#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 0.98 -0.85 0.44 1.08 -1.80 -0.14 117.51 117.22 1pra h ILE 2 Ca 0.00 -0.33 0.08 0.00 -0.39 0.00 0.00 64.86 64.22 1pra h ILE 2 Cb 0.00 -0.07 -0.11 0.00 -3.07 0.00 0.00 36.82 33.57 1pra h ILE 2 CO 0.00 0.18 -0.56 -1.28 -0.69 0.00 0.00 178.15 175.79 1pra h SER 3 N 0.96 -2.04 -0.48 1.72 0.87 -1.12 0.18 113.55 113.64 1pra h SER 3 Ca 0.44 0.30 -0.02 0.00 -1.23 0.00 0.00 61.79 61.28 1pra h SER 3 Cb 0.38 0.89 -0.02 0.00 -0.44 0.00 0.00 62.40 63.21 1pra h SER 3 CO -0.19 -0.26 0.21 0.77 -0.53 0.00 0.00 176.83 176.83 1pra h SER 4 N -0.08 0.64 0.61 6.23 4.64 -1.35 0.17 113.55 124.41 1pra h SER 4 Ca 0.14 -0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1pra h SER 4 Cb 0.43 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1pra h SER 4 CO -0.84 0.61 -0.36 0.03 -0.87 0.00 0.00 176.83 175.40 1pra h ARG 5 N 0.63 -0.87 0.08 4.77 -0.00 -0.50 0.65 114.38 119.15 1pra h ARG 5 Ca 0.16 0.06 0.02 0.00 -0.50 0.00 0.00 59.98 59.72 1pra h ARG 5 Cb 0.15 0.20 -0.05 0.00 0.00 0.00 0.00 29.97 30.27 1pra h ARG 5 CO -0.02 -0.58 -0.40 0.28 0.00 0.00 0.00 179.97 179.25 1pra h VAL 6 N -0.90 0.18 -0.25 2.04 2.07 -0.62 -1.28 116.25 117.49 1pra h VAL 6 Ca -0.08 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.50 1pra h VAL 6 Cb 0.71 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 1pra h VAL 6 CO 0.09 0.00 -0.24 0.50 0.02 0.00 0.00 177.57 177.94 1pra h LYS 7 N -0.61 -0.24 -0.25 1.57 3.64 -0.68 0.31 116.57 120.31 1pra h LYS 7 Ca 0.03 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.48 1pra h LYS 7 Cb 0.66 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.48 1pra h LYS 7 CO -0.26 -0.16 -0.11 1.03 -2.27 0.00 0.00 179.45 177.68 1pra h SER 8 N -0.25 -0.38 -0.56 4.20 0.87 -0.54 0.67 113.55 117.56 1pra h SER 8 Ca 0.14 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.73 1pra h SER 8 Cb 0.46 0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 1pra h SER 8 CO -0.40 -0.14 0.10 0.50 -0.53 0.00 0.00 176.83 176.36 1pra h LYS 9 N -0.08 0.92 -0.68 2.24 3.11 -0.63 -1.72 116.57 119.73 1pra h LYS 9 Ca 0.13 -0.24 0.13 0.00 -2.81 0.00 0.00 60.65 57.86 1pra h LYS 9 Cb 0.27 -0.11 -0.09 0.00 -1.00 0.00 0.00 32.23 31.30 1pra h LYS 9 CO -0.30 0.88 0.20 -0.09 -2.81 0.00 0.00 179.45 177.33 1pra h ARG 10 N 0.81 0.32 0.53 1.90 2.43 0.33 0.25 114.38 120.96 1pra h ARG 10 Ca 0.17 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1pra h ARG 10 Cb 0.40 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1pra h ARG 10 CO 0.01 0.21 -0.32 0.82 -1.51 0.00 0.00 179.97 179.18 1pra h ILE 11 N 0.33 0.34 -0.96 1.20 5.03 -0.49 0.29 117.51 123.25 1pra h ILE 11 Ca 0.37 0.00 0.10 0.00 -0.12 0.00 0.00 64.86 65.21 1pra h ILE 11 Cb 0.56 0.34 -0.08 0.00 -3.03 0.00 0.00 36.82 34.62 1pra h ILE 11 CO -0.42 0.00 0.59 -0.61 -0.68 0.00 0.00 178.15 177.03 1pra h GLN 12 N -0.81 0.95 0.00 2.37 4.15 -0.37 0.15 115.11 121.54 1pra h GLN 12 Ca -0.06 -0.06 -0.09 0.00 0.77 0.00 0.00 58.65 59.21 1pra h GLN 12 Cb 0.66 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 1pra h GLN 12 CO 0.07 0.63 -0.41 -0.07 -1.93 0.00 0.00 178.83 177.12 1pra h LEU 13 N 0.98 0.00 -0.17 -2.39 -0.00 -0.40 -3.47 115.31 109.85 1pra h LEU 13 Ca 0.46 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 58.21 1pra h LEU 13 Cb 0.40 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.08 1pra h LEU 13 CO -0.24 0.41 -0.21 0.61 -0.00 0.00 0.00 178.44 179.01 1pra n GLY 14 N -0.33 0.31 3.66 0.83 0.00 0.95 -5.05 105.19 105.57 1pra n GLY 14 Ca -0.02 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.65 2.52 0.37 0.99 1.43 -0.75 -5.03 118.68 115.56 1pra s LEU 15 Ca 0.12 -1.51 0.07 0.00 -1.03 0.00 0.00 54.13 51.78 1pra s LEU 15 Cb -0.05 -0.74 -0.00 0.00 0.03 0.00 0.00 46.19 45.43 1pra s LEU 15 CO 0.14 -0.66 0.50 0.54 0.23 0.00 0.00 176.35 177.10 1pra s ASN 16 N -3.76 5.84 0.45 2.29 4.22 -1.26 -4.60 114.94 118.11 1pra s ASN 16 Ca 0.22 -0.28 0.14 0.00 -2.14 0.00 0.00 52.86 50.80 1pra s ASN 16 Cb 0.06 -1.01 1.06 0.00 1.28 0.00 0.00 41.25 42.64 1pra s ASN 16 CO 0.11 -0.56 2.00 1.56 -2.04 0.00 0.00 177.10 178.18 1pra h GLN 17 N 0.81 0.35 0.58 3.55 4.20 -1.98 -1.05 115.11 121.57 1pra h GLN 17 Ca -0.44 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.23 1pra h GLN 17 Cb 1.27 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 28.97 1pra h GLN 17 CO 0.50 0.23 -0.28 0.00 -0.67 0.00 0.00 178.83 178.61 1pra h ALA 18 N 1.73 -0.78 -0.40 3.87 0.00 -1.94 0.23 119.26 121.96 1pra h ALA 18 Ca 0.24 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1pra h ALA 18 Cb 0.47 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1pra h ALA 18 CO -0.06 -0.88 0.22 0.93 0.00 0.00 0.00 179.25 179.46 1pra h GLU 19 N -0.89 0.44 -0.49 0.00 4.39 -1.90 0.46 114.58 116.59 1pra h GLU 19 Ca -0.08 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.68 1pra h GLU 19 Cb 0.64 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 29.12 1pra h GLU 19 CO 0.13 0.29 0.07 1.25 -1.16 0.00 0.00 179.01 179.59 1pra h LEU 20 N 0.45 -0.06 -0.56 1.33 6.46 -1.14 0.78 115.31 122.57 1pra h LEU 20 Ca 0.16 0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 58.02 1pra h LEU 20 Cb 0.04 0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1pra h LEU 20 CO -0.09 -0.00 0.34 0.00 -0.62 0.00 0.00 178.44 178.07 1pra h ALA 21 N 1.40 0.72 -0.53 1.25 0.00 0.38 0.17 119.26 122.64 1pra h ALA 21 Ca 0.25 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1pra h ALA 21 Cb 0.34 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1pra h ALA 21 CO -0.35 0.19 0.24 1.96 0.00 0.00 0.00 179.25 181.30 1pra h GLN 22 N 0.76 0.45 -0.24 0.00 4.20 -0.44 0.24 115.11 120.08 1pra h GLN 22 Ca 0.20 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.84 1pra h GLN 22 Cb -0.02 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1pra h GLN 22 CO -0.04 0.30 -0.07 -0.22 -0.67 0.00 0.00 178.83 178.12 1pra h LYS 23 N 0.46 0.37 0.00 1.46 3.64 0.27 -0.30 116.57 122.47 1pra h LYS 23 Ca 0.24 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.44 1pra h LYS 23 Cb 0.20 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1pra h LYS 23 CO -0.20 0.46 -0.48 0.28 -2.27 0.00 0.00 179.45 177.24 1pra h VAL 24 N 0.36 1.19 -0.63 2.00 2.07 -0.19 -3.45 116.25 117.61 1pra h VAL 24 Ca 0.07 -1.74 0.00 0.00 0.82 0.00 0.00 66.70 65.85 1pra h VAL 24 Cb 0.36 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1pra h VAL 24 CO 0.02 0.47 0.00 0.61 0.02 0.00 0.00 177.57 178.69 1pra n GLY 25 N 0.12 0.81 0.00 2.17 0.00 0.70 -4.77 105.19 104.22 1pra n GLY 25 Ca -0.01 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.79 0.00 -4.82 2.61 5.66 -0.35 -5.02 114.28 109.57 1pra n THR 26 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 1pra n THR 26 Cb 0.46 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.12 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 0.48 2.99 0.17 1.09 -4.23 -1.26 -4.14 115.64 110.75 1pra s THR 27 Ca 0.00 -0.86 -0.08 0.00 -1.18 0.00 0.00 61.69 59.57 1pra s THR 27 Cb 0.00 -2.20 0.23 0.00 1.34 0.00 0.00 72.50 71.87 1pra s THR 27 CO 0.00 0.51 1.02 1.67 -0.54 0.00 0.00 174.62 177.28 1pra n GLN 28 N 2.07 -0.11 -0.32 3.99 -0.06 -1.26 0.23 117.38 121.92 1pra n GLN 28 Ca -0.17 1.02 0.17 0.00 -2.00 0.00 0.00 57.00 56.02 1pra n GLN 28 Cb 0.52 -1.51 0.36 0.00 -4.06 0.00 0.00 30.24 25.55 1pra n GLN 28 CO 0.00 0.00 0.00 -0.56 -0.20 0.00 0.00 177.06 176.30 1pra h GLN 29 N 0.00 0.37 -0.89 3.69 -0.00 -1.95 0.49 115.11 116.81 1pra h GLN 29 Ca 0.27 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.89 1pra h GLN 29 Cb 0.44 -0.08 -0.04 0.00 -0.00 0.00 0.00 27.48 27.79 1pra h GLN 29 CO -0.66 0.24 0.53 0.77 -0.00 0.00 0.00 178.83 179.71 1pra h SER 30 N 0.38 1.07 0.03 0.06 0.02 -0.63 0.29 113.55 114.77 1pra h SER 30 Ca 0.62 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.50 1pra h SER 30 Cb 1.26 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.53 1pra h SER 30 CO -0.56 0.83 -0.01 0.40 -1.14 0.00 0.00 176.83 176.34 1pra h ILE 31 N 1.23 1.38 0.14 3.27 5.03 -0.16 -1.62 117.51 126.78 1pra h ILE 31 Ca 0.32 -1.36 0.01 0.00 -0.12 0.00 0.00 64.86 63.72 1pra h ILE 31 Cb -0.05 2.27 -0.03 0.00 -3.03 0.00 0.00 36.82 35.98 1pra h ILE 31 CO -0.06 0.34 -0.26 -0.08 -0.68 0.00 0.00 178.15 177.42 1pra h GLU 32 N -0.64 -0.46 -0.43 2.37 4.81 -0.61 0.45 114.58 120.07 1pra h GLU 32 Ca -0.00 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1pra h GLU 32 Cb 0.59 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.05 1pra h GLU 32 CO 0.01 -0.31 0.29 -0.56 -0.73 0.00 0.00 179.01 177.71 1pra h GLN 33 N -0.48 0.47 -0.03 1.92 3.07 -0.48 0.11 115.11 119.69 1pra h GLN 33 Ca 0.02 -0.03 -0.09 0.00 0.09 0.00 0.00 58.65 58.64 1pra h GLN 33 Cb 0.49 -0.11 0.01 0.00 0.08 0.00 0.00 27.48 27.95 1pra h GLN 33 CO -0.13 0.31 -0.33 1.25 0.09 0.00 0.00 178.83 180.02 1pra h LEU 34 N 0.49 0.35 -0.18 0.06 5.85 -0.74 0.26 115.31 121.40 1pra h LEU 34 Ca 0.17 -0.70 0.04 0.00 0.84 0.00 0.00 57.88 58.23 1pra h LEU 34 Cb 0.08 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 40.93 1pra h LEU 34 CO -0.04 1.01 -0.49 -0.33 -0.34 0.00 0.00 178.44 178.24 1pra h GLU 35 N -0.27 -0.50 -0.34 1.25 5.08 0.35 0.71 114.58 120.87 1pra h GLU 35 Ca -0.03 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pra h GLU 35 Cb 1.03 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1pra h GLU 35 CO 0.07 -0.33 0.00 0.27 -1.00 0.00 0.00 179.01 178.02 1pra n ASN 36 N -5.43 1.78 -0.00 1.42 6.94 0.33 -0.70 115.26 119.59 1pra n ASN 36 Ca -0.05 -2.00 -0.18 0.00 -0.02 0.00 0.00 54.58 52.34 1pra n ASN 36 Cb 0.37 -0.22 -0.14 0.00 -2.36 0.00 0.00 39.78 37.43 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pra n GLY 37 N 1.03 -0.69 3.66 4.83 0.00 0.91 -4.98 105.19 109.94 1pra n GLY 37 Ca 0.11 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 1pra n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pra n LYS 38 N -3.35 -6.24 -2.38 1.61 4.01 -0.86 -4.96 118.16 105.99 1pra n LYS 38 Ca -0.28 0.72 -0.32 0.00 -0.51 0.00 0.00 58.31 57.93 1pra n LYS 38 Cb 1.05 -5.60 -0.03 0.00 -0.51 0.00 0.00 35.03 29.94 1pra n LYS 38 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1pra s THR 39 N -3.42 4.58 -0.07 -0.18 -1.32 -1.26 -4.97 115.64 108.99 1pra s THR 39 Ca 0.29 1.13 -0.21 0.00 -1.21 0.00 0.00 61.69 61.69 1pra s THR 39 Cb -0.14 -3.74 -0.16 0.00 -1.51 0.00 0.00 72.50 66.95 1pra s THR 39 CO 0.78 -0.73 0.80 0.11 -2.21 0.00 0.00 174.62 173.37 1pra h LYS 40 N 0.80 -0.15 -2.07 7.08 1.57 -1.97 -3.45 116.57 118.39 1pra h LYS 40 Ca -0.46 0.01 -0.27 0.00 -1.87 0.00 0.00 60.65 58.06 1pra h LYS 40 Cb 1.19 0.03 -0.32 0.00 0.08 0.00 0.00 32.23 33.21 1pra h LYS 40 CO 0.62 0.34 -0.59 0.50 -0.57 0.00 0.00 179.45 179.75 1pra s ARG 41 N -3.11 0.32 0.74 3.15 3.00 -1.26 -4.77 118.95 117.02 1pra s ARG 41 Ca -0.13 0.09 -0.12 0.00 -1.00 0.00 0.00 55.73 54.57 1pra s ARG 41 Cb -0.00 -0.64 0.18 0.00 0.00 0.00 0.00 34.95 34.49 1pra s ARG 41 CO 0.48 -0.90 0.79 -0.35 0.00 0.00 0.00 175.30 175.32 1pra n PRO 42 N 5.33 -1.73 0.04 5.12 -0.04 -1.26 -5.02 135.00 137.44 1pra n PRO 42 Ca -0.02 -1.24 -0.19 0.00 -0.04 0.00 0.00 63.50 62.01 1pra n PRO 42 Cb 0.48 -1.00 -0.14 0.00 -0.04 0.00 0.00 33.50 32.80 1pra n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pra h ARG 43 N 0.00 0.27 -0.72 0.54 2.47 -2.03 -3.35 114.38 111.55 1pra h ARG 43 Ca -0.28 -0.45 -0.09 0.00 -1.26 0.00 0.00 59.98 57.90 1pra h ARG 43 Cb 0.81 0.17 -0.05 0.00 -1.65 0.00 0.00 29.97 29.24 1pra h ARG 43 CO 0.19 1.13 0.11 1.97 0.56 0.00 0.00 179.97 183.92 1pra n PHE 44 N -3.45 1.90 0.00 3.04 1.16 -1.26 -4.50 117.46 114.35 1pra n PHE 44 Ca -0.22 -0.81 -0.10 0.00 -1.87 0.00 0.00 57.45 54.46 1pra n PHE 44 Cb 1.05 -0.52 -0.04 0.00 -1.61 0.00 0.00 39.48 38.36 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 2.85 -0.26 -0.90 5.98 5.85 -1.97 0.10 115.31 126.96 1pra h LEU 45 Ca 0.11 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1pra h LEU 45 Cb 1.90 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 43.04 1pra h LEU 45 CO 0.51 -0.11 0.15 1.55 -0.34 0.00 0.00 178.44 180.20 1pra h PRO 46 N -0.09 0.96 0.42 5.25 0.13 -1.91 0.12 132.00 136.89 1pra h PRO 46 Ca 0.07 -0.21 -0.02 0.00 -0.87 0.00 0.00 66.00 64.97 1pra h PRO 46 Cb 0.20 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.19 1pra h PRO 46 CO -0.17 0.85 -0.20 0.93 -0.23 0.00 0.00 178.00 179.19 1pra h GLU 47 N 0.92 -0.54 -0.61 0.86 3.07 -1.77 0.13 114.58 116.63 1pra h GLU 47 Ca 0.20 0.04 0.05 0.00 -0.50 0.00 0.00 59.36 59.15 1pra h GLU 47 Cb 0.32 0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 1pra h GLU 47 CO -0.00 -0.30 0.34 1.25 -1.40 0.00 0.00 179.01 178.90 1pra h LEU 48 N -0.68 0.50 0.15 1.33 5.85 -0.74 0.13 115.31 121.84 1pra h LEU 48 Ca -0.06 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1pra h LEU 48 Cb 0.50 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1pra h LEU 48 CO 0.09 0.34 -0.22 0.00 -0.34 0.00 0.00 178.44 178.31 1pra h ALA 49 N 1.31 -0.39 -0.52 1.25 0.00 -0.33 0.12 119.26 120.71 1pra h ALA 49 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1pra h ALA 49 Cb 0.14 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1pra h ALA 49 CO -0.16 -0.76 0.15 0.77 0.00 0.00 0.00 179.25 179.25 1pra h SER 50 N -0.43 0.76 -0.13 0.00 0.02 -0.56 0.57 113.55 113.78 1pra h SER 50 Ca 0.02 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1pra h SER 50 Cb 0.43 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1pra h SER 50 CO -0.10 0.78 0.08 0.00 -1.14 0.00 0.00 176.83 176.45 1pra h ALA 51 N 1.01 0.16 -0.00 3.77 0.00 -0.45 -2.49 119.26 121.26 1pra h ALA 51 Ca 0.16 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 1pra h ALA 51 Cb 0.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1pra h ALA 51 CO -0.00 -0.34 -0.71 -0.07 0.00 0.00 0.00 179.25 178.12 1pra h LEU 52 N 0.16 0.00 -2.75 0.00 3.38 -0.73 -3.49 115.31 111.89 1pra h LEU 52 Ca 0.05 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pra h LEU 52 Cb -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1pra h LEU 52 CO -0.01 0.71 -0.00 0.61 0.09 0.00 0.00 178.44 179.84 1pra n GLY 53 N 0.51 0.79 3.58 0.83 0.00 0.17 -4.99 105.19 106.08 1pra n GLY 53 Ca -0.01 -0.33 -0.27 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.00 1.15 0.09 1.61 -7.23 0.34 -5.01 120.40 108.34 1pra s VAL 54 Ca 0.00 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.10 1pra s VAL 54 Cb -0.00 -2.52 -0.06 0.00 0.56 0.00 0.00 36.38 34.36 1pra s VAL 54 CO 0.00 0.00 0.37 -0.94 -0.31 0.00 0.00 175.10 174.23 1pra s SER 55 N -3.67 6.57 0.14 4.85 1.04 -1.26 -4.35 113.70 117.02 1pra s SER 55 Ca 0.24 0.69 -0.16 0.00 0.48 0.00 0.00 55.95 57.20 1pra s SER 55 Cb 0.05 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 64.04 1pra s SER 55 CO 0.12 0.14 1.74 0.58 0.98 0.00 0.00 173.24 176.80 1pra h VAL 56 N 2.60 1.15 -0.94 5.02 2.07 -1.94 -0.18 116.25 124.03 1pra h VAL 56 Ca -0.48 -0.41 0.27 0.00 0.82 0.00 0.00 66.70 66.90 1pra h VAL 56 Cb 1.18 0.71 -0.14 0.00 -1.52 0.00 0.00 31.29 31.52 1pra h VAL 56 CO 0.68 0.16 0.40 -2.24 0.02 0.00 0.00 177.57 176.60 1pra h ASP 57 N 0.50 0.26 -0.04 0.57 2.03 -1.98 0.35 116.42 118.11 1pra h ASP 57 Ca 0.14 0.19 -0.02 0.00 -0.73 0.00 0.00 57.03 56.61 1pra h ASP 57 Cb 0.07 0.20 -0.00 0.00 -0.83 0.00 0.00 39.33 38.77 1pra h ASP 57 CO -0.02 -0.13 -0.06 -0.25 -1.03 0.00 0.00 179.24 177.75 1pra h TRP 58 N 0.28 0.13 -0.17 4.15 7.01 -1.68 0.17 115.95 125.85 1pra h TRP 58 Ca 0.64 -0.05 0.05 0.00 2.11 0.00 0.00 58.89 61.64 1pra h TRP 58 Cb 1.36 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 28.38 1pra h TRP 58 CO -0.14 0.63 0.22 -0.07 -2.79 0.00 0.00 178.44 176.29 1pra h LEU 59 N -0.40 0.00 0.01 0.65 3.38 0.71 0.97 115.31 120.62 1pra h LEU 59 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1pra h LEU 59 Cb 0.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1pra h LEU 59 CO 0.01 0.00 -0.28 -0.07 0.09 0.00 0.00 178.44 178.20 1pra h LEU 60 N 0.00 0.04 0.00 1.67 3.38 -0.25 -3.43 115.31 116.73 1pra h LEU 60 Ca 0.08 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1pra h LEU 60 Cb 0.52 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1pra h LEU 60 CO -0.00 1.11 0.00 0.59 0.09 0.00 0.00 178.44 180.23 1pra n ASN 61 N -4.53 0.00 -0.37 -0.43 3.02 0.60 -5.04 115.26 108.51 1pra n ASN 61 Ca -0.14 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 1pra n ASN 61 Cb 0.54 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1pra n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pra n GLY 62 N 2.23 0.81 2.59 7.41 0.00 0.33 -5.02 105.19 113.54 1pra n GLY 62 Ca 0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.25 -0.10 0.36 2.61 -4.23 -1.26 -4.95 115.64 105.82 1pra s THR 63 Ca 0.00 -0.47 -0.17 0.00 -1.18 0.00 0.00 61.69 59.87 1pra s THR 63 Cb 0.00 -0.79 0.05 0.00 1.34 0.00 0.00 72.50 73.10 1pra s THR 63 CO 0.00 -0.51 0.80 -0.55 -0.54 0.00 0.00 174.62 173.82 1pra s SER 64 N 2.14 -0.03 0.77 3.99 0.15 -1.26 -5.05 113.70 114.41 1pra s SER 64 Ca 0.06 -1.05 -0.14 0.00 0.70 0.00 0.00 55.95 55.53 1pra s SER 64 Cb -0.16 0.81 0.06 0.00 -1.71 0.00 0.00 66.02 65.02 1pra s SER 64 CO -0.24 -1.60 1.18 -1.81 1.20 0.00 0.00 173.24 171.97 1pra s ASP 65 N -3.08 3.98 -0.02 5.45 1.11 -1.26 -4.76 116.67 118.10 1pra s ASP 65 Ca 0.15 2.26 -0.01 0.00 0.18 0.00 0.00 52.55 55.13 1pra s ASP 65 Cb -0.05 -2.58 0.01 0.00 1.07 0.00 0.00 42.92 41.37 1pra s ASP 65 CO 0.10 -2.40 0.03 -0.24 1.18 0.00 0.00 175.17 173.84 1pra n SER 66 N -3.11 -3.83 0.00 0.27 2.88 -1.26 -5.06 113.62 103.52 1pra n SER 66 Ca 0.13 0.64 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 1pra n SER 66 Cb 0.51 -2.59 0.00 0.00 -0.75 0.00 0.00 64.21 61.38 1pra n SER 66 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1pra n ASN 67 N 0.67 0.00 -0.18 -3.46 5.15 -1.26 -4.85 115.26 111.34 1pra n ASN 67 Ca -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 1pra n ASN 67 Cb 0.07 0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 1pra n ASN 67 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1pra n VAL 68 N -1.80 0.00 0.15 3.44 0.24 -1.26 -4.98 118.33 114.11 1pra n VAL 68 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.31 1pra n VAL 68 Cb 0.00 0.00 0.07 0.00 -1.47 0.00 0.00 33.84 32.44 1pra n VAL 68 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23