02 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1pra h ALA 49 Cb 0.32 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1pra h ALA 49 CO 0.02 -0.44 0.11 0.77 0.00 0.00 0.00 179.25 179.72 1pra h SER 50 N 0.01 0.81 -0.88 0.00 0.02 -0.64 0.36 113.55 113.23 1pra h SER 50 Ca 0.24 -0.25 0.11 0.00 -0.84 0.00 0.00 61.79 61.05 1pra h SER 50 Cb 0.37 -0.21 -0.08 0.00 0.14 0.00 0.00 62.40 62.62 1pra h SER 50 CO -0.50 0.85 0.51 0.00 -1.14 0.00 0.00 176.83 176.55 1pra h ALA 51 N 0.99 1.28 0.01 3.77 0.00 0.36 -0.58 119.26 125.09 1pra h ALA 51 Ca 0.16 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.91 1pra h ALA 51 Cb 0.37 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1pra h ALA 51 CO 0.01 0.12 -0.94 -0.07 0.00 0.00 0.00 179.25 178.37 1pra h LEU 52 N 0.83 0.03 -2.51 0.00 3.38 -1.06 -3.49 115.31 112.50 1pra h LEU 52 Ca 0.43 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1pra h LEU 52 Cb 0.43 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1pra h LEU 52 CO -0.26 0.95 0.00 0.61 0.09 0.00 0.00 178.44 179.82 1pra n GLY 53 N 1.14 0.55 3.31 0.83 0.00 0.99 -4.96 105.19 107.06 1pra n GLY 53 Ca -0.01 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 1pra n GLY 53 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pra s VAL 54 N -2.84 0.00 0.25 1.61 -7.23 0.29 -4.99 120.40 107.49 1pra s VAL 54 Ca 0.00 -1.86 -0.06 0.00 -1.81 0.00 0.00 61.98 58.24 1pra s VAL 54 Cb 0.00 -2.48 -0.06 0.00 0.56 0.00 0.00 36.38 34.40 1pra s VAL 54 CO 0.00 0.00 0.52 -0.94 -0.31 0.00 0.00 175.10 174.37 1pra s SER 55 N -3.21 6.51 0.22 4.85 1.04 -1.26 -3.71 113.70 118.15 1pra s SER 55 Ca 0.36 0.76 -0.07 0.00 0.48 0.00 0.00 55.95 57.48 1pra s SER 55 Cb 0.04 -2.16 0.32 0.00 0.10 0.00 0.00 66.02 64.32 1pra s SER 55 CO 0.17 -0.12 1.79 0.58 0.98 0.00 0.00 173.24 176.64 1pra h VAL 56 N 1.67 0.88 -0.91 5.02 2.07 -1.91 0.59 116.25 123.67 1pra h VAL 56 Ca -0.47 -0.22 0.16 0.00 0.82 0.00 0.00 66.70 66.98 1pra h VAL 56 Cb 1.18 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 31.06 1pra h VAL 56 CO 0.68 0.12 0.58 -0.78 0.02 0.00 0.00 177.57 178.19 1pra h ASP 57 N 0.64 0.64 -0.06 0.57 3.58 -1.98 0.33 116.42 120.14 1pra h ASP 57 Ca 0.34 0.05 -0.14 0.00 0.42 0.00 0.00 57.03 57.70 1pra h ASP 57 Cb 0.33 -0.08 0.01 0.00 1.72 0.00 0.00 39.33 41.31 1pra h ASP 57 CO -0.25 0.31 -0.51 -0.25 -2.88 0.00 0.00 179.24 175.66 1pra h TRP 58 N 0.67 0.63 0.00 0.28 7.01 -1.57 0.20 115.95 123.17 1pra h TRP 58 Ca 0.47 -0.30 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 1pra h TRP 58 Cb 0.80 -0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 27.77 1pra h TRP 58 CO -0.00 1.09 -0.01 -0.07 -2.79 0.00 0.00 178.44 176.65 1pra h LEU 59 N -0.00 0.00 0.05 0.65 3.38 0.72 0.71 115.31 120.81 1pra h LEU 59 Ca -0.05 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.64 1pra h LEU 59 Cb 1.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1pra h LEU 59 CO 0.10 0.01 -1.56 0.18 0.09 0.00 0.00 178.44 177.27 1pra n LEU 60 N -3.22 2.16 -0.00 1.67 4.77 0.99 -4.73 117.00 118.64 1pra n LEU 60 Ca -0.02 0.34 -0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1pra n LEU 60 Cb 0.14 -1.03 -0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1pra n LEU 60 CO 0.23 0.50 0.02 0.78 -1.33 0.00 0.00 177.39 177.59 1pra h ASN 61 N -0.59 -0.01 0.00 -1.43 2.35 -0.38 -3.49 115.58 112.03 1pra h ASN 61 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1pra h ASN 61 Cb 1.59 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.96 1pra h ASN 61 CO -0.10 0.06 0.00 0.61 -1.65 0.00 0.00 177.43 176.35 1pra n GLY 62 N 1.86 0.98 3.00 2.83 0.00 0.24 -5.02 105.19 109.08 1pra n GLY 62 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1pra n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pra s THR 63 N -2.00 -0.03 -0.43 2.61 -4.23 -1.26 -5.03 115.64 105.27 1pra s THR 63 Ca 0.00 0.10 0.08 0.00 -1.18 0.00 0.00 61.69 60.69 1pra s THR 63 Cb 0.00 -0.27 0.29 0.00 1.34 0.00 0.00 72.50 73.86 1pra s THR 63 CO 0.00 0.04 0.86 -1.20 -0.54 0.00 0.00 174.62 173.79 1pra n SER 64 N 3.72 -1.33 -3.10 3.99 7.64 -1.26 -4.77 113.62 118.51 1pra n SER 64 Ca -0.21 -3.26 0.02 0.00 1.01 0.00 0.00 58.87 56.43 1pra n SER 64 Cb 0.55 0.87 -0.00 0.00 -1.01 0.00 0.00 64.21 64.62 1pra n SER 64 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1pra s ASP 65 N -1.63 -1.21 -0.96 6.43 -4.77 -1.26 -4.99 116.67 108.28 1pra s ASP 65 Ca 0.31 -0.49 -0.05 0.00 -3.30 0.00 0.00 52.55 49.02 1pra s ASP 65 Cb 0.27 1.58 -0.04 0.00 -1.09 0.00 0.00 42.92 43.63 1pra s ASP 65 CO -0.12 -0.15 0.84 -1.20 0.70 0.00 0.00 175.17 175.24 1pra n SER 66 N 4.40 -6.90 0.00 2.11 7.64 -1.26 -5.00 113.62 114.60 1pra n SER 66 Ca 0.09 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.43 1pra n SER 66 Cb 0.58 -5.10 0.00 0.00 -1.01 0.00 0.00 64.21 58.68 1pra n SER 66 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1pra n ASN 67 N -2.76 0.00 -4.77 6.43 5.15 -1.26 -4.88 115.26 113.18 1pra n ASN 67 Ca -0.05 0.52 -0.30 0.00 -0.60 0.00 0.00 54.58 54.15 1pra n ASN 67 Cb 0.58 -0.27 0.11 0.00 -0.53 0.00 0.00 39.78 39.67 1pra n ASN 67 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1pra s VAL 68 N -1.32 2.97 -2.55 3.44 -7.23 -1.26 -5.20 120.40 109.25 1pra s VAL 68 Ca 0.00 0.32 0.28 0.00 -1.81 0.00 0.00 61.98 60.76 1pra s VAL 68 Cb 0.00 -2.93 0.51 0.00 0.56 0.00 0.00 36.38 34.53 1pra s VAL 68 CO 0.00 -0.41 1.70 0.54 -0.31 0.00 0.00 175.10 176.61