#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 7.07 0.35 6.12 3.84 -1.26 -4.93 114.94 126.13 3bd1 s ASN 2 Ca 0.00 2.28 0.03 0.00 0.21 0.00 0.00 52.86 55.37 3bd1 s ASN 2 Cb 0.00 -2.61 0.66 0.00 -0.55 0.00 0.00 41.25 38.75 3bd1 s ASN 2 CO 0.00 -0.38 2.01 0.00 -2.79 0.00 0.00 177.10 175.94 3bd1 h ALA 3 N 5.05 1.57 -0.56 1.71 0.00 -1.96 -1.73 119.26 123.34 3bd1 h ALA 3 Ca -0.45 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 3bd1 h ALA 3 Cb 1.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3bd1 h ALA 3 CO 0.74 0.39 0.10 0.82 0.00 0.00 0.00 179.25 181.30 3bd1 h ILE 4 N 0.84 1.25 -0.71 0.00 2.04 -1.95 -1.87 117.51 117.11 3bd1 h ILE 4 Ca 0.24 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 3bd1 h ILE 4 Cb -0.06 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 3bd1 h ILE 4 CO -0.05 0.34 0.33 0.44 0.00 0.00 0.00 178.15 179.21 3bd1 h ASP 5 N 0.81 0.92 -0.52 1.72 3.45 -1.74 0.55 116.42 121.61 3bd1 h ASP 5 Ca 0.17 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.53 3bd1 h ASP 5 Cb 0.39 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.90 3bd1 h ASP 5 CO 0.01 0.79 0.33 0.40 -1.57 0.00 0.00 179.24 179.19 3bd1 h ILE 6 N 1.01 1.15 -0.65 0.35 2.04 -1.05 -0.18 117.51 120.18 3bd1 h ILE 6 Ca 0.24 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 3bd1 h ILE 6 Cb 0.12 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 3bd1 h ILE 6 CO -0.03 0.15 0.28 0.00 0.00 0.00 0.00 178.15 178.55 3bd1 h ALA 7 N 1.17 1.26 -0.56 1.87 0.00 -0.42 -1.32 119.26 121.26 3bd1 h ALA 7 Ca 0.19 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3bd1 h ALA 7 Cb -0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3bd1 h ALA 7 CO -0.04 0.55 -0.02 0.82 0.00 0.00 0.00 179.25 180.57 3bd1 h ILE 8 N 0.93 1.26 -0.36 0.00 2.04 -0.51 -1.06 117.51 119.82 3bd1 h ILE 8 Ca 0.22 -1.13 0.07 0.00 1.00 0.00 0.00 64.86 65.02 3bd1 h ILE 8 Cb 0.15 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 37.01 3bd1 h ILE 8 CO -0.02 0.41 -0.07 -1.13 0.00 0.00 0.00 178.15 177.33 3bd1 h ASN 9 N 0.89 -0.30 -0.45 1.72 -0.73 -0.43 0.25 115.58 116.53 3bd1 h ASN 9 Ca 0.16 0.10 -0.14 0.00 1.87 0.00 0.00 56.30 58.29 3bd1 h ASN 9 Cb 0.54 0.21 -0.01 0.00 0.27 0.00 0.00 38.32 39.33 3bd1 h ASN 9 CO 0.03 -0.11 -0.29 0.50 -0.37 0.00 0.00 177.43 177.20 3bd1 h LYS 10 N 0.02 0.98 0.00 6.67 1.63 -0.97 -3.25 116.57 121.65 3bd1 h LYS 10 Ca 0.17 -0.46 -0.12 0.00 -0.85 0.00 0.00 60.65 59.40 3bd1 h LYS 10 Cb 0.26 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 3bd1 h LYS 10 CO -0.36 1.13 -0.86 -0.07 -3.45 0.00 0.00 179.45 175.85 3bd1 h LEU 11 N 0.82 0.00 0.00 5.20 -0.00 -0.99 -3.48 115.31 116.86 3bd1 h LEU 11 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 3bd1 h LEU 11 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.54 3bd1 h LEU 11 CO 0.08 0.49 0.00 0.61 -0.00 0.00 0.00 178.44 179.62 3bd1 n GLY 12 N 1.28 3.13 3.45 0.83 0.00 0.86 -4.74 105.19 110.00 3bd1 n GLY 12 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3bd1 n GLY 12 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3bd1 s SER 13 N -1.12 -0.50 0.20 1.61 0.15 -1.23 -4.96 113.70 107.84 3bd1 s SER 13 Ca 0.00 0.00 -0.09 0.00 0.70 0.00 0.00 55.95 56.56 3bd1 s SER 13 Cb 0.00 0.52 0.12 0.00 -1.71 0.00 0.00 66.02 64.95 3bd1 s SER 13 CO 0.00 -0.85 1.74 0.58 1.20 0.00 0.00 173.24 175.91 3bd1 h VAL 14 N 2.00 1.26 -0.56 4.45 2.07 -1.95 -1.46 116.25 122.07 3bd1 h VAL 14 Ca -0.30 -0.87 -0.11 0.00 0.82 0.00 0.00 66.70 66.24 3bd1 h VAL 14 Cb 1.29 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 3bd1 h VAL 14 CO 0.35 0.34 -0.09 0.77 0.02 0.00 0.00 177.57 178.97 3bd1 h SER 15 N 1.04 1.04 -0.39 0.57 4.64 -1.98 -0.36 113.55 118.11 3bd1 h SER 15 Ca 0.23 -0.34 -0.07 0.00 -0.47 0.00 0.00 61.79 61.14 3bd1 h SER 15 Cb 0.29 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3bd1 h SER 15 CO -0.01 1.14 -0.04 0.00 -0.87 0.00 0.00 176.83 177.05 3bd1 h ALA 16 N 0.96 0.53 -0.18 5.18 0.00 -1.86 0.10 119.26 123.98 3bd1 h ALA 16 Ca 0.15 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3bd1 h ALA 16 Cb 0.65 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3bd1 h ALA 16 CO 0.05 0.34 0.11 1.25 0.00 0.00 0.00 179.25 181.00 3bd1 h LEU 17 N 0.53 0.22 -0.57 0.00 5.85 -1.09 0.06 115.31 120.29 3bd1 h LEU 17 Ca 0.11 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.81 3bd1 h LEU 17 Cb 0.53 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 3bd1 h LEU 17 CO 0.03 0.19 0.36 0.00 -0.34 0.00 0.00 178.44 178.68 3bd1 h ALA 18 N 1.04 0.74 -0.50 1.25 0.00 -0.86 -1.99 119.26 118.94 3bd1 h ALA 18 Ca 0.07 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3bd1 h ALA 18 Cb 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3bd1 h ALA 18 CO -0.01 0.11 -0.02 0.00 0.00 0.00 0.00 179.25 179.33 3bd1 h ALA 19 N 1.23 0.67 -0.74 0.00 0.00 -0.68 0.26 119.26 120.00 3bd1 h ALA 19 Ca 0.22 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 54.91 3bd1 h ALA 19 Cb -0.03 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 3bd1 h ALA 19 CO -0.08 0.50 0.49 0.66 0.00 0.00 0.00 179.25 180.83 3bd1 h SER 20 N 0.75 0.66 0.37 0.00 4.64 -0.60 -2.16 113.55 117.22 3bd1 h SER 20 Ca 0.14 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3bd1 h SER 20 Cb 0.55 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3bd1 h SER 20 CO 0.03 0.42 -0.70 0.18 -0.87 0.00 0.00 176.83 175.89 3bd1 n LEU 21 N -4.49 0.65 -1.72 5.97 4.77 -0.78 -4.98 117.00 116.42 3bd1 n LEU 21 Ca 0.11 -0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 55.86 3bd1 n LEU 21 Cb 0.26 -0.16 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 3bd1 n LEU 21 CO 0.33 0.14 0.04 0.61 -1.33 0.00 0.00 177.39 177.18 3bd1 n GLY 22 N 1.48 0.14 3.45 -0.72 0.00 -0.08 -5.03 105.19 104.42 3bd1 n GLY 22 Ca 0.05 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.94 1.48 0.32 1.61 -7.23 -0.25 -5.03 120.40 108.34 3bd1 s VAL 23 Ca 0.19 -2.06 -0.28 0.00 -1.81 0.00 0.00 61.98 58.02 3bd1 s VAL 23 Cb -0.08 -2.62 -0.09 0.00 0.56 0.00 0.00 36.38 34.14 3bd1 s VAL 23 CO 0.24 -0.17 1.08 -0.13 -0.31 0.00 0.00 175.10 175.81 3bd1 s ARG 24 N -3.79 4.49 0.45 4.82 3.00 -1.26 -4.35 118.95 122.31 3bd1 s ARG 24 Ca 0.32 1.71 0.21 0.00 0.00 0.00 0.00 55.73 57.97 3bd1 s ARG 24 Cb 0.06 -2.99 1.18 0.00 0.00 0.00 0.00 34.95 33.21 3bd1 s ARG 24 CO 0.14 0.10 1.89 1.96 0.00 0.00 0.00 175.30 179.38 3bd1 h GLN 25 N 3.41 0.28 -0.17 3.54 4.20 -1.91 0.32 115.11 124.78 3bd1 h GLN 25 Ca -0.47 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.21 3bd1 h GLN 25 Cb 1.21 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 3bd1 h GLN 25 CO 0.65 0.19 0.04 0.66 -0.67 0.00 0.00 178.83 179.70 3bd1 h SER 26 N 0.29 0.20 -0.00 1.46 4.64 -1.99 -2.16 113.55 116.00 3bd1 h SER 26 Ca 0.42 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.72 3bd1 h SER 26 Cb 1.19 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3bd1 h SER 26 CO -0.12 0.22 0.00 0.00 -0.87 0.00 0.00 176.83 176.06 3bd1 h ALA 27 N 1.81 0.00 -0.50 5.18 0.00 -0.74 0.15 119.26 125.17 3bd1 h ALA 27 Ca 0.06 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3bd1 h ALA 27 Cb 0.10 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3bd1 h ALA 27 CO -0.00 -0.45 0.29 0.82 0.00 0.00 0.00 179.25 179.91 3bd1 h ILE 28 N -0.09 1.04 -0.67 0.00 2.04 -1.31 0.29 117.51 118.82 3bd1 h ILE 28 Ca 0.00 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.70 3bd1 h ILE 28 Cb 0.09 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 3bd1 h ILE 28 CO -0.00 0.11 0.40 -1.28 0.00 0.00 0.00 178.15 177.37 3bd1 h SER 29 N 0.58 0.63 -0.58 1.72 0.87 -1.31 -0.86 113.55 114.59 3bd1 h SER 29 Ca 0.20 0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.69 3bd1 h SER 29 Cb 0.03 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 3bd1 h SER 29 CO -0.10 0.42 0.03 0.78 -0.53 0.00 0.00 176.83 177.43 3bd1 h ASN 30 N 0.76 0.98 -0.51 6.23 2.35 0.48 0.28 115.58 126.15 3bd1 h ASN 30 Ca 0.28 -0.29 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3bd1 h ASN 30 Cb 0.09 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3bd1 h ASN 30 CO -0.14 1.03 0.32 -0.50 -1.65 0.00 0.00 177.43 176.49 3bd1 h TRP 31 N 0.90 0.67 -0.65 1.19 6.55 -0.15 0.52 115.95 124.98 3bd1 h TRP 31 Ca 0.17 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.96 3bd1 h TRP 31 Cb 0.51 -0.22 -0.03 0.00 -0.86 0.00 0.00 29.16 28.56 3bd1 h TRP 31 CO 0.04 0.46 0.23 -0.09 -1.05 0.00 0.00 178.44 178.02 3bd1 h ARG 32 N 0.69 0.99 -0.42 0.49 9.65 -0.89 -1.15 114.38 123.74 3bd1 h ARG 32 Ca 0.19 -0.20 -0.11 0.00 -1.10 0.00 0.00 59.98 58.76 3bd1 h ARG 32 Cb -0.02 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.39 3bd1 h ARG 32 CO -0.04 0.85 -0.17 0.00 2.80 0.00 0.00 179.97 183.42 3bd1 h ALA 33 N 1.09 0.91 0.00 2.80 0.00 -0.45 -2.99 119.26 120.62 3bd1 h ALA 33 Ca 0.21 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3bd1 h ALA 33 Cb 0.26 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3bd1 h ALA 33 CO -0.01 0.62 -0.49 0.07 0.00 0.00 0.00 179.25 179.44 3bd1 h ARG 34 N 0.71 0.00 -1.44 0.00 0.11 -0.83 -3.47 114.38 109.46 3bd1 h ARG 34 Ca 0.11 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.07 3bd1 h ARG 34 Cb 0.68 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.77 3bd1 h ARG 34 CO 0.05 0.00 -0.17 0.41 0.10 0.00 0.00 179.97 180.36 3bd1 n GLY 35 N 1.22 0.27 2.93 0.08 0.00 -0.49 -5.03 105.19 104.16 3bd1 n GLY 35 Ca 0.03 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 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 -4.70 0.36 0.29 1.61 3.52 -0.86 -5.06 118.95 114.12 3bd1 s ARG 36 Ca 0.06 0.55 -0.28 0.00 -0.13 0.00 0.00 55.73 55.93 3bd1 s ARG 36 Cb -0.03 -0.41 -0.09 0.00 -1.56 0.00 0.00 34.95 32.85 3bd1 s ARG 36 CO 0.08 -0.65 1.06 0.08 -0.81 0.00 0.00 175.30 175.05 3bd1 s VAL 37 N 2.56 3.65 0.33 7.11 1.01 -1.26 -4.56 120.40 129.25 3bd1 s VAL 37 Ca 0.13 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.40 3bd1 s VAL 37 Cb -0.15 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.14 3bd1 s VAL 37 CO -0.17 0.32 1.50 -2.65 0.00 0.00 0.00 175.10 174.10 3bd1 n PRO 38 N 1.00 2.59 -0.32 2.72 -0.02 -1.26 -4.86 135.00 134.85 3bd1 n PRO 38 Ca -0.00 0.91 0.11 0.00 -2.02 0.00 0.00 63.50 62.50 3bd1 n PRO 38 Cb 0.46 -2.64 0.32 0.00 -0.02 0.00 0.00 33.50 31.62 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 3.70 1.71 0.00 3.55 0.00 -2.00 -0.18 119.26 126.04 3bd1 h ALA 39 Ca -0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3bd1 h ALA 39 Cb 1.24 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3bd1 h ALA 39 CO 0.70 0.01 0.00 -0.85 0.00 0.00 0.00 179.25 179.12 3bd1 n GLU 40 N -4.63 0.47 0.00 0.00 0.00 -1.26 -2.31 120.64 112.91 3bd1 n GLU 40 Ca 0.20 0.04 0.08 0.00 0.00 0.00 0.00 57.16 57.48 3bd1 n GLU 40 Cb 0.47 -1.50 -0.01 0.00 0.00 0.00 0.00 31.44 30.40 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 -1.20 1.68 -0.12 3.44 5.12 -0.09 -4.69 116.66 120.80 3bd1 n ARG 41 Ca 0.13 -0.76 -0.09 0.00 -1.93 0.00 0.00 57.85 55.21 3bd1 n ARG 41 Cb 0.16 -1.28 -0.01 0.00 -1.16 0.00 0.00 32.46 30.17 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 0.45 1.26 -0.71 0.00 2.04 -1.84 -0.27 117.51 118.44 3bd1 h ILE 43 Ca 0.13 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 3bd1 h ILE 43 Cb 0.10 -0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.06 3bd1 h ILE 43 CO -0.02 0.27 0.37 0.44 0.00 0.00 0.00 178.15 179.21 3bd1 h ASP 44 N 1.31 0.91 -0.36 1.72 3.32 -1.73 0.22 116.42 121.79 3bd1 h ASP 44 Ca 0.34 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 57.18 3bd1 h ASP 44 Cb -0.07 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 3bd1 h ASP 44 CO -0.07 0.76 -0.15 0.40 -1.72 0.00 0.00 179.24 178.46 3bd1 h ILE 45 N 0.98 1.28 -0.84 0.35 2.04 -0.94 0.36 117.51 120.75 3bd1 h ILE 45 Ca 0.25 -1.26 0.07 0.00 1.00 0.00 0.00 64.86 64.91 3bd1 h ILE 45 Cb 0.07 1.33 -0.06 0.00 -0.74 0.00 0.00 36.82 37.42 3bd1 h ILE 45 CO -0.04 0.42 0.51 -0.08 0.00 0.00 0.00 178.15 178.96 3bd1 h GLU 46 N 0.54 0.88 0.19 2.37 4.81 -0.78 -1.45 114.58 121.13 3bd1 h GLU 46 Ca 0.08 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3bd1 h GLU 46 Cb 0.69 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3bd1 h GLU 46 CO 0.05 0.58 -0.09 -0.09 -0.73 0.00 0.00 179.01 178.73 3bd1 h ARG 47 N 0.90 -0.24 0.00 1.92 2.43 -0.68 -0.55 114.38 118.16 3bd1 h ARG 47 Ca 0.38 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.51 3bd1 h ARG 47 Cb 0.22 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 3bd1 h ARG 47 CO -0.19 0.07 -0.24 -0.39 -1.51 0.00 0.00 179.97 177.71 3bd1 h VAL 48 N -0.56 0.68 -0.24 0.20 -1.51 -0.79 -0.49 116.25 113.53 3bd1 h VAL 48 Ca -0.03 -1.04 0.00 0.00 -1.23 0.00 0.00 66.70 64.40 3bd1 h VAL 48 Cb 0.42 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 3bd1 h VAL 48 CO 0.04 0.23 0.00 0.35 -1.23 0.00 0.00 177.57 176.97 3bd1 n THR 49 N -3.55 0.32 -3.24 7.19 -2.24 -0.56 -4.94 114.28 107.26 3bd1 n THR 49 Ca -0.01 -0.37 -0.22 0.00 -2.27 0.00 0.00 64.05 61.18 3bd1 n THR 49 Cb 0.39 0.24 -0.00 0.00 -2.10 0.00 0.00 70.33 68.86 3bd1 n THR 49 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3bd1 n ASN 50 N 0.32 -3.71 0.00 3.42 3.02 -0.19 -1.72 115.26 116.39 3bd1 n ASN 50 Ca 0.13 -0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 3bd1 n ASN 50 Cb 0.28 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.36 3bd1 n ASN 50 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3bd1 n GLY 51 N -1.13 0.90 0.37 7.41 0.00 -0.23 -4.92 105.19 107.59 3bd1 n GLY 51 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 1.77 -3.74 4.61 0.00 -1.60 -3.39 119.26 116.91 3bd1 h ALA 52 Ca 0.00 0.05 -0.47 0.00 0.00 0.00 0.00 54.91 54.49 3bd1 h ALA 52 Cb 0.00 -0.10 -0.24 0.00 0.00 0.00 0.00 17.79 17.44 3bd1 h ALA 52 CO 0.00 -0.08 -0.80 0.54 0.00 0.00 0.00 179.25 178.91 3bd1 s VAL 53 N -5.77 1.23 0.36 0.00 0.11 -1.26 -5.01 120.40 110.06 3bd1 s VAL 53 Ca -0.11 -1.11 0.08 0.00 -2.93 0.00 0.00 61.98 57.92 3bd1 s VAL 53 Cb 0.24 -1.12 -0.06 0.00 -1.53 0.00 0.00 36.38 33.91 3bd1 s VAL 53 CO 0.80 -0.00 0.03 0.27 -3.33 0.00 0.00 175.10 172.86 3bd1 s ILE 54 N -0.92 2.43 0.26 7.04 -4.36 -1.26 -4.27 121.20 120.12 3bd1 s ILE 54 Ca 0.02 -1.96 -0.02 0.00 -0.26 0.00 0.00 60.65 58.44 3bd1 s ILE 54 Cb -0.08 -2.84 0.24 0.00 1.25 0.00 0.00 42.46 41.02 3bd1 s ILE 54 CO 0.02 -0.14 1.78 0.00 0.24 0.00 0.00 174.94 176.84 3bd1 h ARG 56 N 0.70 0.00 -0.04 0.00 3.08 -1.88 0.05 114.38 116.28 3bd1 h ARG 56 Ca 0.44 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.24 3bd1 h ARG 56 Cb 0.56 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.62 3bd1 h ARG 56 CO -0.32 0.19 -0.96 0.93 -1.07 0.00 0.00 179.97 178.74 3bd1 h GLU 57 N 0.00 0.69 -0.12 0.04 5.08 -1.68 -2.75 114.58 115.84 3bd1 h GLU 57 Ca -0.00 -0.68 -0.08 0.00 -1.00 0.00 0.00 59.36 57.59 3bd1 h GLU 57 Cb 0.57 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3bd1 h GLU 57 CO 0.02 1.28 -0.24 -0.07 -1.00 0.00 0.00 179.01 179.00 3bd1 h LEU 58 N 0.41 0.43 -6.06 1.33 3.38 -0.78 -3.41 115.31 110.61 3bd1 h LEU 58 Ca -0.10 -0.56 -0.51 0.00 0.09 0.00 0.00 57.88 56.80 3bd1 h LEU 58 Cb 1.60 -0.12 -0.34 0.00 0.09 0.00 0.00 40.66 41.89 3bd1 h LEU 58 CO 0.19 0.90 -0.91 0.54 0.09 0.00 0.00 178.44 179.25 3bd1 n ARG 59 N -4.46 0.32 0.27 1.13 5.12 -0.05 -4.66 116.66 114.32 3bd1 n ARG 59 Ca -0.07 -2.96 0.13 0.00 -1.93 0.00 0.00 57.85 53.03 3bd1 n ARG 59 Cb 0.44 -1.57 0.78 0.00 -1.16 0.00 0.00 32.46 30.95 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 5.27 0.00 0.00 5.56 0.13 -1.68 -0.43 132.00 140.85 3bd1 h PRO 60 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3bd1 h PRO 60 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 3bd1 h PRO 60 CO 0.32 0.08 0.00 0.38 -0.23 0.00 0.00 178.00 178.56 3bd1 h ASP 61 N 0.00 0.00 0.00 1.44 2.03 -1.93 -3.31 116.42 114.65 3bd1 h ASP 61 Ca -0.00 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 56.02 3bd1 h ASP 61 Cb 0.24 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.69 3bd1 h ASP 61 CO 0.01 0.00 -2.02 0.52 -1.03 0.00 0.00 179.24 176.73 3bd1 n VAL 62 N -2.56 1.01 0.77 4.15 0.31 -0.47 -5.25 118.33 116.29 3bd1 n VAL 62 Ca 0.02 -0.34 0.09 0.00 -0.01 0.00 0.00 64.34 64.09 3bd1 n VAL 62 Cb 0.26 -1.33 0.08 0.00 -0.91 0.00 0.00 33.84 31.94 3bd1 n VAL 62 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00