#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 0.92 -0.43 -1.33 2.10 -1.93 -3.11 117.51 113.74 1pra h ILE 2 Ca 0.00 -0.19 0.09 0.00 1.08 0.00 0.00 64.86 65.83 1pra h ILE 2 Cb 0.00 1.04 -0.09 0.00 -1.09 0.00 0.00 36.82 36.68 1pra h ILE 2 CO 0.00 0.05 -0.22 0.77 -1.08 0.00 0.00 178.15 177.66 1pra h SER 3 N -0.27 -0.76 -0.96 2.19 4.64 -1.81 -0.45 113.55 116.13 1pra h SER 3 Ca -0.02 0.17 0.18 0.00 -0.47 0.00 0.00 61.79 61.65 1pra h SER 3 Cb 0.21 0.40 -0.09 0.00 -0.31 0.00 0.00 62.40 62.62 1pra h SER 3 CO 0.03 -0.25 0.61 -1.28 -0.87 0.00 0.00 176.83 175.07 1pra h SER 4 N -0.14 0.66 0.66 4.97 0.87 -1.90 0.29 113.55 118.95 1pra h SER 4 Ca 0.20 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.80 1pra h SER 4 Cb 0.46 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.37 1pra h SER 4 CO -0.52 0.28 -0.32 0.03 -0.53 0.00 0.00 176.83 175.77 1pra h ARG 5 N 0.67 -0.85 -0.03 2.24 3.08 -1.02 0.12 114.38 118.59 1pra h ARG 5 Ca 0.51 0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.66 1pra h ARG 5 Cb 0.91 0.19 -0.05 0.00 0.08 0.00 0.00 29.97 31.11 1pra h ARG 5 CO -0.27 -0.55 -0.25 0.28 -1.07 0.00 0.00 179.97 178.11 1pra h VAL 6 N -1.19 0.42 -0.01 2.04 2.07 -1.08 -1.00 116.25 117.50 1pra h VAL 6 Ca -0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1pra h VAL 6 Cb 0.70 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1pra h VAL 6 CO 0.15 0.00 0.01 0.50 0.02 0.00 0.00 177.57 178.24 1pra h LYS 7 N -0.37 0.02 -0.40 1.57 3.64 -0.53 0.46 116.57 120.97 1pra h LYS 7 Ca 0.07 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.53 1pra h LYS 7 Cb 0.47 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1pra h LYS 7 CO -0.24 0.11 -0.05 0.77 -2.27 0.00 0.00 179.45 177.76 1pra h SER 8 N -0.08 -0.27 -0.21 4.20 0.02 -0.43 0.36 113.55 117.15 1pra h SER 8 Ca 0.00 0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 60.94 1pra h SER 8 Cb 0.09 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1pra h SER 8 CO -0.00 -0.09 -0.28 0.50 -1.14 0.00 0.00 176.83 175.82 1pra h LYS 9 N 0.05 0.70 -0.94 3.45 1.63 -0.97 -0.31 116.57 120.18 1pra h LYS 9 Ca 0.19 -0.30 0.05 0.00 -0.85 0.00 0.00 60.65 59.74 1pra h LYS 9 Cb 0.29 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.84 1pra h LYS 9 CO -0.37 0.90 0.61 -0.09 -3.45 0.00 0.00 179.45 177.05 1pra h ARG 10 N 0.60 1.10 0.35 1.90 2.43 -0.03 0.29 114.38 121.02 1pra h ARG 10 Ca 0.07 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1pra h ARG 10 Cb 0.78 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1pra h ARG 10 CO 0.06 0.73 -0.17 0.82 -1.51 0.00 0.00 179.97 179.91 1pra h ILE 11 N 1.14 0.66 -0.67 1.20 5.03 0.47 0.38 117.51 125.72 1pra h ILE 11 Ca 0.39 -0.31 0.13 0.00 -0.12 0.00 0.00 64.86 64.94 1pra h ILE 11 Cb 0.08 0.83 -0.09 0.00 -3.03 0.00 0.00 36.82 34.61 1pra h ILE 11 CO -0.13 0.06 0.19 -0.61 -0.68 0.00 0.00 178.15 176.98 1pra h GLN 12 N -0.65 0.32 -0.19 2.37 4.15 -0.70 0.12 115.11 120.53 1pra h GLN 12 Ca -0.05 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.21 1pra h GLN 12 Cb 0.46 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1pra h GLN 12 CO 0.08 0.21 -0.49 -0.07 -1.93 0.00 0.00 178.83 176.62 1pra h LEU 13 N 0.33 0.56 -2.19 -2.39 3.38 -0.92 -3.49 115.31 110.59 1pra h LEU 13 Ca 0.36 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1pra h LEU 13 Cb 0.54 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1pra h LEU 13 CO -0.41 0.96 0.00 0.61 0.09 0.00 0.00 178.44 179.69 1pra n GLY 14 N 0.14 0.66 3.49 0.83 0.00 0.13 -5.08 105.19 105.35 1pra n GLY 14 Ca -0.02 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.19 2.44 0.27 0.99 1.43 -0.71 -5.03 118.68 115.88 1pra s LEU 15 Ca 0.00 -1.34 0.06 0.00 -1.03 0.00 0.00 54.13 51.82 1pra s LEU 15 Cb 0.00 -0.59 -0.03 0.00 0.03 0.00 0.00 46.19 45.61 1pra s LEU 15 CO 0.00 -0.51 0.31 0.54 0.23 0.00 0.00 176.35 176.93 1pra s ASN 16 N -3.54 5.89 0.41 2.29 4.22 -1.26 -4.72 114.94 118.22 1pra s ASN 16 Ca 0.35 -0.14 0.16 0.00 -2.14 0.00 0.00 52.86 51.09 1pra s ASN 16 Cb 0.08 -1.52 1.05 0.00 1.28 0.00 0.00 41.25 42.14 1pra s ASN 16 CO 0.16 -0.14 1.87 1.56 -2.04 0.00 0.00 177.10 178.50 1pra h GLN 17 N 1.25 0.42 0.39 3.55 4.20 -1.98 -1.23 115.11 121.71 1pra h GLN 17 Ca -0.49 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.17 1pra h GLN 17 Cb 1.24 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.93 1pra h GLN 17 CO 0.59 0.28 -0.19 0.00 -0.67 0.00 0.00 178.83 178.85 1pra h ALA 18 N 1.62 -0.52 -0.50 3.87 0.00 -1.95 0.26 119.26 122.04 1pra h ALA 18 Ca 0.45 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.31 1pra h ALA 18 Cb 1.06 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1pra h ALA 18 CO -0.17 -0.77 0.10 0.93 0.00 0.00 0.00 179.25 179.34 1pra h GLU 19 N -0.58 0.23 -0.54 0.00 4.39 -1.82 0.24 114.58 116.50 1pra h GLU 19 Ca -0.05 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.72 1pra h GLU 19 Cb 0.44 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.97 1pra h GLU 19 CO 0.09 0.15 0.16 1.25 -1.16 0.00 0.00 179.01 179.50 1pra h LEU 20 N 0.23 0.12 -0.53 1.33 6.46 -0.98 0.11 115.31 122.04 1pra h LEU 20 Ca 0.25 0.08 0.04 0.00 -0.12 0.00 0.00 57.88 58.13 1pra h LEU 20 Cb 0.34 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.31 1pra h LEU 20 CO -0.33 0.09 0.30 0.00 -0.62 0.00 0.00 178.44 177.87 1pra h ALA 21 N 1.39 0.68 0.64 1.25 0.00 0.13 0.42 119.26 123.77 1pra h ALA 21 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1pra h ALA 21 Cb 0.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1pra h ALA 21 CO -0.30 -0.02 -0.50 1.96 0.00 0.00 0.00 179.25 180.39 1pra h GLN 22 N 0.58 -1.06 0.00 0.00 4.20 0.23 0.40 115.11 119.46 1pra h GLN 22 Ca 0.22 0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.98 1pra h GLN 22 Cb 0.08 0.24 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 1pra h GLN 22 CO -0.13 -0.71 -0.14 1.57 -0.67 0.00 0.00 178.83 178.76 1pra h LYS 23 N -1.10 0.00 0.00 1.46 -0.00 -0.85 -0.05 116.57 116.02 1pra h LYS 23 Ca -0.08 0.00 -0.13 0.00 -0.00 0.00 0.00 60.65 60.43 1pra h LYS 23 Cb 0.92 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.13 1pra h LYS 23 CO 0.02 0.14 -0.63 0.28 -0.00 0.00 0.00 179.45 179.25 1pra h VAL 24 N 0.00 1.42 -3.30 0.07 2.07 -0.62 -3.45 116.25 112.43 1pra h VAL 24 Ca -0.00 -2.20 -0.10 0.00 0.82 0.00 0.00 66.70 65.22 1pra h VAL 24 Cb 0.36 2.20 0.06 0.00 -1.52 0.00 0.00 31.29 32.39 1pra h VAL 24 CO 0.02 0.62 -0.25 0.61 0.02 0.00 0.00 177.57 178.59 1pra n GLY 25 N 0.37 0.20 0.00 2.17 0.00 0.12 -4.84 105.19 103.20 1pra n GLY 25 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.02 0.00 -4.50 2.61 5.66 0.04 -5.03 114.28 111.05 1pra n THR 26 Ca -0.08 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.59 1pra n THR 26 Cb 0.55 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.23 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 -1.79 3.74 0.31 1.09 -4.23 -1.26 -4.29 115.64 109.21 1pra s THR 27 Ca 0.00 -0.63 0.07 0.00 -1.18 0.00 0.00 61.69 59.94 1pra s THR 27 Cb 0.00 -2.59 0.30 0.00 1.34 0.00 0.00 72.50 71.55 1pra s THR 27 CO 0.00 0.47 1.71 -0.61 -0.54 0.00 0.00 174.62 175.65 1pra h GLN 28 N 4.79 0.45 -0.45 3.99 4.15 -1.89 0.94 115.11 127.09 1pra h GLN 28 Ca -0.49 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 58.99 1pra h GLN 28 Cb 1.17 -0.10 -0.07 0.00 0.21 0.00 0.00 27.48 28.69 1pra h GLN 28 CO 0.54 0.30 -0.01 0.37 -1.93 0.00 0.00 178.83 178.10 1pra h GLN 29 N 0.47 0.10 -0.81 1.69 4.15 -1.96 0.24 115.11 118.98 1pra h GLN 29 Ca 0.60 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 60.02 1pra h GLN 29 Cb 1.17 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.79 1pra h GLN 29 CO -0.51 0.07 0.50 0.77 -1.93 0.00 0.00 178.83 177.72 1pra h SER 30 N 0.10 0.96 0.41 -0.69 0.02 -1.25 -0.29 113.55 112.82 1pra h SER 30 Ca 0.22 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1pra h SER 30 Cb 0.33 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1pra h SER 30 CO -0.38 0.73 -0.20 0.40 -1.14 0.00 0.00 176.83 176.25 1pra h ILE 31 N 1.12 0.59 -0.40 3.27 1.08 -0.51 -1.75 117.51 120.91 1pra h ILE 31 Ca 0.29 -0.31 0.08 0.00 -0.39 0.00 0.00 64.86 64.53 1pra h ILE 31 Cb -0.06 0.74 -0.07 0.00 -3.07 0.00 0.00 36.82 34.35 1pra h ILE 31 CO -0.06 0.06 -0.09 -0.08 -0.69 0.00 0.00 178.15 177.29 1pra h GLU 32 N -0.73 0.01 -0.15 2.37 4.57 -0.38 0.46 114.58 120.74 1pra h GLU 32 Ca -0.06 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1pra h GLU 32 Cb 0.51 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.09 1pra h GLU 32 CO 0.09 0.01 0.15 1.96 -1.18 0.00 0.00 179.01 180.04 1pra h GLN 33 N 0.01 0.00 0.09 1.92 7.50 -1.03 -0.46 115.11 123.15 1pra h GLN 33 Ca 0.19 0.00 -0.22 0.00 0.50 0.00 0.00 58.65 59.12 1pra h GLN 33 Cb 0.29 0.00 0.02 0.00 0.05 0.00 0.00 27.48 27.84 1pra h GLN 33 CO -0.40 0.00 -0.91 1.25 -1.50 0.00 0.00 178.83 177.27 1pra h LEU 34 N 0.00 0.64 -0.80 1.46 7.12 0.78 -1.74 115.31 122.77 1pra h LEU 34 Ca 0.07 -0.85 0.14 0.00 0.13 0.00 0.00 57.88 57.37 1pra h LEU 34 Cb 0.38 -0.20 -0.09 0.00 -0.53 0.00 0.00 40.66 40.21 1pra h LEU 34 CO -0.00 1.42 0.37 -0.33 -0.13 0.00 0.00 178.44 179.78 1pra h GLU 35 N -0.06 0.53 0.00 1.25 3.07 -0.21 0.26 114.58 119.43 1pra h GLU 35 Ca -0.14 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 1pra h GLU 35 Cb 1.65 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 29.44 1pra h GLU 35 CO 0.17 0.35 0.00 0.27 -1.40 0.00 0.00 179.01 178.41 1pra n ASN 36 N -4.92 0.00 -1.84 1.42 0.23 -0.26 -4.13 115.26 105.75 1pra n ASN 36 Ca 0.15 -0.64 -0.07 0.00 -0.53 0.00 0.00 54.58 53.50 1pra n ASN 36 Cb 0.41 -0.04 0.03 0.00 -2.08 0.00 0.00 39.78 38.10 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pra n GLY 37 N 0.52 0.21 0.00 4.83 0.00 0.93 -4.95 105.19 106.72 1pra n GLY 37 Ca 0.17 -0.28 0.09 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.17 0.33 -3.66 1.61 2.85 -0.70 -4.80 118.16 111.62 1pra n LYS 38 Ca -0.08 0.09 -0.10 0.00 -1.05 0.00 0.00 58.31 57.17 1pra n LYS 38 Cb 0.55 -1.50 -0.03 0.00 -0.65 0.00 0.00 35.03 33.41 1pra n LYS 38 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1pra s THR 39 N -2.42 0.01 -0.09 0.58 -1.32 -1.26 -5.06 115.64 106.07 1pra s THR 39 Ca 0.19 -0.56 -0.23 0.00 -1.21 0.00 0.00 61.69 59.88 1pra s THR 39 Cb 0.12 -1.49 -0.29 0.00 -1.51 0.00 0.00 72.50 69.33 1pra s THR 39 CO 0.25 -0.04 0.77 0.07 -2.21 0.00 0.00 174.62 173.46 1pra h LYS 40 N 2.07 0.19 -3.16 7.08 2.10 -2.01 -3.45 116.57 119.38 1pra h LYS 40 Ca -0.28 -0.32 -0.51 0.00 -2.00 0.00 0.00 60.65 57.54 1pra h LYS 40 Cb 1.28 0.12 -0.40 0.00 -0.90 0.00 0.00 32.23 32.32 1pra h LYS 40 CO 0.33 1.16 -0.76 0.50 -2.00 0.00 0.00 179.45 178.68 1pra s ARG 41 N -2.37 0.33 0.88 0.07 3.52 -1.26 -4.87 118.95 115.25 1pra s ARG 41 Ca -0.17 -0.43 -0.13 0.00 -0.13 0.00 0.00 55.73 54.87 1pra s ARG 41 Cb 0.01 -1.73 0.12 0.00 -1.56 0.00 0.00 34.95 31.79 1pra s ARG 41 CO 0.77 -0.81 1.19 -1.25 -0.81 0.00 0.00 175.30 174.39 1pra s PRO 42 N 1.99 1.41 0.19 5.12 0.04 -1.26 -5.00 135.00 137.48 1pra s PRO 42 Ca 0.04 0.06 -0.10 0.00 0.04 0.00 0.00 61.00 61.03 1pra s PRO 42 Cb -0.16 -1.89 0.11 0.00 0.04 0.00 0.00 34.50 32.60 1pra s PRO 42 CO -0.19 -1.97 1.77 0.07 0.04 0.00 0.00 177.00 176.72 1pra h ARG 43 N -1.33 0.99 -0.80 4.56 0.11 -2.03 -3.11 114.38 112.77 1pra h ARG 43 Ca -0.47 -0.16 0.00 0.00 0.10 0.00 0.00 59.98 59.45 1pra h ARG 43 Cb 1.31 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 32.22 1pra h ARG 43 CO 0.59 0.80 0.00 1.97 0.10 0.00 0.00 179.97 183.43 1pra n PHE 44 N -4.43 0.98 -0.04 4.08 1.16 -1.26 -4.47 117.46 113.48 1pra n PHE 44 Ca 0.05 -0.34 -0.08 0.00 -1.87 0.00 0.00 57.45 55.21 1pra n PHE 44 Cb 0.14 -0.29 -0.02 0.00 -1.61 0.00 0.00 39.48 37.70 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 1.88 -0.09 -0.40 5.98 7.12 -1.94 0.12 115.31 127.99 1pra h LEU 45 Ca 0.00 0.05 -0.01 0.00 0.13 0.00 0.00 57.88 58.04 1pra h LEU 45 Cb 1.19 0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 41.39 1pra h LEU 45 CO 0.23 -0.02 0.20 1.55 -0.13 0.00 0.00 178.44 180.28 1pra h PRO 46 N 0.06 0.57 -0.39 5.25 0.13 -1.88 -0.64 132.00 135.11 1pra h PRO 46 Ca 0.10 -0.08 0.07 0.00 -0.87 0.00 0.00 66.00 65.22 1pra h PRO 46 Cb 0.12 -0.11 -0.06 0.00 0.13 0.00 0.00 31.00 31.09 1pra h PRO 46 CO -0.17 0.49 0.01 0.93 -0.23 0.00 0.00 178.00 179.03 1pra h GLU 47 N 0.51 0.11 -0.28 0.86 3.07 -1.79 0.11 114.58 117.18 1pra h GLU 47 Ca 0.14 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.02 1pra h GLU 47 Cb 0.10 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 1pra h GLU 47 CO -0.02 0.07 0.11 1.25 -1.40 0.00 0.00 179.01 179.03 1pra h LEU 48 N 0.12 0.14 0.21 1.33 7.12 -0.58 0.25 115.31 123.90 1pra h LEU 48 Ca 0.19 0.02 0.01 0.00 0.13 0.00 0.00 57.88 58.23 1pra h LEU 48 Cb 0.26 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.36 1pra h LEU 48 CO -0.31 0.12 -0.32 0.00 -0.13 0.00 0.00 178.44 177.80 1pra h ALA 49 N 1.16 -0.60 -0.53 1.25 0.00 0.10 -1.53 119.26 119.12 1pra h ALA 49 Ca 0.12 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1pra h ALA 49 Cb 0.07 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1pra h ALA 49 CO -0.11 -0.88 0.23 0.77 0.00 0.00 0.00 179.25 179.25 1pra h SER 50 N -0.59 0.28 -0.57 0.00 0.02 -0.73 0.16 113.55 112.11 1pra h SER 50 Ca 0.01 0.05 0.10 0.00 -0.84 0.00 0.00 61.79 61.11 1pra h SER 50 Cb 0.58 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.10 1pra h SER 50 CO -0.13 0.19 0.39 0.00 -1.14 0.00 0.00 176.83 176.13 1pra h ALA 51 N 1.33 2.05 0.00 3.77 0.00 0.34 0.23 119.26 126.98 1pra h ALA 51 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1pra h ALA 51 Cb 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1pra h ALA 51 CO -0.22 -0.18 -1.15 1.28 0.00 0.00 0.00 179.25 178.97 1pra n LEU 52 N -4.47 0.59 -2.31 0.00 7.99 -0.66 -5.01 117.00 113.14 1pra n LEU 52 Ca 0.09 -0.09 -0.09 0.00 -0.01 0.00 0.00 56.01 55.91 1pra n LEU 52 Cb 0.38 -0.07 0.05 0.00 -0.11 0.00 0.00 43.42 43.67 1pra n LEU 52 CO 0.34 0.07 0.05 0.61 -1.51 0.00 0.00 177.39 176.95 1pra n GLY 53 N 1.37 -0.02 3.34 -0.72 0.00 0.30 -5.08 105.19 104.39 1pra n GLY 53 Ca 0.01 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.19 0.85 0.27 1.61 -7.23 0.22 -5.00 120.40 107.93 1pra s VAL 54 Ca 0.04 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 1pra s VAL 54 Cb -0.01 -2.54 -0.08 0.00 0.56 0.00 0.00 36.38 34.31 1pra s VAL 54 CO 0.39 -0.14 0.70 -0.94 -0.31 0.00 0.00 175.10 174.80 1pra s SER 55 N -3.34 6.86 0.27 4.85 1.04 -1.26 -3.86 113.70 118.26 1pra s SER 55 Ca 0.34 1.28 -0.00 0.00 0.48 0.00 0.00 55.95 58.04 1pra s SER 55 Cb 0.07 -2.37 0.62 0.00 0.10 0.00 0.00 66.02 64.45 1pra s SER 55 CO 0.12 -0.09 1.66 0.58 0.98 0.00 0.00 173.24 176.48 1pra h VAL 56 N 2.29 0.37 -0.93 5.02 2.07 -1.92 0.06 116.25 123.21 1pra h VAL 56 Ca -0.48 -0.08 0.18 0.00 0.82 0.00 0.00 66.70 67.15 1pra h VAL 56 Cb 1.18 0.13 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 1pra h VAL 56 CO 0.66 0.04 0.60 0.44 0.02 0.00 0.00 177.57 179.32 1pra h ASP 57 N 0.23 0.57 0.10 0.57 5.19 -1.97 0.31 116.42 121.42 1pra h ASP 57 Ca 0.51 0.05 -0.29 0.00 -0.62 0.00 0.00 57.03 56.68 1pra h ASP 57 Cb 0.97 -0.05 0.03 0.00 0.18 0.00 0.00 39.33 40.45 1pra h ASP 57 CO -0.62 0.24 -1.21 -0.25 -3.12 0.00 0.00 179.24 174.29 1pra h TRP 58 N 0.58 1.03 -0.20 4.55 7.01 -1.34 0.11 115.95 127.69 1pra h TRP 58 Ca 0.49 -0.63 -0.06 0.00 2.11 0.00 0.00 58.89 60.80 1pra h TRP 58 Cb 0.97 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1pra h TRP 58 CO -0.00 1.47 -0.14 -0.07 -2.79 0.00 0.00 178.44 176.91 1pra h LEU 59 N 0.29 0.31 0.00 0.65 3.38 -0.84 0.70 115.31 119.80 1pra h LEU 59 Ca -0.18 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1pra h LEU 59 Cb 1.88 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.55 1pra h LEU 59 CO 0.23 0.47 0.00 0.18 0.09 0.00 0.00 178.44 179.42 1pra n LEU 60 N -4.24 0.00 -1.83 1.67 4.77 0.98 -4.87 117.00 113.49 1pra n LEU 60 Ca -0.00 0.82 -0.04 0.00 -0.03 0.00 0.00 56.01 56.76 1pra n LEU 60 Cb 0.29 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1pra n LEU 60 CO 0.39 -0.32 0.44 0.59 -1.33 0.00 0.00 177.39 177.15 1pra n ASN 61 N -1.51 -0.95 0.06 -1.43 3.02 0.39 -4.99 115.26 109.85 1pra n ASN 61 Ca 0.00 -2.09 0.12 0.00 -0.03 0.00 0.00 54.58 52.58 1pra n ASN 61 Cb 0.00 0.39 0.17 0.00 -0.61 0.00 0.00 39.78 39.73 1pra n ASN 61 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1pra h GLY 62 N 0.61 0.00 0.00 7.41 0.00 -0.97 -3.48 103.07 106.65 1pra h GLY 62 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1pra h GLY 62 CO -0.20 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.04 1pra n THR 63 N -2.12 0.00 -3.59 4.70 -2.24 -1.26 -4.58 114.28 105.19 1pra n THR 63 Ca 0.03 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.82 1pra n THR 63 Cb 0.44 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.61 1pra n THR 63 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1pra s SER 64 N -1.09 -0.20 0.26 3.42 0.15 -1.26 -4.98 113.70 109.99 1pra s SER 64 Ca 0.00 0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.97 1pra s SER 64 Cb 0.00 1.11 0.00 0.00 -1.71 0.00 0.00 66.02 65.42 1pra s SER 64 CO 0.00 -0.05 0.00 -0.67 1.20 0.00 0.00 173.24 173.72 1pra n ASP 65 N 3.49 -4.16 -3.60 5.45 -0.08 -1.26 -4.49 116.55 111.91 1pra n ASP 65 Ca -0.16 0.75 -0.40 0.00 -1.51 0.00 0.00 54.79 53.46 1pra n ASP 65 Cb 0.56 -1.76 -0.03 0.00 2.34 0.00 0.00 41.12 42.23 1pra n ASP 65 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1pra n SER 66 N -1.58 3.71 -1.67 1.67 7.64 -1.26 -3.92 113.62 118.21 1pra n SER 66 Ca 0.00 -2.70 -0.00 0.00 1.01 0.00 0.00 58.87 57.18 1pra n SER 66 Cb 0.13 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 61.98 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 6.35 -2.68 -4.69 6.43 2.85 -1.26 -4.57 115.26 117.69 1pra n ASN 67 Ca 0.52 0.02 -0.31 0.00 -0.11 0.00 0.00 54.58 54.70 1pra n ASN 67 Cb 0.36 -1.50 0.15 0.00 1.24 0.00 0.00 39.78 40.03 1pra n ASN 67 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1pra s VAL 68 N -2.17 2.19 0.00 3.44 0.11 -1.25 -5.08 120.40 117.64 1pra s VAL 68 Ca 0.01 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 1pra s VAL 68 Cb -0.00 -2.19 0.00 0.00 -1.53 0.00 0.00 36.38 32.66 1pra s VAL 68 CO 0.09 -0.08 0.00 -1.14 -3.33 0.00 0.00 175.10 170.64