#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdt s GLN 2 N 0.00 3.20 0.20 3.17 -0.21 -1.26 -0.27 119.66 124.50 2wdt s GLN 2 Ca 0.00 -0.43 0.08 0.00 0.02 0.00 0.00 55.36 55.04 2wdt s GLN 2 Cb 0.00 -2.85 -0.05 0.00 1.00 0.00 0.00 33.01 31.11 2wdt s GLN 2 CO 0.00 0.57 -0.15 0.96 -2.12 0.00 0.00 175.29 174.55 2wdt s ILE 3 N -0.52 1.80 -0.01 1.08 -4.36 -0.72 -0.23 121.20 118.24 2wdt s ILE 3 Ca 0.09 -2.18 0.05 0.00 -0.26 0.00 0.00 60.65 58.35 2wdt s ILE 3 Cb -0.12 -2.03 -0.03 0.00 1.25 0.00 0.00 42.46 41.53 2wdt s ILE 3 CO 0.02 -0.54 -0.17 -0.36 0.24 0.00 0.00 174.94 174.13 2wdt s PHE 4 N -2.80 2.61 -0.17 1.37 0.08 -0.26 -0.61 117.98 118.21 2wdt s PHE 4 Ca 0.22 -0.22 0.01 0.00 0.12 0.00 0.00 56.93 57.06 2wdt s PHE 4 Cb -0.02 -1.55 0.03 0.00 -0.57 0.00 0.00 43.02 40.91 2wdt s PHE 4 CO 0.07 0.19 -0.15 0.08 -0.10 0.00 0.00 175.22 175.31 2wdt s VAL 5 N -0.80 1.75 -0.16 -0.44 1.01 0.14 -0.35 120.40 121.55 2wdt s VAL 5 Ca 0.13 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 2wdt s VAL 5 Cb -0.11 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 2wdt s VAL 5 CO 0.02 0.43 0.30 -0.54 0.00 0.00 0.00 175.10 175.31 2wdt s LYS 6 N 1.40 4.25 0.47 2.72 -0.14 0.69 -0.24 119.74 128.89 2wdt s LYS 6 Ca 0.04 0.11 0.03 0.00 -1.36 0.00 0.00 55.97 54.78 2wdt s LYS 6 Cb -0.14 -3.42 0.01 0.00 -1.68 0.00 0.00 37.83 32.60 2wdt s LYS 6 CO -0.11 0.24 0.67 0.95 -0.76 0.00 0.00 175.35 176.34 2wdt s THR 7 N 0.45 3.30 0.37 2.17 -4.23 -0.19 -0.59 115.64 116.92 2wdt s THR 7 Ca 0.17 -0.72 0.08 0.00 -1.18 0.00 0.00 61.69 60.04 2wdt s THR 7 Cb -0.13 -3.19 0.30 0.00 1.34 0.00 0.00 72.50 70.82 2wdt s THR 7 CO 0.04 -0.12 1.95 0.25 -0.54 0.00 0.00 174.62 176.20 2wdt h LEU 8 N 0.37 0.62 0.00 4.79 6.46 -1.89 -1.24 115.31 124.41 2wdt h LEU 8 Ca -0.43 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.34 2wdt h LEU 8 Cb 1.28 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 2wdt h LEU 8 CO 0.52 0.38 0.00 0.35 -0.62 0.00 0.00 178.44 179.08 2wdt n THR 9 N -4.49 0.50 -0.45 1.05 -2.24 -1.26 -4.87 114.28 102.52 2wdt n THR 9 Ca 0.12 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2wdt n THR 9 Cb 0.29 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 2wdt n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wdt n GLY 10 N 0.46 0.75 3.78 3.38 0.00 -0.47 -5.06 105.19 108.03 2wdt n GLY 10 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 2wdt n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wdt s LYS 11 N -0.55 4.28 -0.24 1.61 2.20 -1.26 -4.84 119.74 120.94 2wdt s LYS 11 Ca 0.00 1.55 -0.04 0.00 -0.36 0.00 0.00 55.97 57.12 2wdt s LYS 11 Cb 0.00 -2.68 0.01 0.00 -1.51 0.00 0.00 37.83 33.65 2wdt s LYS 11 CO 0.00 -0.04 -0.03 0.99 -0.36 0.00 0.00 175.35 175.91 2wdt s THR 12 N -1.56 3.28 -0.10 3.43 2.01 -1.26 -1.02 115.64 120.42 2wdt s THR 12 Ca 0.55 -0.73 -0.18 0.00 0.31 0.00 0.00 61.69 61.64 2wdt s THR 12 Cb -0.24 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 2wdt s THR 12 CO 0.30 0.28 0.49 -0.63 -0.69 0.00 0.00 174.62 174.36 2wdt s ILE 13 N 1.43 5.15 -0.19 1.82 1.01 0.67 -4.91 121.20 126.18 2wdt s ILE 13 Ca 0.03 0.98 -0.11 0.00 0.00 0.00 0.00 60.65 61.55 2wdt s ILE 13 Cb -0.16 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 2wdt s ILE 13 CO -0.03 0.35 0.19 -0.89 0.00 0.00 0.00 174.94 174.56 2wdt s THR 14 N 0.45 5.37 0.12 2.92 2.01 -1.26 0.24 115.64 125.49 2wdt s THR 14 Ca 0.26 0.32 0.10 0.00 0.31 0.00 0.00 61.69 62.68 2wdt s THR 14 Cb -0.15 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 2wdt s THR 14 CO 0.11 0.41 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.46 2wdt s LEU 15 N 0.48 2.33 -0.24 4.42 1.43 0.22 -5.00 118.68 122.31 2wdt s LEU 15 Ca 0.11 -0.74 -0.08 0.00 -1.03 0.00 0.00 54.13 52.39 2wdt s LEU 15 Cb -0.12 -1.05 -0.04 0.00 0.03 0.00 0.00 46.19 45.02 2wdt s LEU 15 CO 0.01 0.11 0.09 -1.61 0.23 0.00 0.00 176.35 175.18 2wdt s GLU 16 N -2.08 3.78 0.11 1.70 0.41 -1.26 -1.76 118.70 119.60 2wdt s GLU 16 Ca 0.11 -0.42 -0.01 0.00 -0.41 0.00 0.00 54.97 54.24 2wdt s GLU 16 Cb -0.10 -3.37 -0.04 0.00 -1.78 0.00 0.00 34.13 28.85 2wdt s GLU 16 CO 0.06 -0.10 0.05 0.14 -0.49 0.00 0.00 175.26 174.92 2wdt s VAL 17 N 1.40 0.13 0.15 2.63 -7.23 0.63 -4.94 120.40 113.17 2wdt s VAL 17 Ca 0.06 -1.86 0.09 0.00 -1.81 0.00 0.00 61.98 58.46 2wdt s VAL 17 Cb -0.15 -1.91 -0.04 0.00 0.56 0.00 0.00 36.38 34.84 2wdt s VAL 17 CO 0.05 -0.58 -0.15 -1.61 -0.31 0.00 0.00 175.10 172.49 2wdt s GLU 18 N -4.01 1.86 0.53 4.82 0.41 -1.26 0.91 118.70 121.95 2wdt s GLU 18 Ca 0.20 -1.26 0.32 0.00 -0.41 0.00 0.00 54.97 53.81 2wdt s GLU 18 Cb 0.07 -2.10 1.46 0.00 -1.78 0.00 0.00 34.13 31.79 2wdt s GLU 18 CO -0.01 0.45 1.86 -1.35 -0.49 0.00 0.00 175.26 175.72 2wdt h PRO 19 N 3.34 0.04 0.00 0.39 0.11 -1.95 -0.84 132.00 133.08 2wdt h PRO 19 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wdt h PRO 19 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wdt h PRO 19 CO 0.50 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.18 2wdt n SER 20 N -4.28 0.00 -4.77 -2.05 3.41 -1.26 -0.73 113.62 103.95 2wdt n SER 20 Ca 0.21 0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 58.63 2wdt n SER 20 Cb 1.02 -0.40 -0.02 0.00 -0.26 0.00 0.00 64.21 64.55 2wdt n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2wdt s ASP 21 N -2.80 6.73 0.60 4.04 1.01 -0.32 -4.81 116.67 121.11 2wdt s ASP 21 Ca 0.19 2.73 -0.08 0.00 0.71 0.00 0.00 52.55 56.10 2wdt s ASP 21 Cb 0.18 -2.65 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 2wdt s ASP 21 CO 0.45 -0.57 0.94 0.42 0.21 0.00 0.00 175.17 176.63 2wdt s THR 22 N -1.13 4.11 0.33 -1.27 -4.23 -1.26 -1.02 115.64 111.16 2wdt s THR 22 Ca 0.49 0.32 0.01 0.00 -1.18 0.00 0.00 61.69 61.33 2wdt s THR 22 Cb -0.40 -3.63 0.27 0.00 1.34 0.00 0.00 72.50 70.07 2wdt s THR 22 CO 0.54 -0.72 1.97 0.40 -0.54 0.00 0.00 174.62 176.27 2wdt h ILE 23 N -0.21 1.14 -0.29 2.99 1.08 -0.98 -1.68 117.51 119.55 2wdt h ILE 23 Ca -0.45 -0.33 0.06 0.00 -0.39 0.00 0.00 64.86 63.75 2wdt h ILE 23 Cb 1.23 0.10 -0.06 0.00 -3.07 0.00 0.00 36.82 35.02 2wdt h ILE 23 CO 0.62 0.17 -0.09 -0.33 -0.69 0.00 0.00 178.15 177.83 2wdt h GLU 24 N 0.95 -0.03 -0.68 2.37 5.08 -1.79 -1.08 114.58 119.41 2wdt h GLU 24 Ca 0.30 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.70 2wdt h GLU 24 Cb 0.01 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 2wdt h GLU 24 CO -0.08 -0.02 0.40 -0.91 -1.00 0.00 0.00 179.01 177.40 2wdt h ASN 25 N -0.03 0.63 -0.45 1.42 4.21 -1.70 -0.44 115.58 119.23 2wdt h ASN 25 Ca 0.14 0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.66 2wdt h ASN 25 Cb 0.25 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 2wdt h ASN 25 CO -0.32 0.43 0.25 0.58 -1.29 0.00 0.00 177.43 177.08 2wdt h VAL 26 N 0.77 1.15 -0.95 2.81 2.07 -1.01 -1.52 116.25 119.57 2wdt h VAL 26 Ca 0.29 -0.38 0.01 0.00 0.82 0.00 0.00 66.70 67.43 2wdt h VAL 26 Cb 0.10 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 2wdt h VAL 26 CO -0.14 0.16 0.63 0.11 0.02 0.00 0.00 177.57 178.35 2wdt h LYS 27 N 0.59 1.25 -0.22 1.57 1.57 -0.76 -2.00 116.57 118.58 2wdt h LYS 27 Ca 0.16 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2wdt h LYS 27 Cb 0.04 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.05 2wdt h LYS 27 CO -0.03 0.83 -0.05 0.00 -0.57 0.00 0.00 179.45 179.64 2wdt h ALA 28 N 1.40 1.52 -0.21 3.86 0.00 -0.72 -1.92 119.26 123.20 2wdt h ALA 28 Ca 0.35 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 2wdt h ALA 28 Cb -0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2wdt h ALA 28 CO -0.07 0.35 -0.46 0.87 0.00 0.00 0.00 179.25 179.93 2wdt h LYS 29 N 0.32 0.53 -0.34 0.00 1.57 -0.59 -2.00 116.57 116.07 2wdt h LYS 29 Ca 0.07 -0.29 -0.12 0.00 -1.87 0.00 0.00 60.65 58.43 2wdt h LYS 29 Cb 0.30 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2wdt h LYS 29 CO 0.01 0.88 -0.29 0.82 -0.57 0.00 0.00 179.45 180.31 2wdt h ILE 30 N 0.43 1.28 -0.50 1.86 2.04 -1.11 -1.73 117.51 119.78 2wdt h ILE 30 Ca 0.03 -1.41 -0.07 0.00 1.00 0.00 0.00 64.86 64.40 2wdt h ILE 30 Cb 0.97 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 2wdt h ILE 30 CO 0.09 0.46 0.04 -0.61 0.00 0.00 0.00 178.15 178.13 2wdt h GLN 31 N 0.61 0.85 -0.81 2.37 4.15 -1.21 0.29 115.11 121.37 2wdt h GLN 31 Ca 0.07 -0.25 0.07 0.00 0.77 0.00 0.00 58.65 59.31 2wdt h GLN 31 Cb 0.80 -0.09 -0.06 0.00 0.21 0.00 0.00 27.48 28.34 2wdt h GLN 31 CO 0.07 0.87 0.48 -0.44 -1.93 0.00 0.00 178.83 177.87 2wdt h ASP 32 N 0.72 0.72 -0.00 -0.69 3.32 -1.21 0.27 116.42 119.55 2wdt h ASP 32 Ca 0.14 0.03 -0.26 0.00 0.02 0.00 0.00 57.03 56.97 2wdt h ASP 32 Cb 0.46 -0.11 0.02 0.00 0.22 0.00 0.00 39.33 39.92 2wdt h ASP 32 CO 0.02 0.44 -1.00 0.50 -1.72 0.00 0.00 179.24 177.48 2wdt h LYS 33 N 0.84 0.68 0.00 3.56 1.63 -1.06 -3.41 116.57 118.81 2wdt h LYS 33 Ca 0.37 -0.73 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 2wdt h LYS 33 Cb 0.25 0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 2wdt h LYS 33 CO -0.20 1.31 0.00 0.39 -3.45 0.00 0.00 179.45 177.49 2wdt n GLU 34 N -3.90 1.90 -0.99 1.90 -0.58 0.10 -5.04 120.64 114.03 2wdt n GLU 34 Ca -0.11 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.51 2wdt n GLU 34 Cb 0.86 -0.50 0.00 0.00 -0.57 0.00 0.00 31.44 31.23 2wdt n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wdt n GLY 35 N 0.31 0.57 3.66 0.62 0.00 0.95 -4.98 105.19 106.32 2wdt n GLY 35 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2wdt n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wdt s ILE 36 N -2.37 5.00 0.35 -0.61 1.01 -1.26 -4.99 121.20 118.33 2wdt s ILE 36 Ca 0.00 1.24 -0.28 0.00 0.00 0.00 0.00 60.65 61.61 2wdt s ILE 36 Cb 0.00 -3.97 -0.11 0.00 0.01 0.00 0.00 42.46 38.40 2wdt s ILE 36 CO 0.00 0.10 1.38 -2.16 0.00 0.00 0.00 174.94 174.26 2wdt s PRO 37 N 1.96 4.24 0.41 2.79 0.04 -1.26 -4.03 135.00 139.15 2wdt s PRO 37 Ca 0.30 2.36 0.17 0.00 0.04 0.00 0.00 61.00 63.88 2wdt s PRO 37 Cb -0.16 -3.01 1.07 0.00 0.04 0.00 0.00 34.50 32.44 2wdt s PRO 37 CO 0.10 -0.35 1.85 -1.35 0.04 0.00 0.00 177.00 177.30 2wdt h PRO 38 N 3.19 0.41 0.00 0.56 0.11 -1.95 -1.64 132.00 132.67 2wdt h PRO 38 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2wdt h PRO 38 Cb 1.23 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2wdt h PRO 38 CO 0.65 0.27 -0.04 0.38 -0.21 0.00 0.00 178.00 179.05 2wdt h ASP 39 N 0.42 0.00 0.42 -2.05 3.04 -1.98 -1.71 116.42 114.57 2wdt h ASP 39 Ca 0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.27 2wdt h ASP 39 Cb 1.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 2wdt h ASP 39 CO -0.19 0.04 -0.32 0.00 -2.04 0.00 0.00 179.24 176.73 2wdt n GLN 40 N -3.25 0.40 -3.70 4.15 6.02 -0.62 -4.88 117.38 115.50 2wdt n GLN 40 Ca -0.01 -0.21 -0.37 0.00 -0.01 0.00 0.00 57.00 56.40 2wdt n GLN 40 Cb 0.21 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.91 2wdt n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2wdt s GLN 41 N -2.75 3.88 -0.08 -1.09 -0.21 -0.64 -0.16 119.66 118.61 2wdt s GLN 41 Ca 0.18 -0.01 0.03 0.00 0.02 0.00 0.00 55.36 55.59 2wdt s GLN 41 Cb 0.19 -3.30 0.01 0.00 1.00 0.00 0.00 33.01 30.90 2wdt s GLN 41 CO 0.59 0.53 -0.18 1.03 -2.12 0.00 0.00 175.29 175.14 2wdt s ARG 42 N -0.36 2.31 -0.13 2.91 1.81 0.08 -4.95 118.95 120.62 2wdt s ARG 42 Ca 0.15 -0.63 -0.03 0.00 -1.72 0.00 0.00 55.73 53.50 2wdt s ARG 42 Cb -0.13 -1.81 -0.03 0.00 -0.45 0.00 0.00 34.95 32.53 2wdt s ARG 42 CO 0.04 0.11 -0.04 -0.51 -0.68 0.00 0.00 175.30 174.22 2wdt s LEU 43 N 0.48 3.24 0.00 2.53 1.43 -1.26 -0.27 118.68 124.83 2wdt s LEU 43 Ca -0.16 -0.09 0.08 0.00 -1.03 0.00 0.00 54.13 52.93 2wdt s LEU 43 Cb -0.16 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 2wdt s LEU 43 CO 0.06 0.22 -0.25 -0.63 0.23 0.00 0.00 176.35 175.98 2wdt s ILE 44 N 0.04 2.02 -0.09 -0.59 1.09 0.06 -0.59 121.20 123.14 2wdt s ILE 44 Ca -0.00 -1.17 -0.05 0.00 -1.10 0.00 0.00 60.65 58.33 2wdt s ILE 44 Cb -0.13 -1.69 0.04 0.00 -1.06 0.00 0.00 42.46 39.62 2wdt s ILE 44 CO 0.03 0.49 0.22 0.12 -0.10 0.00 0.00 174.94 175.70 2wdt s PHE 45 N -0.66 -0.28 -1.54 3.97 5.36 -0.09 -1.22 117.98 123.52 2wdt s PHE 45 Ca 0.10 0.70 -0.05 0.00 -0.96 0.00 0.00 56.93 56.72 2wdt s PHE 45 Cb -0.10 0.02 0.01 0.00 -0.34 0.00 0.00 43.02 42.62 2wdt s PHE 45 CO -0.00 -0.21 0.57 0.00 -1.46 0.00 0.00 175.22 174.12 2wdt n ALA 46 N 4.09 -0.97 -0.76 11.12 0.00 -1.26 -0.81 120.51 131.92 2wdt n ALA 46 Ca -0.24 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2wdt n ALA 46 Cb 0.53 -3.70 0.00 0.00 0.00 0.00 0.00 19.45 16.28 2wdt n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdt n GLY 47 N -1.47 0.32 3.72 0.00 0.00 -1.26 -4.99 105.19 101.50 2wdt n GLY 47 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2wdt n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wdt s LYS 48 N -0.80 4.04 0.12 1.61 2.20 0.01 -5.07 119.74 121.85 2wdt s LYS 48 Ca 0.00 -0.25 -0.31 0.00 -0.36 0.00 0.00 55.97 55.06 2wdt s LYS 48 Cb 0.00 -3.33 -0.07 0.00 -1.51 0.00 0.00 37.83 32.92 2wdt s LYS 48 CO 0.00 0.34 1.26 -1.14 -0.36 0.00 0.00 175.35 175.45 2wdt s GLN 49 N 0.21 4.42 -0.03 4.03 0.74 -1.26 -0.91 119.66 126.85 2wdt s GLN 49 Ca 0.07 1.91 -0.21 0.00 0.05 0.00 0.00 55.36 57.18 2wdt s GLN 49 Cb -0.11 -3.28 -0.05 0.00 1.10 0.00 0.00 33.01 30.67 2wdt s GLN 49 CO -0.01 -0.26 0.61 -0.51 -0.55 0.00 0.00 175.29 174.58 2wdt s LEU 50 N 0.60 4.38 -0.04 3.68 1.43 0.24 -4.96 118.68 124.01 2wdt s LEU 50 Ca 0.58 1.14 -0.20 0.00 -1.03 0.00 0.00 54.13 54.62 2wdt s LEU 50 Cb -0.33 -2.95 -0.05 0.00 0.03 0.00 0.00 46.19 42.90 2wdt s LEU 50 CO 0.32 0.03 0.57 -1.61 0.23 0.00 0.00 176.35 175.90 2wdt s GLU 51 N 0.16 4.32 0.36 1.70 2.02 -1.26 -4.68 118.70 121.32 2wdt s GLU 51 Ca 0.32 0.67 0.15 0.00 0.02 0.00 0.00 54.97 56.14 2wdt s GLU 51 Cb -0.18 -3.38 1.05 0.00 0.10 0.00 0.00 34.13 31.72 2wdt s GLU 51 CO 0.17 0.28 1.72 -0.44 0.02 0.00 0.00 175.26 177.01 2wdt h ASP 52 N 6.05 0.53 0.67 -0.19 3.32 -1.96 -2.04 116.42 122.80 2wdt h ASP 52 Ca -0.44 0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.74 2wdt h ASP 52 Cb 1.20 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2wdt h ASP 52 CO 0.72 0.02 -0.07 0.61 -1.72 0.00 0.00 179.24 178.80 2wdt n GLY 53 N -1.38 -1.29 3.93 2.75 0.00 -1.26 -2.73 105.19 105.22 2wdt n GLY 53 Ca 0.28 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 2wdt n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdt s ARG 54 N -2.75 3.49 0.40 1.61 0.52 -0.77 -4.90 118.95 116.56 2wdt s ARG 54 Ca 0.22 -0.19 0.02 0.00 -0.52 0.00 0.00 55.73 55.25 2wdt s ARG 54 Cb 0.19 -2.58 -0.01 0.00 0.52 0.00 0.00 34.95 33.07 2wdt s ARG 54 CO 0.51 0.04 0.59 0.95 0.02 0.00 0.00 175.30 177.42 2wdt s THR 55 N -2.44 4.18 0.40 0.02 -4.23 -1.26 -0.80 115.64 111.51 2wdt s THR 55 Ca 0.42 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 60.35 2wdt s THR 55 Cb -0.10 -3.51 0.23 0.00 1.34 0.00 0.00 72.50 70.46 2wdt s THR 55 CO 0.38 -0.30 2.01 -0.07 -0.54 0.00 0.00 174.62 176.10 2wdt h LEU 56 N 0.60 0.40 -0.53 4.79 3.38 -1.02 -2.07 115.31 120.86 2wdt h LEU 56 Ca -0.47 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.42 2wdt h LEU 56 Cb 1.25 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2wdt h LEU 56 CO 0.57 0.37 0.13 -1.28 0.09 0.00 0.00 178.44 178.31 2wdt h SER 57 N 0.45 0.79 -0.99 -0.43 0.87 -1.17 -0.48 113.55 112.58 2wdt h SER 57 Ca 0.11 -0.23 0.20 0.00 -1.23 0.00 0.00 61.79 60.64 2wdt h SER 57 Cb 0.09 -0.21 -0.10 0.00 -0.44 0.00 0.00 62.40 61.74 2wdt h SER 57 CO -0.01 0.81 0.61 0.44 -0.53 0.00 0.00 176.83 178.16 2wdt h ASP 58 N 0.73 0.72 -0.26 6.23 3.32 -1.65 0.11 116.42 125.62 2wdt h ASP 58 Ca 0.17 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2wdt h ASP 58 Cb 0.33 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2wdt h ASP 58 CO 0.00 0.25 0.00 -1.22 -1.72 0.00 0.00 179.24 176.55 2wdt n TYR 59 N -4.72 0.35 -4.05 4.55 4.01 -1.07 -4.92 117.16 111.31 2wdt n TYR 59 Ca 0.23 -0.17 -0.32 0.00 -0.16 0.00 0.00 57.90 57.48 2wdt n TYR 59 Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.63 2wdt n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2wdt n ASN 60 N 0.51 -3.44 -4.60 7.72 4.05 0.38 -4.91 115.26 114.97 2wdt n ASN 60 Ca 0.15 -0.91 -0.43 0.00 0.45 0.00 0.00 54.58 53.84 2wdt n ASN 60 Cb 0.34 -3.30 -0.04 0.00 1.23 0.00 0.00 39.78 38.02 2wdt n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2wdt s ILE 61 N -3.39 4.57 0.55 -1.44 1.01 -0.23 -5.03 121.20 117.24 2wdt s ILE 61 Ca 0.59 1.14 0.09 0.00 0.00 0.00 0.00 60.65 62.47 2wdt s ILE 61 Cb -0.31 -4.34 0.07 0.00 0.01 0.00 0.00 42.46 37.89 2wdt s ILE 61 CO 0.88 -0.57 0.73 -1.10 0.00 0.00 0.00 174.94 174.88 2wdt s GLN 62 N 3.50 2.38 0.18 2.79 -0.21 -1.26 -4.57 119.66 122.47 2wdt s GLN 62 Ca 0.38 -1.61 -0.32 0.00 0.02 0.00 0.00 55.36 53.83 2wdt s GLN 62 Cb -0.12 -2.62 -0.15 0.00 1.00 0.00 0.00 33.01 31.12 2wdt s GLN 62 CO 0.19 -0.75 1.17 0.36 -2.12 0.00 0.00 175.29 174.14 2wdt n LYS 63 N -2.14 1.21 -1.22 2.91 2.85 -1.26 -2.01 118.16 118.50 2wdt n LYS 63 Ca 0.13 0.43 -0.08 0.00 -1.05 0.00 0.00 58.31 57.75 2wdt n LYS 63 Cb 0.61 -1.93 -0.03 0.00 -0.65 0.00 0.00 35.03 33.03 2wdt n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2wdt n GLU 64 N 1.72 -0.91 -1.98 -1.58 -0.58 0.68 -5.00 120.64 112.99 2wdt n GLU 64 Ca 0.15 0.69 -0.37 0.00 -0.42 0.00 0.00 57.16 57.20 2wdt n GLU 64 Cb 0.25 -4.63 0.03 0.00 -0.57 0.00 0.00 31.44 26.52 2wdt n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2wdt s SER 65 N -2.58 5.47 -0.18 1.62 0.01 -0.85 -4.73 113.70 112.46 2wdt s SER 65 Ca 0.00 2.52 -0.02 0.00 1.31 0.00 0.00 55.95 59.76 2wdt s SER 65 Cb 0.00 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.61 2wdt s SER 65 CO 0.00 -1.41 -0.09 -0.89 0.41 0.00 0.00 173.24 171.26 2wdt s THR 66 N -1.46 3.14 0.13 1.44 2.01 -1.26 -1.10 115.64 118.56 2wdt s THR 66 Ca 0.72 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 62.15 2wdt s THR 66 Cb -0.34 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 2wdt s THR 66 CO 0.39 0.48 0.23 -0.76 -0.69 0.00 0.00 174.62 174.27 2wdt s LEU 67 N 0.97 4.20 -0.12 4.42 1.02 0.53 -4.85 118.68 124.85 2wdt s LEU 67 Ca -0.01 0.11 -0.05 0.00 0.02 0.00 0.00 54.13 54.20 2wdt s LEU 67 Cb -0.15 -2.79 -0.04 0.00 0.02 0.00 0.00 46.19 43.24 2wdt s LEU 67 CO -0.01 0.08 0.05 -1.00 0.02 0.00 0.00 176.35 175.50 2wdt s HIS 68 N -1.69 3.30 -0.23 0.29 3.76 -0.36 -0.22 115.29 120.15 2wdt s HIS 68 Ca 0.34 0.25 -0.07 0.00 -0.15 0.00 0.00 55.06 55.43 2wdt s HIS 68 Cb -0.11 -1.90 -0.03 0.00 1.11 0.00 0.00 32.58 31.65 2wdt s HIS 68 CO 0.27 0.47 0.05 -1.17 -0.85 0.00 0.00 174.74 173.51 2wdt s LEU 69 N -0.63 3.44 -0.09 0.89 2.96 0.24 -0.76 118.68 124.74 2wdt s LEU 69 Ca 0.11 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.84 2wdt s LEU 69 Cb -0.12 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 2wdt s LEU 69 CO 0.02 0.02 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.35 2wdt s VAL 70 N 1.29 4.05 -0.19 1.68 1.01 0.63 -4.09 120.40 124.77 2wdt s VAL 70 Ca 0.05 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 2wdt s VAL 70 Cb -0.15 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2wdt s VAL 70 CO 0.03 0.59 0.01 -0.76 0.00 0.00 0.00 175.10 174.97 2wdt s LEU 71 N -0.67 3.40 -0.76 3.92 1.43 -1.26 -0.74 118.68 124.01 2wdt s LEU 71 Ca 0.10 -0.13 -0.25 0.00 -1.03 0.00 0.00 54.13 52.83 2wdt s LEU 71 Cb -0.12 -1.86 0.05 0.00 0.03 0.00 0.00 46.19 44.30 2wdt s LEU 71 CO 0.02 0.10 1.19 -0.13 0.23 0.00 0.00 176.35 177.76 2wdt s ARG 72 N 0.82 3.24 0.02 1.70 1.81 0.77 -5.01 118.95 122.29 2wdt s ARG 72 Ca 0.01 -0.62 0.00 0.00 -1.72 0.00 0.00 55.73 53.41 2wdt s ARG 72 Cb -0.14 -4.38 -0.04 0.00 -0.45 0.00 0.00 34.95 29.94 2wdt s ARG 72 CO 0.02 -2.03 0.10 -0.51 -0.68 0.00 0.00 175.30 172.20 2wdt s LEU 73 N 4.95 3.95 -0.19 2.53 1.43 -1.26 -4.67 118.68 125.41 2wdt s LEU 73 Ca 0.32 0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 2wdt s LEU 73 Cb -0.10 -2.40 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 2wdt s LEU 73 CO 0.09 0.24 0.47 -0.13 0.23 0.00 0.00 176.35 177.25 2wdt s ARG 74 N -1.95 4.20 0.00 1.70 0.52 -1.26 -5.22 118.95 116.93 2wdt s ARG 74 Ca 0.26 0.34 0.08 0.00 -0.52 0.00 0.00 55.73 55.89 2wdt s ARG 74 Cb -0.12 -3.54 0.06 0.00 0.52 0.00 0.00 34.95 31.87 2wdt s ARG 74 CO 0.17 -0.08 0.74 0.41 0.02 0.00 0.00 175.30 176.57