#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bd1 s ASN 2 N 0.00 4.48 0.37 6.12 3.84 -1.26 -4.98 114.94 123.51 3bd1 s ASN 2 Ca 0.00 -2.30 0.04 0.00 0.21 0.00 0.00 52.86 50.81 3bd1 s ASN 2 Cb 0.00 -1.47 0.70 0.00 -0.55 0.00 0.00 41.25 39.92 3bd1 s ASN 2 CO 0.00 -0.35 2.01 0.00 -2.79 0.00 0.00 177.10 175.98 3bd1 h ALA 3 N 7.38 1.58 -0.67 1.71 0.00 -1.97 -1.49 119.26 125.79 3bd1 h ALA 3 Ca -0.06 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3bd1 h ALA 3 Cb 0.98 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3bd1 h ALA 3 CO 0.55 0.38 0.14 0.82 0.00 0.00 0.00 179.25 181.14 3bd1 h ILE 4 N 0.74 1.26 -0.52 0.00 2.04 -1.93 -0.88 117.51 118.22 3bd1 h ILE 4 Ca 0.20 -0.98 -0.09 0.00 1.00 0.00 0.00 64.86 64.99 3bd1 h ILE 4 Cb -0.05 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 3bd1 h ILE 4 CO -0.04 0.37 -0.05 0.44 0.00 0.00 0.00 178.15 178.87 3bd1 h ASP 5 N 1.00 0.90 -0.67 1.72 3.32 -1.77 -0.23 116.42 120.69 3bd1 h ASP 5 Ca 0.21 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3bd1 h ASP 5 Cb 0.39 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 3bd1 h ASP 5 CO 0.01 0.99 0.41 0.40 -1.72 0.00 0.00 179.24 179.33 3bd1 h ILE 6 N 0.84 1.19 -0.49 0.35 2.04 -1.01 -0.37 117.51 120.06 3bd1 h ILE 6 Ca 0.15 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 3bd1 h ILE 6 Cb 0.57 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3bd1 h ILE 6 CO 0.03 0.20 0.25 0.00 0.00 0.00 0.00 178.15 178.63 3bd1 h ALA 7 N 1.21 0.63 -0.55 1.87 0.00 -0.80 -0.37 119.26 121.26 3bd1 h ALA 7 Ca 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3bd1 h ALA 7 Cb -0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3bd1 h ALA 7 CO -0.05 0.18 0.34 0.82 0.00 0.00 0.00 179.25 180.55 3bd1 h ILE 8 N 0.65 1.16 -0.09 0.00 2.04 -0.75 -2.43 117.51 118.09 3bd1 h ILE 8 Ca 0.17 -0.33 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 3bd1 h ILE 8 Cb 0.09 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3bd1 h ILE 8 CO -0.02 0.16 -0.36 0.78 0.00 0.00 0.00 178.15 178.70 3bd1 h ASN 9 N 0.74 0.18 -0.38 1.72 2.35 -0.88 0.23 115.58 119.55 3bd1 h ASN 9 Ca 0.20 -0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 3bd1 h ASN 9 Cb -0.04 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 3bd1 h ASN 9 CO -0.04 0.54 0.07 0.50 -1.65 0.00 0.00 177.43 176.85 3bd1 h LYS 10 N 0.15 0.62 -0.00 0.81 1.63 -0.66 -2.71 116.57 116.40 3bd1 h LYS 10 Ca 0.02 -0.16 -0.16 0.00 -0.85 0.00 0.00 60.65 59.49 3bd1 h LYS 10 Cb 0.72 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.25 3bd1 h LYS 10 CO 0.05 0.67 -0.77 -0.07 -3.45 0.00 0.00 179.45 175.88 3bd1 h LEU 11 N 0.47 0.05 0.00 5.20 -0.00 -1.29 -3.48 115.31 116.25 3bd1 h LEU 11 Ca 0.12 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 3bd1 h LEU 11 Cb 0.34 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 3bd1 h LEU 11 CO 0.00 0.80 0.00 0.61 -0.00 0.00 0.00 178.44 179.85 3bd1 n GLY 12 N 0.66 2.06 3.51 0.83 0.00 0.80 -4.83 105.19 108.22 3bd1 n GLY 12 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3bd1 n GLY 12 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bd1 s SER 13 N -1.18 -0.50 0.23 1.61 1.04 -1.05 -4.83 113.70 109.02 3bd1 s SER 13 Ca 0.00 -0.12 -0.08 0.00 0.48 0.00 0.00 55.95 56.23 3bd1 s SER 13 Cb 0.00 0.62 0.23 0.00 0.10 0.00 0.00 66.02 66.96 3bd1 s SER 13 CO 0.00 -1.03 1.90 0.58 0.98 0.00 0.00 173.24 175.67 3bd1 h VAL 14 N 2.00 1.21 -0.69 5.02 2.07 -1.97 -1.42 116.25 122.47 3bd1 h VAL 14 Ca -0.31 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 3bd1 h VAL 14 Cb 1.29 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3bd1 h VAL 14 CO 0.35 0.22 0.42 0.77 0.02 0.00 0.00 177.57 179.35 3bd1 h SER 15 N 1.19 0.82 -0.50 0.57 4.64 -1.96 0.68 113.55 118.99 3bd1 h SER 15 Ca 0.33 -0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 3bd1 h SER 15 Cb -0.11 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.75 3bd1 h SER 15 CO -0.08 0.63 -0.02 0.00 -0.87 0.00 0.00 176.83 176.49 3bd1 h ALA 16 N 1.22 0.68 -0.35 5.18 0.00 -1.82 -0.23 119.26 123.95 3bd1 h ALA 16 Ca 0.25 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3bd1 h ALA 16 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3bd1 h ALA 16 CO -0.05 0.51 0.05 1.25 0.00 0.00 0.00 179.25 181.01 3bd1 h LEU 17 N 0.77 0.56 -0.50 0.00 5.85 -1.03 -0.93 115.31 120.02 3bd1 h LEU 17 Ca 0.14 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.64 3bd1 h LEU 17 Cb 0.55 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3bd1 h LEU 17 CO 0.03 0.68 0.24 0.00 -0.34 0.00 0.00 178.44 179.05 3bd1 h ALA 18 N 0.89 0.64 -0.48 1.25 0.00 -0.72 -1.89 119.26 118.95 3bd1 h ALA 18 Ca 0.10 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3bd1 h ALA 18 Cb 0.37 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3bd1 h ALA 18 CO 0.01 -0.12 0.31 0.00 0.00 0.00 0.00 179.25 179.44 3bd1 h ALA 19 N 1.29 0.61 0.00 0.00 0.00 -0.82 -0.18 119.26 120.15 3bd1 h ALA 19 Ca 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3bd1 h ALA 19 Cb 0.16 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3bd1 h ALA 19 CO -0.18 0.02 -0.07 0.77 0.00 0.00 0.00 179.25 179.80 3bd1 h SER 20 N 0.62 0.00 -0.00 0.00 0.02 -0.54 -2.53 113.55 111.12 3bd1 h SER 20 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3bd1 h SER 20 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 3bd1 h SER 20 CO -0.06 0.07 -0.79 0.18 -1.14 0.00 0.00 176.83 175.09 3bd1 n LEU 21 N -3.45 1.15 -2.10 5.07 4.77 -0.77 -4.98 117.00 116.69 3bd1 n LEU 21 Ca -0.02 -0.56 -0.15 0.00 -0.03 0.00 0.00 56.01 55.25 3bd1 n LEU 21 Cb 0.21 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.33 3bd1 n LEU 21 CO 0.27 0.26 0.02 0.61 -1.33 0.00 0.00 177.39 177.23 3bd1 n GLY 22 N 1.42 -0.08 3.55 -0.72 0.00 -0.18 -5.04 105.19 104.15 3bd1 n GLY 22 Ca 0.05 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 3bd1 n GLY 22 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bd1 s VAL 23 N -2.99 1.82 0.45 1.61 -7.23 -0.61 -5.04 120.40 108.40 3bd1 s VAL 23 Ca 0.22 -2.04 -0.21 0.00 -1.81 0.00 0.00 61.98 58.14 3bd1 s VAL 23 Cb -0.10 -2.85 -0.10 0.00 0.56 0.00 0.00 36.38 33.89 3bd1 s VAL 23 CO 0.28 -0.06 0.98 -0.13 -0.31 0.00 0.00 175.10 175.86 3bd1 s ARG 24 N -3.74 4.09 0.35 4.82 1.81 -1.26 -4.35 118.95 120.67 3bd1 s ARG 24 Ca 0.34 1.21 0.08 0.00 -1.72 0.00 0.00 55.73 55.64 3bd1 s ARG 24 Cb 0.08 -2.17 0.78 0.00 -0.45 0.00 0.00 34.95 33.19 3bd1 s ARG 24 CO 0.17 -0.16 1.87 1.96 -0.68 0.00 0.00 175.30 178.46 3bd1 h GLN 25 N 1.83 0.71 -0.25 3.54 4.20 -1.92 -0.49 115.11 122.73 3bd1 h GLN 25 Ca -0.49 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.19 3bd1 h GLN 25 Cb 1.19 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 3bd1 h GLN 25 CO 0.60 0.47 0.17 0.66 -0.67 0.00 0.00 178.83 180.06 3bd1 h SER 26 N 0.73 0.24 -0.15 1.46 4.64 -1.98 -1.21 113.55 117.30 3bd1 h SER 26 Ca 0.45 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.75 3bd1 h SER 26 Cb 0.66 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 3bd1 h SER 26 CO -0.21 0.17 0.04 0.00 -0.87 0.00 0.00 176.83 175.97 3bd1 h ALA 27 N 1.85 0.19 -0.56 5.18 0.00 -1.46 -0.73 119.26 123.73 3bd1 h ALA 27 Ca 0.10 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3bd1 h ALA 27 Cb 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3bd1 h ALA 27 CO -0.02 -0.19 0.31 0.82 0.00 0.00 0.00 179.25 180.17 3bd1 h ILE 28 N 0.05 0.99 -0.82 0.00 1.08 -1.29 -0.42 117.51 117.10 3bd1 h ILE 28 Ca 0.05 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 3bd1 h ILE 28 Cb 0.23 0.34 -0.04 0.00 -3.07 0.00 0.00 36.82 34.28 3bd1 h ILE 28 CO -0.00 0.11 0.51 0.28 -0.69 0.00 0.00 178.15 178.36 3bd1 h SER 29 N 0.59 0.97 -0.59 1.72 0.02 -1.08 -0.80 113.55 114.38 3bd1 h SER 29 Ca 0.24 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 3bd1 h SER 29 Cb 0.12 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 3bd1 h SER 29 CO -0.15 0.73 0.31 -1.13 -1.14 0.00 0.00 176.83 175.46 3bd1 h ASN 30 N 1.12 0.76 -0.70 3.07 -0.00 -0.63 -0.27 115.58 118.93 3bd1 h ASN 30 Ca 0.30 -0.11 -0.01 0.00 -0.00 0.00 0.00 56.30 56.48 3bd1 h ASN 30 Cb -0.07 -0.19 -0.03 0.00 -0.00 0.00 0.00 38.32 38.02 3bd1 h ASN 30 CO -0.06 0.65 0.40 -0.50 -0.00 0.00 0.00 177.43 177.92 3bd1 h TRP 31 N 0.81 0.95 -0.38 0.67 6.55 -0.50 -1.61 115.95 122.43 3bd1 h TRP 31 Ca 0.21 -0.02 -0.05 0.00 0.95 0.00 0.00 58.89 59.98 3bd1 h TRP 31 Cb 0.07 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 28.05 3bd1 h TRP 31 CO -0.01 0.66 0.03 -0.09 -1.05 0.00 0.00 178.44 177.99 3bd1 h ARG 32 N 0.96 0.65 -0.85 0.49 2.43 -0.94 0.17 114.38 117.29 3bd1 h ARG 32 Ca 0.25 -0.19 0.03 0.00 -0.81 0.00 0.00 59.98 59.26 3bd1 h ARG 32 Cb 0.01 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.44 3bd1 h ARG 32 CO -0.04 0.73 0.55 0.00 -1.51 0.00 0.00 179.97 179.69 3bd1 h ALA 33 N 0.89 1.12 -0.01 2.80 0.00 -0.69 -2.11 119.26 121.26 3bd1 h ALA 33 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3bd1 h ALA 33 Cb 0.42 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3bd1 h ALA 33 CO 0.01 0.39 -0.25 2.89 0.00 0.00 0.00 179.25 182.29 3bd1 n ARG 34 N -4.55 1.02 -2.25 0.00 1.85 -0.64 -4.95 116.66 107.13 3bd1 n ARG 34 Ca 0.10 -0.64 -0.11 0.00 -1.00 0.00 0.00 57.85 56.20 3bd1 n ARG 34 Cb 0.09 -1.49 -0.00 0.00 -1.05 0.00 0.00 32.46 30.01 3bd1 n ARG 34 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3bd1 n GLY 35 N 1.33 -0.08 3.38 2.89 0.00 0.43 -5.00 105.19 108.13 3bd1 n GLY 35 Ca 0.13 -0.41 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 3bd1 n GLY 35 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3bd1 s ARG 36 N -4.61 0.49 0.36 1.61 3.52 -0.17 -5.01 118.95 115.13 3bd1 s ARG 36 Ca 0.01 1.17 -0.18 0.00 -0.13 0.00 0.00 55.73 56.60 3bd1 s ARG 36 Cb -0.01 0.54 -0.10 0.00 -1.56 0.00 0.00 34.95 33.82 3bd1 s ARG 36 CO 0.02 -0.34 0.84 0.14 -0.81 0.00 0.00 175.30 175.14 3bd1 s VAL 37 N 2.78 4.52 0.39 7.11 -7.23 -1.26 -4.56 120.40 122.16 3bd1 s VAL 37 Ca 0.02 1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 61.17 3bd1 s VAL 37 Cb -0.13 -3.65 -0.10 0.00 0.56 0.00 0.00 36.38 33.06 3bd1 s VAL 37 CO -0.17 -0.19 1.41 -2.65 -0.31 0.00 0.00 175.10 173.18 3bd1 n PRO 38 N -0.33 2.37 -0.27 4.82 -0.02 -1.26 -4.88 135.00 135.43 3bd1 n PRO 38 Ca 0.04 0.83 0.01 0.00 -2.02 0.00 0.00 63.50 62.37 3bd1 n PRO 38 Cb 0.53 -2.56 0.23 0.00 -0.02 0.00 0.00 33.50 31.68 3bd1 n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bd1 h ALA 39 N 2.59 1.46 0.00 3.55 0.00 -2.00 -1.20 119.26 123.66 3bd1 h ALA 39 Ca -0.49 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3bd1 h ALA 39 Cb 1.26 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3bd1 h ALA 39 CO 0.62 0.47 0.00 -0.85 0.00 0.00 0.00 179.25 179.50 3bd1 n GLU 40 N -4.43 0.57 0.00 0.00 0.00 -1.26 -2.36 120.64 113.15 3bd1 n GLU 40 Ca 0.11 0.03 0.08 0.00 0.00 0.00 0.00 57.16 57.37 3bd1 n GLU 40 Cb 0.08 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.04 3bd1 n GLU 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3bd1 n ARG 41 N -1.13 1.61 -0.06 3.44 5.12 -0.46 -4.72 116.66 120.47 3bd1 n ARG 41 Ca 0.15 -0.94 -0.11 0.00 -1.93 0.00 0.00 57.85 55.02 3bd1 n ARG 41 Cb 0.13 -1.26 -0.05 0.00 -1.16 0.00 0.00 32.46 30.12 3bd1 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3bd1 h ILE 43 N 0.13 1.11 -0.67 0.00 2.04 -1.84 -0.10 117.51 118.18 3bd1 h ILE 43 Ca 0.06 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 3bd1 h ILE 43 Cb 0.24 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 3bd1 h ILE 43 CO -0.00 0.20 0.40 0.44 0.00 0.00 0.00 178.15 179.19 3bd1 h ASP 44 N 1.10 0.81 -0.36 1.72 3.32 -1.77 0.24 116.42 121.47 3bd1 h ASP 44 Ca 0.38 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 3bd1 h ASP 44 Cb 0.08 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3bd1 h ASP 44 CO -0.14 0.64 0.04 0.40 -1.72 0.00 0.00 179.24 178.45 3bd1 h ILE 45 N 0.91 1.25 -0.88 0.35 2.04 -0.62 -0.32 117.51 120.24 3bd1 h ILE 45 Ca 0.24 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.29 3bd1 h ILE 45 Cb -0.02 1.11 -0.07 0.00 -0.74 0.00 0.00 36.82 37.11 3bd1 h ILE 45 CO -0.04 0.30 0.54 -0.08 0.00 0.00 0.00 178.15 178.86 3bd1 h GLU 46 N 0.45 0.91 -0.01 2.37 4.81 -0.63 -1.10 114.58 121.38 3bd1 h GLU 46 Ca 0.11 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3bd1 h GLU 46 Cb 0.39 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 3bd1 h GLU 46 CO 0.01 0.60 -0.00 0.00 -0.73 0.00 0.00 179.01 178.89 3bd1 h ARG 47 N 0.94 0.01 0.00 1.92 3.08 -0.54 0.82 114.38 120.61 3bd1 h ARG 47 Ca 0.40 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.39 3bd1 h ARG 47 Cb 0.27 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 3bd1 h ARG 47 CO -0.21 0.43 -0.28 -0.39 -1.07 0.00 0.00 179.97 178.46 3bd1 h VAL 48 N -0.41 0.87 -0.14 2.04 -1.51 -0.92 -1.60 116.25 114.58 3bd1 h VAL 48 Ca 0.00 -1.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.38 3bd1 h VAL 48 Cb 0.43 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 3bd1 h VAL 48 CO 0.00 0.27 0.00 0.35 -1.23 0.00 0.00 177.57 176.96 3bd1 n THR 49 N -3.73 0.18 -2.88 7.19 -2.24 -0.43 -4.92 114.28 107.45 3bd1 n THR 49 Ca -0.01 -0.24 -0.20 0.00 -2.27 0.00 0.00 64.05 61.32 3bd1 n THR 49 Cb 0.38 0.13 0.01 0.00 -2.10 0.00 0.00 70.33 68.75 3bd1 n THR 49 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3bd1 n ASN 50 N -0.03 -5.08 -0.00 3.42 4.05 -0.60 -1.55 115.26 115.46 3bd1 n ASN 50 Ca 0.13 -0.17 -0.00 0.00 0.45 0.00 0.00 54.58 54.99 3bd1 n ASN 50 Cb 0.22 -4.18 -0.00 0.00 1.23 0.00 0.00 39.78 37.04 3bd1 n ASN 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3bd1 n GLY 51 N -1.21 0.48 0.23 8.20 0.00 0.27 -4.91 105.19 108.25 3bd1 n GLY 51 Ca -0.12 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.83 3bd1 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bd1 h ALA 52 N 0.00 1.63 -3.51 4.61 0.00 -1.53 -3.39 119.26 117.07 3bd1 h ALA 52 Ca -0.00 -0.17 -0.49 0.00 0.00 0.00 0.00 54.91 54.25 3bd1 h ALA 52 Cb 0.01 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 17.56 3bd1 h ALA 52 CO 0.00 0.24 -0.80 0.14 0.00 0.00 0.00 179.25 178.82 3bd1 s VAL 53 N -4.55 1.44 0.32 0.00 -7.23 -1.26 -4.97 120.40 104.14 3bd1 s VAL 53 Ca -0.04 -1.46 0.10 0.00 -1.81 0.00 0.00 61.98 58.78 3bd1 s VAL 53 Cb 0.15 -1.35 -0.06 0.00 0.56 0.00 0.00 36.38 35.68 3bd1 s VAL 53 CO 0.69 -0.15 -0.10 0.27 -0.31 0.00 0.00 175.10 175.49 3bd1 s ILE 54 N -1.27 2.42 0.25 -0.62 -4.36 -1.26 -4.26 121.20 112.10 3bd1 s ILE 54 Ca 0.03 -2.21 -0.04 0.00 -0.26 0.00 0.00 60.65 58.17 3bd1 s ILE 54 Cb -0.10 -2.58 0.22 0.00 1.25 0.00 0.00 42.46 41.25 3bd1 s ILE 54 CO 0.03 -0.26 1.77 0.00 0.24 0.00 0.00 174.94 176.72 3bd1 h ARG 56 N 0.63 0.00 0.00 0.00 9.65 -1.86 -0.11 114.38 122.69 3bd1 h ARG 56 Ca 0.41 0.00 -0.21 0.00 -1.10 0.00 0.00 59.98 59.09 3bd1 h ARG 56 Cb 0.52 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 3bd1 h ARG 56 CO -0.32 0.19 -0.89 0.93 2.80 0.00 0.00 179.97 182.68 3bd1 h GLU 57 N 0.00 0.26 -0.01 0.20 5.08 -1.54 -2.87 114.58 115.70 3bd1 h GLU 57 Ca -0.00 -0.28 -0.17 0.00 -1.00 0.00 0.00 59.36 57.91 3bd1 h GLU 57 Cb 0.43 0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.77 3bd1 h GLU 57 CO 0.03 1.00 -0.65 -0.07 -1.00 0.00 0.00 179.01 178.31 3bd1 h LEU 58 N 0.14 0.59 -6.24 1.33 3.38 -0.84 -3.42 115.31 110.25 3bd1 h LEU 58 Ca -0.05 -0.75 -0.56 0.00 0.09 0.00 0.00 57.88 56.60 3bd1 h LEU 58 Cb 1.52 -0.18 -0.37 0.00 0.09 0.00 0.00 40.66 41.73 3bd1 h LEU 58 CO 0.14 1.26 -0.98 0.54 0.09 0.00 0.00 178.44 179.49 3bd1 n ARG 59 N -4.17 0.28 0.27 1.13 5.12 -0.14 -4.66 116.66 114.49 3bd1 n ARG 59 Ca -0.10 -3.12 0.18 0.00 -1.93 0.00 0.00 57.85 52.88 3bd1 n ARG 59 Cb 0.69 -1.59 0.86 0.00 -1.16 0.00 0.00 32.46 31.27 3bd1 n ARG 59 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3bd1 h PRO 60 N 5.33 0.00 0.00 5.56 0.13 -1.72 -0.73 132.00 140.57 3bd1 h PRO 60 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.36 3bd1 h PRO 60 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 3bd1 h PRO 60 CO 0.37 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.74 3bd1 n ASP 61 N -2.92 0.08 -0.05 1.44 5.75 -1.26 -4.14 116.55 115.45 3bd1 n ASP 61 Ca -0.01 0.51 -0.09 0.00 -0.01 0.00 0.00 54.79 55.20 3bd1 n ASP 61 Cb 0.18 -0.53 -0.04 0.00 -1.03 0.00 0.00 41.12 39.70 3bd1 n ASP 61 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3bd1 n VAL 62 N -1.58 0.56 -3.99 2.12 0.31 -0.36 -5.07 118.33 110.31 3bd1 n VAL 62 Ca 0.06 -0.18 -0.24 0.00 -0.01 0.00 0.00 64.34 63.96 3bd1 n VAL 62 Cb 0.29 -1.23 -0.03 0.00 -0.91 0.00 0.00 33.84 31.96 3bd1 n VAL 62 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3bd1 s PHE 63 N -2.19 3.39 0.49 3.52 0.40 -0.70 -5.10 117.98 117.79 3bd1 s PHE 63 Ca -0.14 0.04 -0.02 0.00 -0.60 0.00 0.00 56.93 56.21 3bd1 s PHE 63 Cb 0.04 -1.59 -0.01 0.00 0.51 0.00 0.00 43.02 41.98 3bd1 s PHE 63 CO 0.20 0.50 0.74 0.20 0.70 0.00 0.00 175.22 177.56 3bd1 s GLY 64 N -3.47 1.56 0.00 4.36 0.00 -1.26 -4.77 107.32 103.74 3bd1 s GLY 64 Ca 0.34 -0.88 0.26 0.00 0.00 0.00 0.00 44.72 44.43 3bd1 s GLY 64 CO 0.28 -0.68 1.46 0.00 0.00 0.00 0.00 173.10 174.15