#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 0.62 -0.07 0.44 5.03 -1.92 -0.56 117.51 121.04 1pra h ILE 2 Ca 0.00 -0.06 0.01 0.00 -0.12 0.00 0.00 64.86 64.68 1pra h ILE 2 Cb 0.00 0.42 -0.01 0.00 -3.03 0.00 0.00 36.82 34.20 1pra h ILE 2 CO 0.00 0.03 -0.08 -1.28 -0.68 0.00 0.00 178.15 176.15 1pra h SER 3 N 0.18 -0.26 -0.68 1.72 0.87 -1.86 0.92 113.55 114.43 1pra h SER 3 Ca 0.44 0.04 0.08 0.00 -1.23 0.00 0.00 61.79 61.11 1pra h SER 3 Cb 1.42 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 63.45 1pra h SER 3 CO -0.09 -0.05 0.45 0.77 -0.53 0.00 0.00 176.83 177.38 1pra h SER 4 N -0.04 0.55 0.55 6.23 4.64 -1.47 0.32 113.55 124.32 1pra h SER 4 Ca 0.01 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 1pra h SER 4 Cb 0.08 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1pra h SER 4 CO -0.09 0.34 -0.26 0.03 -0.87 0.00 0.00 176.83 175.98 1pra h ARG 5 N 0.62 -0.71 0.01 4.77 3.08 -0.96 0.15 114.38 121.34 1pra h ARG 5 Ca 0.31 0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.43 1pra h ARG 5 Cb 0.39 0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 1pra h ARG 5 CO -0.10 -0.47 -0.41 0.28 -1.07 0.00 0.00 179.97 178.20 1pra h VAL 6 N -1.03 0.17 0.09 2.04 2.07 -0.60 -1.51 116.25 117.48 1pra h VAL 6 Ca -0.07 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1pra h VAL 6 Cb 0.56 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1pra h VAL 6 CO 0.12 0.00 -0.39 0.50 0.02 0.00 0.00 177.57 177.83 1pra h LYS 7 N -0.57 -0.58 -0.59 1.57 3.64 -0.45 -0.34 116.57 119.25 1pra h LYS 7 Ca 0.05 0.04 0.12 0.00 -1.27 0.00 0.00 60.65 59.59 1pra h LYS 7 Cb 0.64 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 32.50 1pra h LYS 7 CO -0.31 -0.39 0.05 1.03 -2.27 0.00 0.00 179.45 177.57 1pra h SER 8 N -0.60 -0.15 -0.09 4.20 0.87 -0.49 0.15 113.55 117.44 1pra h SER 8 Ca 0.03 0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.66 1pra h SER 8 Cb 0.64 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 1pra h SER 8 CO -0.24 -0.06 -0.13 0.50 -0.53 0.00 0.00 176.83 176.36 1pra h LYS 9 N 0.17 0.43 -0.35 2.24 3.11 -0.73 -1.08 116.57 120.36 1pra h LYS 9 Ca 0.31 -0.12 -0.04 0.00 -2.81 0.00 0.00 60.65 57.99 1pra h LYS 9 Cb 0.49 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.66 1pra h LYS 9 CO -0.46 0.56 0.07 -0.09 -2.81 0.00 0.00 179.45 176.72 1pra h ARG 10 N 0.40 0.58 0.30 1.90 2.43 0.90 -1.52 114.38 119.35 1pra h ARG 10 Ca 0.07 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1pra h ARG 10 Cb 0.48 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1pra h ARG 10 CO 0.03 0.64 -0.28 0.82 -1.51 0.00 0.00 179.97 179.67 1pra h ILE 11 N 0.42 0.41 -0.97 1.20 5.03 -0.26 0.17 117.51 123.51 1pra h ILE 11 Ca 0.11 0.00 0.08 0.00 -0.12 0.00 0.00 64.86 64.93 1pra h ILE 11 Cb 0.33 0.41 -0.07 0.00 -3.03 0.00 0.00 36.82 34.46 1pra h ILE 11 CO 0.00 0.00 0.62 0.06 -0.68 0.00 0.00 178.15 178.16 1pra h GLN 12 N -0.60 1.02 -0.36 2.37 3.07 -1.02 0.16 115.11 119.76 1pra h GLN 12 Ca -0.01 -0.06 -0.06 0.00 0.09 0.00 0.00 58.65 58.60 1pra h GLN 12 Cb 0.54 -0.23 -0.02 0.00 0.08 0.00 0.00 27.48 27.85 1pra h GLN 12 CO -0.05 0.68 -0.05 -0.07 0.09 0.00 0.00 178.83 179.43 1pra h LEU 13 N 1.05 0.55 -0.66 0.06 3.38 -1.03 -3.48 115.31 115.19 1pra h LEU 13 Ca 0.44 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1pra h LEU 13 Cb 0.30 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1pra h LEU 13 CO -0.19 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.61 1pra n GLY 14 N -0.72 0.87 3.33 0.83 0.00 0.57 -5.09 105.19 104.97 1pra n GLY 14 Ca 0.01 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.66 2.48 0.37 0.99 1.43 -0.61 -5.03 118.68 117.64 1pra s LEU 15 Ca 0.00 -0.91 0.07 0.00 -1.03 0.00 0.00 54.13 52.26 1pra s LEU 15 Cb 0.00 -0.74 -0.00 0.00 0.03 0.00 0.00 46.19 45.48 1pra s LEU 15 CO 0.00 -0.10 0.51 0.54 0.23 0.00 0.00 176.35 177.54 1pra s ASN 16 N -2.88 5.85 0.54 2.29 4.22 -1.26 -4.31 114.94 119.38 1pra s ASN 16 Ca 0.17 -0.27 0.24 0.00 -2.14 0.00 0.00 52.86 50.86 1pra s ASN 16 Cb -0.04 -1.02 1.42 0.00 1.28 0.00 0.00 41.25 42.89 1pra s ASN 16 CO 0.06 -0.57 2.06 1.56 -2.04 0.00 0.00 177.10 178.17 1pra h GLN 17 N 0.78 0.00 0.01 3.55 4.20 -1.98 -0.21 115.11 121.45 1pra h GLN 17 Ca -0.44 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.27 1pra h GLN 17 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 1pra h GLN 17 CO 0.50 0.00 -0.00 0.00 -0.67 0.00 0.00 178.83 178.65 1pra h ALA 18 N 1.81 -0.01 -0.65 3.87 0.00 -1.95 0.21 119.26 122.53 1pra h ALA 18 Ca 0.15 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1pra h ALA 18 Cb 0.65 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1pra h ALA 18 CO -0.00 -0.34 0.38 0.93 0.00 0.00 0.00 179.25 180.22 1pra h GLU 19 N -0.35 0.69 0.20 0.00 4.39 -1.76 -0.01 114.58 117.74 1pra h GLU 19 Ca -0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1pra h GLU 19 Cb 0.34 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1pra h GLU 19 CO 0.00 0.46 -0.10 1.25 -1.16 0.00 0.00 179.01 179.46 1pra h LEU 20 N 0.71 -0.23 -0.31 1.33 5.85 -0.98 -0.23 115.31 121.45 1pra h LEU 20 Ca 0.28 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 59.02 1pra h LEU 20 Cb 0.13 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 1pra h LEU 20 CO -0.16 -0.10 -0.19 0.00 -0.34 0.00 0.00 178.44 177.66 1pra h ALA 21 N 0.43 0.03 -0.37 1.25 0.00 -0.25 0.36 119.26 120.71 1pra h ALA 21 Ca -0.03 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1pra h ALA 21 Cb 0.27 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1pra h ALA 21 CO 0.05 -0.58 0.12 -0.56 0.00 0.00 0.00 179.25 178.27 1pra h GLN 22 N -0.15 0.58 0.00 0.00 3.07 -0.92 0.13 115.11 117.82 1pra h GLN 22 Ca 0.16 -0.12 -0.05 0.00 0.09 0.00 0.00 58.65 58.73 1pra h GLN 22 Cb 0.40 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.87 1pra h GLN 22 CO -0.40 0.59 -0.24 1.57 0.09 0.00 0.00 178.83 180.44 1pra h LYS 23 N 0.45 0.00 0.00 0.06 2.10 -0.52 0.09 116.57 118.75 1pra h LYS 23 Ca 0.12 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.69 1pra h LYS 23 Cb 0.25 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.57 1pra h LYS 23 CO -0.00 0.24 -0.37 0.28 -2.00 0.00 0.00 179.45 177.60 1pra h VAL 24 N 0.00 0.84 -1.96 0.07 2.07 0.12 -3.46 116.25 113.94 1pra h VAL 24 Ca -0.00 -1.52 -0.07 0.00 0.82 0.00 0.00 66.70 65.92 1pra h VAL 24 Cb 0.57 1.94 0.03 0.00 -1.52 0.00 0.00 31.29 32.31 1pra h VAL 24 CO 0.03 0.36 -0.13 0.61 0.02 0.00 0.00 177.57 178.46 1pra n GLY 25 N 0.29 0.65 0.00 2.17 0.00 0.23 -4.85 105.19 103.68 1pra n GLY 25 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.83 0.00 -4.82 2.61 5.66 0.13 -5.02 114.28 110.00 1pra n THR 26 Ca -0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 1pra n THR 26 Cb 0.51 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.16 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 -1.26 2.70 0.49 1.09 -4.23 -1.26 -3.80 115.64 109.37 1pra s THR 27 Ca 0.00 -1.09 0.29 0.00 -1.18 0.00 0.00 61.69 59.71 1pra s THR 27 Cb 0.00 -2.09 0.48 0.00 1.34 0.00 0.00 72.50 72.23 1pra s THR 27 CO 0.00 0.43 1.82 -0.61 -0.54 0.00 0.00 174.62 175.72 1pra h GLN 28 N 4.87 0.14 -0.66 3.99 -0.00 -1.89 0.15 115.11 121.71 1pra h GLN 28 Ca -0.47 -0.01 0.14 0.00 -0.00 0.00 0.00 58.65 58.32 1pra h GLN 28 Cb 1.15 -0.03 -0.11 0.00 0.00 0.00 0.00 27.48 28.49 1pra h GLN 28 CO 0.48 0.09 0.01 0.37 0.00 0.00 0.00 178.83 179.78 1pra h GLN 29 N 0.14 0.12 -0.45 1.69 5.75 -1.95 0.27 115.11 120.68 1pra h GLN 29 Ca 0.53 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 58.91 1pra h GLN 29 Cb 1.82 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 30.33 1pra h GLN 29 CO -0.10 0.08 -0.17 0.77 -2.65 0.00 0.00 178.83 176.75 1pra h SER 30 N 0.12 0.88 0.12 -0.69 0.02 -1.12 -0.47 113.55 112.40 1pra h SER 30 Ca 0.35 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1pra h SER 30 Cb 0.58 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1pra h SER 30 CO -0.56 1.04 -0.06 0.40 -1.14 0.00 0.00 176.83 176.51 1pra h ILE 31 N 0.77 0.95 0.27 3.27 1.08 -1.10 -1.46 117.51 121.28 1pra h ILE 31 Ca 0.11 -0.24 0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1pra h ILE 31 Cb 0.70 1.10 -0.03 0.00 -3.07 0.00 0.00 36.82 35.52 1pra h ILE 31 CO 0.05 0.06 -0.36 -0.08 -0.69 0.00 0.00 178.15 177.13 1pra h GLU 32 N -0.27 -0.66 -0.94 2.37 4.81 -0.36 0.16 114.58 119.69 1pra h GLU 32 Ca -0.02 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1pra h GLU 32 Cb 0.22 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 29.68 1pra h GLU 32 CO 0.03 -0.44 0.60 -0.56 -0.73 0.00 0.00 179.01 177.90 1pra h GLN 33 N -0.69 1.06 -0.05 1.92 3.07 -1.06 0.45 115.11 119.82 1pra h GLN 33 Ca -0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 58.65 58.67 1pra h GLN 33 Cb 0.65 -0.24 -0.00 0.00 0.08 0.00 0.00 27.48 27.97 1pra h GLN 33 CO -0.12 0.70 0.03 1.25 0.09 0.00 0.00 178.83 180.78 1pra h LEU 34 N 1.09 0.06 -1.68 0.06 5.85 -1.00 -2.64 115.31 117.05 1pra h LEU 34 Ca 0.41 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1pra h LEU 34 Cb 0.16 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1pra h LEU 34 CO -0.17 0.10 0.00 -0.33 -0.34 0.00 0.00 178.44 177.69 1pra h GLU 35 N 0.01 0.00 0.00 1.25 5.08 0.51 0.25 114.58 121.69 1pra h GLU 35 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1pra h GLU 35 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1pra h GLU 35 CO -0.00 0.00 0.00 -1.71 -1.00 0.00 0.00 179.01 176.30 1pra n ASN 36 N -2.91 0.00 -0.02 1.42 2.85 0.15 -4.11 115.26 112.64 1pra n ASN 36 Ca -0.00 0.25 -0.00 0.00 -0.11 0.00 0.00 54.58 54.72 1pra n ASN 36 Cb 0.23 -0.38 -0.00 0.00 1.24 0.00 0.00 39.78 40.87 1pra n ASN 36 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1pra n GLY 37 N -0.02 0.47 0.18 8.20 0.00 0.89 -4.90 105.19 110.01 1pra n GLY 37 Ca 0.06 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.76 1.23 -3.78 1.61 4.01 -1.21 -4.72 118.16 112.55 1pra n LYS 38 Ca -0.00 -0.35 -0.13 0.00 -0.51 0.00 0.00 58.31 57.32 1pra n LYS 38 Cb 0.04 -1.31 -0.10 0.00 -0.51 0.00 0.00 35.03 33.15 1pra n LYS 38 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1pra s THR 39 N -1.93 0.03 0.00 -0.18 2.01 -1.26 -5.00 115.64 109.31 1pra s THR 39 Ca 0.28 -0.29 0.00 0.00 0.31 0.00 0.00 61.69 61.99 1pra s THR 39 Cb 0.13 -0.50 0.00 0.00 0.01 0.00 0.00 72.50 72.15 1pra s THR 39 CO 0.22 -0.16 0.00 0.29 -0.69 0.00 0.00 174.62 174.28 1pra n LYS 40 N 2.05 0.11 -3.59 4.92 5.02 -1.26 -4.89 118.16 120.52 1pra n LYS 40 Ca -0.18 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.84 1pra n LYS 40 Cb 0.57 -0.99 -0.10 0.00 -0.02 0.00 0.00 35.03 34.49 1pra n LYS 40 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1pra n ARG 41 N -1.48 1.85 -1.83 1.97 3.00 -1.26 -4.78 116.66 114.12 1pra n ARG 41 Ca 0.00 -4.32 -0.32 0.00 -0.00 0.00 0.00 57.85 53.22 1pra n ARG 41 Cb 0.00 -2.11 0.02 0.00 0.00 0.00 0.00 32.46 30.37 1pra n ARG 41 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1pra s PRO 42 N -1.71 3.24 0.24 -0.14 0.04 -1.26 -4.97 135.00 130.44 1pra s PRO 42 Ca 0.33 1.00 -0.06 0.00 0.04 0.00 0.00 61.00 62.31 1pra s PRO 42 Cb 0.06 -2.03 0.24 0.00 0.04 0.00 0.00 34.50 32.82 1pra s PRO 42 CO -0.10 -0.86 1.82 0.07 0.04 0.00 0.00 177.00 177.97 1pra h ARG 43 N -0.16 1.12 -0.98 4.56 0.11 -2.03 -3.00 114.38 114.01 1pra h ARG 43 Ca -0.45 -0.18 -0.17 0.00 0.10 0.00 0.00 59.98 59.27 1pra h ARG 43 Cb 1.21 -0.19 -0.10 0.00 1.11 0.00 0.00 29.97 31.99 1pra h ARG 43 CO 0.58 0.89 0.22 1.97 0.10 0.00 0.00 179.97 183.73 1pra n PHE 44 N -4.30 1.13 -0.03 4.08 1.16 -1.26 -4.44 117.46 113.81 1pra n PHE 44 Ca 0.07 -0.92 -0.12 0.00 -1.87 0.00 0.00 57.45 54.62 1pra n PHE 44 Cb 0.17 -0.48 -0.06 0.00 -1.61 0.00 0.00 39.48 37.49 1pra n PHE 44 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 1pra h LEU 45 N 1.07 -1.35 -0.81 5.98 3.38 -1.92 0.24 115.31 121.90 1pra h LEU 45 Ca 0.21 0.18 -0.08 0.00 0.09 0.00 0.00 57.88 58.28 1pra h LEU 45 Cb 1.63 0.56 -0.02 0.00 0.09 0.00 0.00 40.66 42.92 1pra h LEU 45 CO 0.39 -0.42 -0.02 1.55 0.09 0.00 0.00 178.44 180.04 1pra h PRO 46 N -0.46 0.88 -0.32 1.13 0.13 -1.89 0.22 132.00 131.68 1pra h PRO 46 Ca 0.09 -0.26 -0.11 0.00 -0.87 0.00 0.00 66.00 64.85 1pra h PRO 46 Cb 0.62 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 1pra h PRO 46 CO -0.43 0.89 -0.24 0.93 -0.23 0.00 0.00 178.00 178.91 1pra h GLU 47 N 0.81 0.64 0.04 0.86 5.08 -1.80 0.09 114.58 120.31 1pra h GLU 47 Ca 0.15 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1pra h GLU 47 Cb 0.51 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1pra h GLU 47 CO 0.03 0.82 -0.02 1.25 -1.00 0.00 0.00 179.01 180.09 1pra h LEU 48 N 0.56 -0.05 -0.54 1.33 7.12 -0.31 0.92 115.31 124.34 1pra h LEU 48 Ca 0.08 -0.35 0.11 0.00 0.13 0.00 0.00 57.88 57.85 1pra h LEU 48 Cb 0.71 0.01 -0.10 0.00 -0.53 0.00 0.00 40.66 40.75 1pra h LEU 48 CO 0.05 0.32 -0.14 0.00 -0.13 0.00 0.00 178.44 178.55 1pra h ALA 49 N 0.50 0.36 -0.01 1.25 0.00 -0.61 0.12 119.26 120.87 1pra h ALA 49 Ca -0.01 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pra h ALA 49 Cb 0.39 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1pra h ALA 49 CO 0.01 -0.44 0.00 0.66 0.00 0.00 0.00 179.25 179.49 1pra h SER 50 N -0.00 0.01 -0.51 0.00 4.64 -1.00 0.15 113.55 116.84 1pra h SER 50 Ca 0.26 -0.17 0.10 0.00 -0.47 0.00 0.00 61.79 61.51 1pra h SER 50 Cb 0.40 -0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.40 1pra h SER 50 CO -0.56 0.18 -0.01 0.00 -0.87 0.00 0.00 176.83 175.57 1pra h ALA 51 N 0.83 0.47 0.00 5.18 0.00 0.68 -1.14 119.26 125.29 1pra h ALA 51 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1pra h ALA 51 Cb 0.17 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1pra h ALA 51 CO -0.00 -0.39 -0.32 -0.07 0.00 0.00 0.00 179.25 178.47 1pra h LEU 52 N 0.10 0.00 -2.46 0.00 -0.00 -0.88 -3.49 115.31 108.59 1pra h LEU 52 Ca 0.26 -0.03 -0.13 0.00 -0.00 0.00 0.00 57.88 57.98 1pra h LEU 52 Cb 0.40 0.00 0.11 0.00 -0.00 0.00 0.00 40.66 41.16 1pra h LEU 52 CO -0.44 0.02 -0.45 0.61 -0.00 0.00 0.00 178.44 178.17 1pra n GLY 53 N 1.20 -1.08 3.27 0.83 0.00 0.33 -5.00 105.19 104.73 1pra n GLY 53 Ca 0.03 0.48 -0.11 0.00 0.00 0.00 0.00 46.02 46.42 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 -3.21 0.02 0.25 1.61 -7.23 0.01 -5.02 120.40 106.83 1pra s VAL 54 Ca 0.24 -1.85 -0.10 0.00 -1.81 0.00 0.00 61.98 58.47 1pra s VAL 54 Cb -0.03 -2.34 -0.07 0.00 0.56 0.00 0.00 36.38 34.49 1pra s VAL 54 CO 0.69 -0.08 0.58 -0.94 -0.31 0.00 0.00 175.10 175.03 1pra s SER 55 N -3.11 6.62 0.14 4.85 1.04 -1.26 -4.41 113.70 117.57 1pra s SER 55 Ca 0.33 0.95 -0.14 0.00 0.48 0.00 0.00 55.95 57.56 1pra s SER 55 Cb 0.06 -2.24 0.01 0.00 0.10 0.00 0.00 66.02 63.95 1pra s SER 55 CO 0.09 -0.11 1.65 0.58 0.98 0.00 0.00 173.24 176.43 1pra h VAL 56 N 1.89 1.23 -0.86 5.02 2.07 -1.95 -0.13 116.25 123.53 1pra h VAL 56 Ca -0.47 -0.81 0.22 0.00 0.82 0.00 0.00 66.70 66.47 1pra h VAL 56 Cb 1.17 0.89 -0.14 0.00 -1.52 0.00 0.00 31.29 31.69 1pra h VAL 56 CO 0.68 0.29 0.15 -2.24 0.02 0.00 0.00 177.57 176.47 1pra h ASP 57 N 0.61 -0.14 -0.32 0.57 3.04 -1.99 0.10 116.42 118.28 1pra h ASP 57 Ca 0.14 0.21 -0.14 0.00 -3.24 0.00 0.00 57.03 54.00 1pra h ASP 57 Cb 0.31 0.31 -0.00 0.00 -1.04 0.00 0.00 39.33 38.91 1pra h ASP 57 CO 0.00 -0.19 -0.34 -0.25 -2.04 0.00 0.00 179.24 176.43 1pra h TRP 58 N 0.16 0.96 -0.83 4.15 7.01 -1.70 0.45 115.95 126.15 1pra h TRP 58 Ca 0.52 -0.29 0.10 0.00 2.11 0.00 0.00 58.89 61.33 1pra h TRP 58 Cb 1.03 -0.20 -0.08 0.00 -2.10 0.00 0.00 29.16 27.82 1pra h TRP 58 CO -0.33 1.07 0.47 -0.07 -2.79 0.00 0.00 178.44 176.79 1pra h LEU 59 N 0.57 0.66 0.50 0.65 3.38 0.36 0.67 115.31 122.10 1pra h LEU 59 Ca 0.05 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1pra h LEU 59 Cb 0.92 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1pra h LEU 59 CO 0.08 0.37 -0.24 -0.07 0.09 0.00 0.00 178.44 178.67 1pra h LEU 60 N 0.77 -0.57 0.00 1.67 -0.00 -0.62 -3.41 115.31 113.16 1pra h LEU 60 Ca 0.41 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.31 1pra h LEU 60 Cb 0.40 0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1pra h LEU 60 CO -0.26 -0.34 -0.10 0.78 -0.00 0.00 0.00 178.44 178.52 1pra h ASN 61 N -0.80 0.00 -3.21 -0.43 2.35 -0.85 -3.51 115.58 109.14 1pra h ASN 61 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1pra h ASN 61 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1pra h ASN 61 CO 0.11 0.30 -0.05 0.61 -1.65 0.00 0.00 177.43 176.75 1pra n GLY 62 N 1.81 -0.75 3.21 2.83 0.00 0.23 -5.01 105.19 107.52 1pra n GLY 62 Ca -0.01 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.15 -0.38 0.00 2.61 -4.23 -1.26 -5.07 115.64 106.15 1pra s THR 63 Ca 0.02 0.16 0.00 0.00 -1.18 0.00 0.00 61.69 60.69 1pra s THR 63 Cb -0.01 -0.60 0.00 0.00 1.34 0.00 0.00 72.50 73.24 1pra s THR 63 CO 0.07 0.07 0.00 -1.20 -0.54 0.00 0.00 174.62 173.02 1pra n SER 64 N 4.97 -0.91 -1.79 3.99 7.64 -1.26 -5.03 113.62 121.23 1pra n SER 64 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1pra n SER 64 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1pra n SER 64 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1pra n ASP 65 N -0.39 -8.83 -3.44 6.43 2.03 -1.26 -4.84 116.55 106.24 1pra n ASP 65 Ca 0.00 1.26 -0.14 0.00 0.52 0.00 0.00 54.79 56.43 1pra n ASP 65 Cb 0.00 -4.67 0.01 0.00 -0.72 0.00 0.00 41.12 35.74 1pra n ASP 65 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1pra n SER 66 N 0.78 -6.28 -3.54 1.67 3.41 -1.26 -5.03 113.62 103.37 1pra n SER 66 Ca 0.00 -0.56 -0.04 0.00 -0.26 0.00 0.00 58.87 58.01 1pra n SER 66 Cb 0.00 -3.58 -0.06 0.00 -0.26 0.00 0.00 64.21 60.31 1pra n SER 66 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pra s ASN 67 N -3.06 -0.69 -0.33 4.04 3.84 -1.26 -4.85 114.94 112.63 1pra s ASN 67 Ca 0.06 1.10 -0.08 0.00 0.21 0.00 0.00 52.86 54.15 1pra s ASN 67 Cb -0.02 1.80 0.01 0.00 -0.55 0.00 0.00 41.25 42.49 1pra s ASN 67 CO 0.82 -0.24 0.25 0.52 -2.79 0.00 0.00 177.10 175.66 1pra n VAL 68 N 5.42-10.48 1.48 -5.21 0.31 -1.26 -5.15 118.33 103.43 1pra n VAL 68 Ca -0.08 1.32 0.14 0.00 -0.01 0.00 0.00 64.34 65.71 1pra n VAL 68 Cb 0.50 -6.56 0.51 0.00 -0.91 0.00 0.00 33.84 27.37 1pra n VAL 68 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05