#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nr2 s GLN 2 N 0.00 3.21 0.25 3.17 0.74 -1.26 -1.40 119.66 124.37 2nr2 s GLN 2 Ca 0.00 -0.75 0.10 0.00 0.05 0.00 0.00 55.36 54.76 2nr2 s GLN 2 Cb 0.00 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.95 2nr2 s GLN 2 CO 0.00 -0.30 -0.04 0.96 -0.55 0.00 0.00 175.29 175.35 2nr2 s ILE 3 N 1.46 3.29 0.05 -2.34 -4.36 0.11 -4.72 121.20 114.69 2nr2 s ILE 3 Ca 0.04 -1.94 0.05 0.00 -0.26 0.00 0.00 60.65 58.54 2nr2 s ILE 3 Cb -0.16 -2.73 -0.04 0.00 1.25 0.00 0.00 42.46 40.79 2nr2 s ILE 3 CO -0.02 -0.34 -0.09 -0.36 0.24 0.00 0.00 174.94 174.38 2nr2 s PHE 4 N -2.25 2.80 -0.24 1.37 0.08 -0.99 -0.36 117.98 118.38 2nr2 s PHE 4 Ca 0.30 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.24 2nr2 s PHE 4 Cb -0.07 -1.53 0.03 0.00 -0.57 0.00 0.00 43.02 40.89 2nr2 s PHE 4 CO 0.19 0.38 -0.10 0.08 -0.10 0.00 0.00 175.22 175.67 2nr2 s VAL 5 N -1.08 2.55 -0.10 -0.44 1.01 0.15 -0.73 120.40 121.77 2nr2 s VAL 5 Ca 0.19 -1.19 -0.18 0.00 0.00 0.00 0.00 61.98 60.80 2nr2 s VAL 5 Cb -0.11 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2nr2 s VAL 5 CO 0.10 0.19 0.47 -0.54 0.00 0.00 0.00 175.10 175.32 2nr2 s LYS 6 N 1.26 4.29 0.83 2.72 1.02 0.12 -0.71 119.74 129.27 2nr2 s LYS 6 Ca -0.02 0.45 -0.10 0.00 0.02 0.00 0.00 55.97 56.32 2nr2 s LYS 6 Cb -0.17 -3.40 0.13 0.00 -0.52 0.00 0.00 37.83 33.86 2nr2 s LYS 6 CO -0.06 0.24 1.16 0.95 -0.92 0.00 0.00 175.35 176.72 2nr2 s THR 7 N 0.36 2.09 0.15 2.17 -4.23 -0.48 -0.30 115.64 115.41 2nr2 s THR 7 Ca 0.26 -0.16 -0.17 0.00 -1.18 0.00 0.00 61.69 60.44 2nr2 s THR 7 Cb -0.15 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.76 2nr2 s THR 7 CO 0.11 0.00 1.77 0.25 -0.54 0.00 0.00 174.62 176.21 2nr2 h LEU 8 N -1.08 0.22 -0.12 4.79 5.85 -1.80 -3.21 115.31 119.95 2nr2 h LEU 8 Ca -0.44 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2nr2 h LEU 8 Cb 1.28 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2nr2 h LEU 8 CO 0.50 0.17 -0.26 0.35 -0.34 0.00 0.00 178.44 178.86 2nr2 n THR 9 N -4.96 0.00 0.00 1.05 -2.24 -1.26 -4.92 114.28 101.94 2nr2 n THR 9 Ca 0.01 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2nr2 n THR 9 Cb 0.09 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2nr2 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nr2 n GLY 10 N 1.42 1.99 3.63 3.38 0.00 -1.21 -5.11 105.19 109.28 2nr2 n GLY 10 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 2nr2 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nr2 s LYS 11 N -0.87 3.52 -0.27 1.61 2.20 -1.26 -4.84 119.74 119.83 2nr2 s LYS 11 Ca 0.00 -0.40 -0.08 0.00 -0.36 0.00 0.00 55.97 55.12 2nr2 s LYS 11 Cb 0.00 -2.98 -0.02 0.00 -1.51 0.00 0.00 37.83 33.31 2nr2 s LYS 11 CO 0.00 0.44 0.11 0.99 -0.36 0.00 0.00 175.35 176.53 2nr2 s THR 12 N -0.14 4.49 -0.20 3.43 2.01 -1.26 -1.38 115.64 122.59 2nr2 s THR 12 Ca 0.05 -0.21 -0.10 0.00 0.31 0.00 0.00 61.69 61.74 2nr2 s THR 12 Cb -0.12 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.18 2nr2 s THR 12 CO 0.02 0.25 0.12 -0.63 -0.69 0.00 0.00 174.62 173.69 2nr2 s ILE 13 N 1.63 5.28 -0.21 1.82 1.01 0.12 -4.93 121.20 125.91 2nr2 s ILE 13 Ca 0.06 0.15 -0.21 0.00 0.00 0.00 0.00 60.65 60.64 2nr2 s ILE 13 Cb -0.16 -3.41 -0.02 0.00 0.01 0.00 0.00 42.46 38.88 2nr2 s ILE 13 CO 0.05 0.43 0.65 -0.89 0.00 0.00 0.00 174.94 175.18 2nr2 s THR 14 N 0.46 5.00 -0.06 2.92 2.01 -1.26 -0.67 115.64 124.04 2nr2 s THR 14 Ca 0.07 1.21 0.05 0.00 0.31 0.00 0.00 61.69 63.34 2nr2 s THR 14 Cb -0.12 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.43 2nr2 s THR 14 CO -0.01 0.08 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.55 2nr2 s LEU 15 N 2.11 2.03 -0.60 4.42 2.96 0.51 -4.97 118.68 125.13 2nr2 s LEU 15 Ca 0.29 -0.47 -0.19 0.00 -0.22 0.00 0.00 54.13 53.53 2nr2 s LEU 15 Cb -0.16 -1.27 0.10 0.00 0.50 0.00 0.00 46.19 45.37 2nr2 s LEU 15 CO 0.10 0.21 0.74 -1.61 -1.32 0.00 0.00 176.35 174.46 2nr2 s GLU 16 N -0.05 3.05 0.11 1.98 2.02 -1.26 -0.71 118.70 123.84 2nr2 s GLU 16 Ca -0.05 -1.28 0.08 0.00 0.02 0.00 0.00 54.97 53.74 2nr2 s GLU 16 Cb -0.14 -4.27 -0.04 0.00 0.10 0.00 0.00 34.13 29.79 2nr2 s GLU 16 CO 0.04 -1.58 -0.16 0.14 0.02 0.00 0.00 175.26 173.73 2nr2 s VAL 17 N 2.83 2.99 0.35 2.63 -7.23 -0.49 -4.88 120.40 116.60 2nr2 s VAL 17 Ca 0.13 -1.41 0.07 0.00 -1.81 0.00 0.00 61.98 58.96 2nr2 s VAL 17 Cb -0.23 -2.37 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 2nr2 s VAL 17 CO 0.06 0.12 0.38 -1.61 -0.31 0.00 0.00 175.10 173.74 2nr2 s GLU 18 N -2.10 2.85 0.44 4.82 0.41 -1.26 0.14 118.70 123.99 2nr2 s GLU 18 Ca 0.19 -1.22 0.23 0.00 -0.41 0.00 0.00 54.97 53.76 2nr2 s GLU 18 Cb -0.11 -2.60 0.39 0.00 -1.78 0.00 0.00 34.13 30.03 2nr2 s GLU 18 CO 0.11 0.04 1.63 -1.00 -0.49 0.00 0.00 175.26 175.54 2nr2 h PRO 19 N 1.07 0.00 -0.02 0.39 0.13 -1.95 -2.70 132.00 128.93 2nr2 h PRO 19 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2nr2 h PRO 19 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2nr2 h PRO 19 CO 0.56 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.20 2nr2 n SER 20 N -3.10 0.73 -4.78 1.44 3.41 -1.26 -1.63 113.62 108.43 2nr2 n SER 20 Ca 0.04 -1.28 -0.34 0.00 -0.26 0.00 0.00 58.87 57.03 2nr2 n SER 20 Cb 0.52 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.47 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2nr2 s ASP 21 N -1.95 5.64 0.65 4.04 1.01 -1.02 -4.79 116.67 120.25 2nr2 s ASP 21 Ca 0.42 2.08 -0.07 0.00 0.71 0.00 0.00 52.55 55.68 2nr2 s ASP 21 Cb 0.21 -2.57 0.03 0.00 1.01 0.00 0.00 42.92 41.60 2nr2 s ASP 21 CO 0.34 -1.27 0.98 0.42 0.21 0.00 0.00 175.17 175.85 2nr2 s THR 22 N -1.99 3.11 0.14 -1.27 -4.23 -1.26 -1.51 115.64 108.63 2nr2 s THR 22 Ca 0.70 -0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 61.16 2nr2 s THR 22 Cb -0.22 -3.29 -0.16 0.00 1.34 0.00 0.00 72.50 70.17 2nr2 s THR 22 CO 0.31 -0.32 1.34 0.40 -0.54 0.00 0.00 174.62 175.80 2nr2 h ILE 23 N -0.42 1.39 -0.61 2.99 1.08 -1.34 -2.73 117.51 117.87 2nr2 h ILE 23 Ca -0.45 -2.34 0.12 0.00 -0.39 0.00 0.00 64.86 61.81 2nr2 h ILE 23 Cb 1.28 2.31 -0.11 0.00 -3.07 0.00 0.00 36.82 37.23 2nr2 h ILE 23 CO 0.61 0.70 -0.11 -0.08 -0.69 0.00 0.00 178.15 178.59 2nr2 h GLU 24 N 0.26 0.03 -0.64 2.37 4.81 -0.94 -2.13 114.58 118.34 2nr2 h GLU 24 Ca -0.07 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2nr2 h GLU 24 Cb 1.50 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.83 2nr2 h GLU 24 CO 0.15 0.02 0.42 -0.97 -0.73 0.00 0.00 179.01 177.91 2nr2 h ASN 25 N 0.03 0.63 -0.11 1.04 -1.24 -1.82 -1.39 115.58 112.73 2nr2 h ASN 25 Ca 0.30 -0.00 -0.20 0.00 0.71 0.00 0.00 56.30 57.10 2nr2 h ASN 25 Cb 0.47 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.38 2nr2 h ASN 25 CO -0.60 0.43 -0.70 0.58 -1.29 0.00 0.00 177.43 175.85 2nr2 h VAL 26 N 0.73 1.29 -0.10 2.57 2.07 -1.08 -0.65 116.25 121.08 2nr2 h VAL 26 Ca 0.26 -1.92 -0.04 0.00 0.82 0.00 0.00 66.70 65.81 2nr2 h VAL 26 Cb 0.14 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2nr2 h VAL 26 CO -0.08 0.61 -0.15 0.11 0.02 0.00 0.00 177.57 178.09 2nr2 h LYS 27 N 0.53 0.15 -0.08 1.57 1.57 -1.22 -1.04 116.57 118.04 2nr2 h LYS 27 Ca -0.03 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2nr2 h LYS 27 Cb 1.31 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 2nr2 h LYS 27 CO 0.14 0.30 -0.45 0.00 -0.57 0.00 0.00 179.45 178.88 2nr2 h ALA 28 N 1.71 1.09 -0.22 3.86 0.00 -0.54 -2.03 119.26 123.15 2nr2 h ALA 28 Ca 0.03 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 2nr2 h ALA 28 Cb 0.35 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2nr2 h ALA 28 CO 0.02 0.61 -0.14 0.87 0.00 0.00 0.00 179.25 180.61 2nr2 h LYS 29 N 0.16 0.48 -0.59 0.00 1.57 -0.21 -1.66 116.57 116.32 2nr2 h LYS 29 Ca 0.01 -0.22 0.03 0.00 -1.87 0.00 0.00 60.65 58.60 2nr2 h LYS 29 Cb 0.86 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.13 2nr2 h LYS 29 CO 0.07 0.78 0.39 0.82 -0.57 0.00 0.00 179.45 180.94 2nr2 h ILE 30 N 0.17 1.09 -0.39 1.86 2.04 -1.06 0.73 117.51 121.94 2nr2 h ILE 30 Ca 0.04 -0.24 -0.14 0.00 1.00 0.00 0.00 64.86 65.53 2nr2 h ILE 30 Cb 0.65 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2nr2 h ILE 30 CO 0.04 0.13 -0.29 -0.61 0.00 0.00 0.00 178.15 177.42 2nr2 h GLN 31 N 0.71 0.89 0.51 2.37 4.15 -1.36 0.22 115.11 122.59 2nr2 h GLN 31 Ca 0.23 -0.43 -0.02 0.00 0.77 0.00 0.00 58.65 59.20 2nr2 h GLN 31 Cb 0.06 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2nr2 h GLN 31 CO -0.06 1.08 -0.42 0.22 -1.93 0.00 0.00 178.83 177.72 2nr2 h ASP 32 N 0.70 -1.12 0.01 -0.69 3.58 -0.92 -3.20 116.42 114.78 2nr2 h ASP 32 Ca 0.07 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2nr2 h ASP 32 Cb 0.87 0.35 0.00 0.00 1.72 0.00 0.00 39.33 42.27 2nr2 h ASP 32 CO 0.08 -0.58 -0.01 0.07 -2.88 0.00 0.00 179.24 175.92 2nr2 h LYS 33 N -0.90 -0.02 0.01 0.28 2.10 -0.90 -3.41 116.57 113.73 2nr2 h LYS 33 Ca -0.07 0.00 -0.40 0.00 -2.00 0.00 0.00 60.65 58.18 2nr2 h LYS 33 Cb 0.76 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.03 2nr2 h LYS 33 CO -0.00 0.76 -2.23 -1.91 -2.00 0.00 0.00 179.45 174.07 2nr2 n GLU 34 N -4.71 0.60 0.00 0.07 4.07 0.15 -5.08 120.64 115.75 2nr2 n GLU 34 Ca -0.09 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 2nr2 n GLU 34 Cb 0.38 -1.56 0.00 0.00 -0.06 0.00 0.00 31.44 30.20 2nr2 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2nr2 n GLY 35 N 1.44 0.80 3.11 8.31 0.00 0.52 -4.99 105.19 114.38 2nr2 n GLY 35 Ca -0.48 -0.76 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 2nr2 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nr2 s ILE 36 N -1.71 1.30 0.05 -0.61 1.01 -1.25 -4.96 121.20 115.03 2nr2 s ILE 36 Ca 0.00 -0.64 -0.24 0.00 0.00 0.00 0.00 60.65 59.77 2nr2 s ILE 36 Cb 0.00 -1.12 -0.06 0.00 0.01 0.00 0.00 42.46 41.29 2nr2 s ILE 36 CO 0.00 0.38 0.73 -2.84 0.00 0.00 0.00 174.94 173.21 2nr2 s PRO 37 N 0.09 4.46 0.11 2.79 0.02 -1.26 -3.85 135.00 137.35 2nr2 s PRO 37 Ca -0.04 1.00 0.06 0.00 0.02 0.00 0.00 61.00 62.05 2nr2 s PRO 37 Cb -0.11 -3.35 0.33 0.00 0.02 0.00 0.00 34.50 31.40 2nr2 s PRO 37 CO 0.02 0.33 1.11 -2.30 -0.33 0.00 0.00 177.00 175.83 2nr2 n PRO 38 N 2.67 0.04 0.21 5.54 -0.02 -1.26 -0.30 135.00 141.88 2nr2 n PRO 38 Ca -0.04 0.48 0.09 0.00 -2.02 0.00 0.00 63.50 62.01 2nr2 n PRO 38 Cb 0.50 -1.74 0.36 0.00 -0.02 0.00 0.00 33.50 32.60 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2nr2 h ASP 39 N 0.00 0.00 -0.02 2.55 3.32 -1.95 -3.34 116.42 116.98 2nr2 h ASP 39 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nr2 h ASP 39 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2nr2 h ASP 39 CO 0.00 0.26 -0.30 0.00 -1.72 0.00 0.00 179.24 177.47 2nr2 n GLN 40 N -3.32 1.61 -3.35 3.56 6.02 0.59 -4.64 117.38 117.85 2nr2 n GLN 40 Ca 0.01 -1.33 -0.45 0.00 -0.01 0.00 0.00 57.00 55.21 2nr2 n GLN 40 Cb 0.50 -1.47 -0.05 0.00 1.02 0.00 0.00 30.24 30.23 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nr2 s GLN 41 N -2.31 3.05 -0.21 -1.09 -0.21 -1.24 -0.89 119.66 116.77 2nr2 s GLN 41 Ca 0.22 -1.90 -0.22 0.00 0.02 0.00 0.00 55.36 53.48 2nr2 s GLN 41 Cb 0.19 -4.27 -0.02 0.00 1.00 0.00 0.00 33.01 29.91 2nr2 s GLN 41 CO 0.47 -1.30 0.69 0.50 -2.12 0.00 0.00 175.29 173.54 2nr2 s ARG 42 N 1.21 4.20 -0.13 2.91 3.52 -0.41 -4.90 118.95 125.35 2nr2 s ARG 42 Ca 0.07 0.72 -0.02 0.00 -0.13 0.00 0.00 55.73 56.37 2nr2 s ARG 42 Cb -0.25 -3.60 -0.02 0.00 -1.56 0.00 0.00 34.95 29.51 2nr2 s ARG 42 CO -0.00 -0.34 -0.08 -0.51 -0.81 0.00 0.00 175.30 173.56 2nr2 s LEU 43 N 2.23 3.04 -0.05 -0.88 1.43 -1.26 -0.25 118.68 122.95 2nr2 s LEU 43 Ca 0.31 -0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.28 2nr2 s LEU 43 Cb -0.16 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 2nr2 s LEU 43 CO 0.10 0.20 -0.23 -0.63 0.23 0.00 0.00 176.35 176.02 2nr2 s ILE 44 N 0.18 1.86 0.00 -0.59 1.09 -0.15 -0.34 121.20 123.24 2nr2 s ILE 44 Ca -0.04 -0.97 0.00 0.00 -1.10 0.00 0.00 60.65 58.54 2nr2 s ILE 44 Cb -0.14 -1.57 0.00 0.00 -1.06 0.00 0.00 42.46 39.69 2nr2 s ILE 44 CO 0.04 0.52 0.00 0.33 -0.10 0.00 0.00 174.94 175.73 2nr2 n PHE 45 N 2.91 0.00 -0.00 3.97 7.35 -0.69 -0.86 117.46 130.14 2nr2 n PHE 45 Ca -0.17 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.52 2nr2 n PHE 45 Cb 0.52 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.35 2nr2 n PHE 45 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2nr2 n ALA 46 N -3.00 0.59 -0.06 3.13 0.00 -1.26 -4.69 120.51 115.22 2nr2 n ALA 46 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 53.44 53.18 2nr2 n ALA 46 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2nr2 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nr2 n GLY 47 N 1.88 -0.71 3.86 0.00 0.00 -1.26 -4.95 105.19 104.01 2nr2 n GLY 47 Ca -0.00 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 2nr2 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nr2 s LYS 48 N -2.45 3.74 -0.09 1.61 -0.14 -1.26 -5.08 119.74 116.07 2nr2 s LYS 48 Ca -0.07 0.17 -0.13 0.00 -1.36 0.00 0.00 55.97 54.57 2nr2 s LYS 48 Cb 0.05 -3.11 -0.05 0.00 -1.68 0.00 0.00 37.83 33.04 2nr2 s LYS 48 CO 0.60 0.65 0.33 1.14 -0.76 0.00 0.00 175.35 177.30 2nr2 s GLN 49 N -1.51 3.99 -0.33 1.68 -2.07 -1.26 -1.70 119.66 118.45 2nr2 s GLN 49 Ca 0.27 0.21 -0.24 0.00 -1.82 0.00 0.00 55.36 53.79 2nr2 s GLN 49 Cb -0.14 -3.31 0.01 0.00 -1.09 0.00 0.00 33.01 28.48 2nr2 s GLN 49 CO 0.14 0.50 0.80 -0.51 -1.32 0.00 0.00 175.29 174.91 2nr2 s LEU 50 N -0.38 4.09 0.04 2.60 1.43 0.54 -4.98 118.68 122.02 2nr2 s LEU 50 Ca 0.20 0.54 -0.25 0.00 -1.03 0.00 0.00 54.13 53.59 2nr2 s LEU 50 Cb -0.14 -3.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.95 2nr2 s LEU 50 CO 0.08 -0.68 0.76 -0.70 0.23 0.00 0.00 176.35 176.04 2nr2 s GLU 51 N 3.06 4.49 0.25 1.70 2.12 -1.26 -4.59 118.70 124.47 2nr2 s GLU 51 Ca 0.32 1.06 -0.06 0.00 0.36 0.00 0.00 54.97 56.65 2nr2 s GLU 51 Cb -0.14 -3.37 0.26 0.00 0.26 0.00 0.00 34.13 31.15 2nr2 s GLU 51 CO 0.15 0.28 1.92 -0.44 -0.54 0.00 0.00 175.26 176.62 2nr2 h ASP 52 N 5.70 1.11 -1.58 -1.70 3.32 -1.96 -3.03 116.42 118.28 2nr2 h ASP 52 Ca -0.44 -0.03 -0.72 0.00 0.02 0.00 0.00 57.03 55.87 2nr2 h ASP 52 Cb 1.20 -0.27 -0.20 0.00 0.22 0.00 0.00 39.33 40.29 2nr2 h ASP 52 CO 0.71 0.79 1.46 0.61 -1.72 0.00 0.00 179.24 181.09 2nr2 n GLY 53 N -1.37 5.38 3.27 2.75 0.00 -1.26 -0.28 105.19 113.68 2nr2 n GLY 53 Ca 0.12 -2.24 -0.15 0.00 0.00 0.00 0.00 46.02 43.75 2nr2 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nr2 s ARG 54 N -2.60 1.15 0.50 1.61 1.81 -1.14 -5.01 118.95 115.26 2nr2 s ARG 54 Ca 0.50 -1.53 0.03 0.00 -1.72 0.00 0.00 55.73 53.02 2nr2 s ARG 54 Cb 0.26 -0.57 0.02 0.00 -0.45 0.00 0.00 34.95 34.21 2nr2 s ARG 54 CO -0.17 -0.00 0.70 0.95 -0.68 0.00 0.00 175.30 176.09 2nr2 s THR 55 N -3.40 2.84 0.52 0.02 -4.23 -1.26 -2.03 115.64 108.10 2nr2 s THR 55 Ca 0.21 -0.77 0.17 0.00 -1.18 0.00 0.00 61.69 60.12 2nr2 s THR 55 Cb 0.04 -3.02 0.29 0.00 1.34 0.00 0.00 72.50 71.15 2nr2 s THR 55 CO 0.03 -0.01 2.12 -0.07 -0.54 0.00 0.00 174.62 176.14 2nr2 h LEU 56 N 0.28 0.03 -0.76 4.79 4.07 -1.20 -2.88 115.31 119.63 2nr2 h LEU 56 Ca -0.42 -0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.49 2nr2 h LEU 56 Cb 1.29 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 2nr2 h LEU 56 CO 0.50 0.02 -0.26 0.77 -1.08 0.00 0.00 178.44 178.39 2nr2 h SER 57 N 0.03 0.00 -0.08 -0.43 4.64 -1.59 -1.15 113.55 114.98 2nr2 h SER 57 Ca 0.06 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.15 2nr2 h SER 57 Cb 0.18 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2nr2 h SER 57 CO -0.00 0.26 -0.85 0.44 -0.87 0.00 0.00 176.83 175.80 2nr2 h ASP 58 N 0.00 0.88 0.01 4.97 3.32 -1.82 -3.04 116.42 120.74 2nr2 h ASP 58 Ca -0.00 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.36 2nr2 h ASP 58 Cb 0.91 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2nr2 h ASP 58 CO 0.03 1.43 -0.04 -1.22 -1.72 0.00 0.00 179.24 177.73 2nr2 n TYR 59 N -3.95 0.00 -3.00 4.55 4.01 -1.21 -4.98 117.16 112.58 2nr2 n TYR 59 Ca -0.09 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.52 2nr2 n TYR 59 Cb 0.78 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 39.86 2nr2 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2nr2 n ASN 60 N 0.24 -4.58 -4.69 7.72 5.03 -0.98 -4.98 115.26 113.02 2nr2 n ASN 60 Ca 0.17 -0.55 -0.41 0.00 0.87 0.00 0.00 54.58 54.66 2nr2 n ASN 60 Cb 0.39 -4.31 -0.04 0.00 -1.02 0.00 0.00 39.78 34.80 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2nr2 s ILE 61 N -3.31 4.93 0.43 2.41 1.01 -0.47 -5.03 121.20 121.17 2nr2 s ILE 61 Ca 0.25 1.61 0.07 0.00 0.00 0.00 0.00 60.65 62.59 2nr2 s ILE 61 Cb -0.03 -4.12 -0.02 0.00 0.01 0.00 0.00 42.46 38.30 2nr2 s ILE 61 CO 0.60 0.11 0.37 -1.10 0.00 0.00 0.00 174.94 174.92 2nr2 s GLN 62 N 1.62 2.48 0.31 2.79 -1.52 -1.26 -4.83 119.66 119.24 2nr2 s GLN 62 Ca 0.39 -1.61 0.12 0.00 -1.95 0.00 0.00 55.36 52.32 2nr2 s GLN 62 Cb -0.17 -2.32 0.48 0.00 -0.22 0.00 0.00 33.01 30.77 2nr2 s GLN 62 CO 0.16 -0.24 1.67 1.57 -0.25 0.00 0.00 175.29 178.20 2nr2 h LYS 63 N 1.02 0.00 -0.04 2.91 2.10 -1.97 -2.97 116.57 117.62 2nr2 h LYS 63 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 2nr2 h LYS 63 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 2nr2 h LYS 63 CO 0.58 0.54 0.00 0.39 -2.00 0.00 0.00 179.45 178.96 2nr2 n GLU 64 N -3.80 1.00 -2.66 0.07 -0.58 -1.26 -4.38 120.64 109.03 2nr2 n GLU 64 Ca -0.01 -0.01 -0.42 0.00 -0.42 0.00 0.00 57.16 56.31 2nr2 n GLU 64 Cb 0.56 -1.02 -0.03 0.00 -0.57 0.00 0.00 31.44 30.38 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2nr2 s SER 65 N -0.96 7.34 -0.30 1.62 0.01 -1.12 -4.95 113.70 115.33 2nr2 s SER 65 Ca 0.00 1.76 -0.08 0.00 1.31 0.00 0.00 55.95 58.94 2nr2 s SER 65 Cb 0.00 -2.58 -0.00 0.00 0.21 0.00 0.00 66.02 63.65 2nr2 s SER 65 CO 0.00 -0.26 0.11 -0.89 0.41 0.00 0.00 173.24 172.60 2nr2 s THR 66 N 0.81 4.25 0.43 1.44 2.01 -1.26 -2.36 115.64 120.97 2nr2 s THR 66 Ca 0.52 -0.53 -0.07 0.00 0.31 0.00 0.00 61.69 61.92 2nr2 s THR 66 Cb -0.23 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.07 2nr2 s THR 66 CO 0.29 0.10 0.75 -0.76 -0.69 0.00 0.00 174.62 174.31 2nr2 s LEU 67 N 1.56 3.75 -0.10 4.42 1.02 0.09 -4.87 118.68 124.56 2nr2 s LEU 67 Ca 0.04 0.96 0.01 0.00 0.02 0.00 0.00 54.13 55.16 2nr2 s LEU 67 Cb -0.17 -3.88 0.02 0.00 0.02 0.00 0.00 46.19 42.18 2nr2 s LEU 67 CO 0.04 -0.47 -0.10 -1.00 0.02 0.00 0.00 176.35 174.84 2nr2 s HIS 68 N -2.53 1.56 -0.32 0.29 3.76 -0.04 0.14 115.29 118.16 2nr2 s HIS 68 Ca 0.48 -0.72 -0.10 0.00 -0.15 0.00 0.00 55.06 54.57 2nr2 s HIS 68 Cb -0.10 -1.22 -0.01 0.00 1.11 0.00 0.00 32.58 32.36 2nr2 s HIS 68 CO 0.38 -0.44 0.17 -1.17 -0.85 0.00 0.00 174.74 172.83 2nr2 s LEU 69 N 1.27 4.20 0.36 0.89 0.20 0.59 -0.98 118.68 125.21 2nr2 s LEU 69 Ca -0.03 -0.52 0.08 0.00 0.69 0.00 0.00 54.13 54.35 2nr2 s LEU 69 Cb -0.14 -2.03 -0.04 0.00 -0.43 0.00 0.00 46.19 43.56 2nr2 s LEU 69 CO -0.04 -0.21 0.23 0.68 -0.29 0.00 0.00 176.35 176.73 2nr2 s VAL 70 N 1.63 2.98 -0.42 1.68 -7.23 0.65 -2.39 120.40 117.30 2nr2 s VAL 70 Ca 0.05 -1.55 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 2nr2 s VAL 70 Cb -0.17 -3.03 0.01 0.00 0.56 0.00 0.00 36.38 33.74 2nr2 s VAL 70 CO 0.07 -0.12 1.41 -0.22 -0.31 0.00 0.00 175.10 175.93 2nr2 s LEU 71 N -3.95 3.57 -0.12 1.32 2.96 -1.26 -1.28 118.68 119.93 2nr2 s LEU 71 Ca 0.41 0.80 -0.06 0.00 -0.22 0.00 0.00 54.13 55.06 2nr2 s LEU 71 Cb -0.03 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2nr2 s LEU 71 CO 0.25 -1.45 0.09 -0.60 -1.32 0.00 0.00 176.35 173.32 2nr2 s ARG 72 N 4.97 3.38 0.36 1.98 3.00 -0.06 -4.88 118.95 127.70 2nr2 s ARG 72 Ca 0.61 -0.23 0.08 0.00 -1.00 0.00 0.00 55.73 55.19 2nr2 s ARG 72 Cb -0.13 -3.08 -0.05 0.00 0.00 0.00 0.00 34.95 31.69 2nr2 s ARG 72 CO 0.33 0.69 0.14 -0.51 0.00 0.00 0.00 175.30 175.95 2nr2 s LEU 73 N -0.81 3.17 0.23 -0.88 1.43 -1.26 -4.27 118.68 116.29 2nr2 s LEU 73 Ca 0.13 -0.90 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 2nr2 s LEU 73 Cb -0.12 -1.59 -0.09 0.00 0.03 0.00 0.00 46.19 44.43 2nr2 s LEU 73 CO 0.03 -0.37 0.97 -0.60 0.23 0.00 0.00 176.35 176.60 2nr2 s ARG 74 N -3.85 4.81 0.00 1.70 3.52 -1.26 -4.70 118.95 119.17 2nr2 s ARG 74 Ca 0.39 1.53 0.00 0.00 -0.13 0.00 0.00 55.73 57.52 2nr2 s ARG 74 Cb -0.00 -3.28 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 2nr2 s ARG 74 CO 0.22 0.43 0.00 0.41 -0.81 0.00 0.00 175.30 175.56 2nr2 n GLY 75 N 1.56 -0.69 0.00 8.12 0.00 -1.26 -5.28 105.19 107.64 2nr2 n GLY 75 Ca -0.01 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93