#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 4.16 0.22 2.12 -0.21 -1.26 -1.28 119.66 123.41 2nr2 s GLN 2 Ca 0.00 0.38 0.09 0.00 0.02 0.00 0.00 55.36 55.85 2nr2 s GLN 2 Cb 0.00 -3.58 -0.05 0.00 1.00 0.00 0.00 33.01 30.38 2nr2 s GLN 2 CO 0.00 -0.18 -0.16 0.96 -2.12 0.00 0.00 175.29 173.79 2nr2 s ILE 3 N 1.75 1.92 -0.17 1.08 -4.36 -0.94 -0.57 121.20 119.91 2nr2 s ILE 3 Ca 0.23 -2.23 -0.05 0.00 -0.26 0.00 0.00 60.65 58.35 2nr2 s ILE 3 Cb -0.15 -2.08 -0.03 0.00 1.25 0.00 0.00 42.46 41.44 2nr2 s ILE 3 CO 0.09 -0.52 -0.01 -0.36 0.24 0.00 0.00 174.94 174.38 2nr2 s PHE 4 N -2.77 3.06 -0.38 1.37 0.08 -0.33 -1.80 117.98 117.20 2nr2 s PHE 4 Ca 0.24 -0.30 -0.10 0.00 0.12 0.00 0.00 56.93 56.89 2nr2 s PHE 4 Cb -0.02 -2.02 0.05 0.00 -0.57 0.00 0.00 43.02 40.46 2nr2 s PHE 4 CO 0.09 -0.07 0.21 0.08 -0.10 0.00 0.00 175.22 175.42 2nr2 s VAL 5 N 0.57 4.34 -0.16 -0.44 1.01 -0.32 -1.19 120.40 124.21 2nr2 s VAL 5 Ca -0.01 -1.08 -0.06 0.00 0.00 0.00 0.00 61.98 60.83 2nr2 s VAL 5 Cb -0.14 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2nr2 s VAL 5 CO 0.02 -0.32 0.05 -0.75 0.00 0.00 0.00 175.10 174.10 2nr2 s LYS 6 N 1.49 3.77 0.32 2.72 2.20 -0.76 -1.08 119.74 128.40 2nr2 s LYS 6 Ca 0.02 -0.36 0.06 0.00 -0.36 0.00 0.00 55.97 55.33 2nr2 s LYS 6 Cb -0.20 -3.12 -0.01 0.00 -1.51 0.00 0.00 37.83 32.98 2nr2 s LYS 6 CO 0.05 0.37 0.44 0.95 -0.36 0.00 0.00 175.35 176.80 2nr2 s THR 7 N 0.09 4.25 -1.76 3.43 -4.23 -0.51 -0.11 115.64 116.80 2nr2 s THR 7 Ca 0.04 -1.01 0.29 0.00 -1.18 0.00 0.00 61.69 59.83 2nr2 s THR 7 Cb -0.12 -3.47 0.51 0.00 1.34 0.00 0.00 72.50 70.76 2nr2 s THR 7 CO 0.01 -0.19 1.89 0.18 -0.54 0.00 0.00 174.62 175.98 2nr2 n LEU 8 N -1.59 0.50 -0.02 4.79 4.77 -1.24 -4.00 117.00 120.21 2nr2 n LEU 8 Ca -0.02 -0.04 -0.08 0.00 -0.03 0.00 0.00 56.01 55.85 2nr2 n LEU 8 Cb 0.58 -0.15 -0.14 0.00 -2.33 0.00 0.00 43.42 41.38 2nr2 n LEU 8 CO 0.42 0.09 -0.51 0.35 -1.33 0.00 0.00 177.39 176.41 2nr2 n THR 9 N -0.86 1.60 0.00 -5.08 -2.24 -1.26 -4.97 114.28 101.47 2nr2 n THR 9 Ca 0.16 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2nr2 n THR 9 Cb 0.27 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.46 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 1.55 0.51 3.39 3.38 0.00 -1.26 -5.16 105.19 107.60 2nr2 n GLY 10 Ca -0.16 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 0.56 -0.03 1.61 2.20 -1.26 -5.04 119.74 117.77 2nr2 s LYS 11 Ca 0.00 0.72 0.01 0.00 -0.36 0.00 0.00 55.97 56.34 2nr2 s LYS 11 Cb 0.00 0.24 0.02 0.00 -1.51 0.00 0.00 37.83 36.58 2nr2 s LYS 11 CO 0.00 -0.08 -0.02 0.99 -0.36 0.00 0.00 175.35 175.88 2nr2 s THR 12 N 0.45 0.31 0.13 3.43 2.01 -1.26 -1.43 115.64 119.28 2nr2 s THR 12 Ca -0.02 -0.01 0.07 0.00 0.31 0.00 0.00 61.69 62.04 2nr2 s THR 12 Cb -0.04 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 2nr2 s THR 12 CO -0.02 0.16 -0.17 0.27 -0.69 0.00 0.00 174.62 174.18 2nr2 s ILE 13 N 0.84 1.58 -0.35 1.82 -4.36 -0.24 -4.98 121.20 115.51 2nr2 s ILE 13 Ca -0.09 -1.74 -0.06 0.00 -0.26 0.00 0.00 60.65 58.49 2nr2 s ILE 13 Cb -0.13 -1.63 0.05 0.00 1.25 0.00 0.00 42.46 42.00 2nr2 s ILE 13 CO -0.01 -0.30 0.12 -0.89 0.24 0.00 0.00 174.94 174.10 2nr2 s THR 14 N -1.88 3.78 0.32 8.37 2.01 -1.26 -1.17 115.64 125.81 2nr2 s THR 14 Ca 0.10 -1.19 -0.09 0.00 0.31 0.00 0.00 61.69 60.82 2nr2 s THR 14 Cb -0.06 -3.17 -0.06 0.00 0.01 0.00 0.00 72.50 69.21 2nr2 s THR 14 CO 0.05 -0.22 0.65 -0.76 -0.69 0.00 0.00 174.62 173.65 2nr2 s LEU 15 N 1.39 4.00 -0.20 4.42 1.43 -0.75 -4.97 118.68 124.01 2nr2 s LEU 15 Ca -0.01 0.97 0.00 0.00 -1.03 0.00 0.00 54.13 54.06 2nr2 s LEU 15 Cb -0.20 -3.79 0.05 0.00 0.03 0.00 0.00 46.19 42.27 2nr2 s LEU 15 CO 0.02 -0.25 -0.07 -1.61 0.23 0.00 0.00 176.35 174.68 2nr2 s GLU 16 N -3.46 1.68 0.00 1.70 2.02 -1.26 -2.22 118.70 117.16 2nr2 s GLU 16 Ca 0.48 -0.76 0.00 0.00 0.02 0.00 0.00 54.97 54.72 2nr2 s GLU 16 Cb -0.11 -2.32 0.00 0.00 0.10 0.00 0.00 34.13 31.81 2nr2 s GLU 16 CO 0.27 -0.48 0.00 1.33 0.02 0.00 0.00 175.26 176.40 2nr2 n VAL 17 N 4.76 0.00 -4.44 2.63 0.24 -0.40 -4.91 118.33 116.20 2nr2 n VAL 17 Ca -0.13 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 61.96 2nr2 n VAL 17 Cb 0.46 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.73 2nr2 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2nr2 s GLU 18 N -0.29 1.66 0.41 7.34 2.02 -1.26 0.51 118.70 129.08 2nr2 s GLU 18 Ca 0.00 -1.93 0.29 0.00 0.02 0.00 0.00 54.97 53.35 2nr2 s GLU 18 Cb 0.00 -0.76 1.16 0.00 0.10 0.00 0.00 34.13 34.63 2nr2 s GLU 18 CO 0.00 -0.24 1.85 -1.35 0.02 0.00 0.00 175.26 175.54 2nr2 h PRO 19 N 2.11 0.00 -0.10 0.39 0.11 -1.93 -1.87 132.00 130.71 2nr2 h PRO 19 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2nr2 h PRO 19 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2nr2 h PRO 19 CO 0.67 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.89 2nr2 n SER 20 N -2.69 1.49 -4.76 -2.05 7.64 -1.26 0.28 113.62 112.27 2nr2 n SER 20 Ca 0.01 -1.60 -0.40 0.00 1.01 0.00 0.00 58.87 57.90 2nr2 n SER 20 Cb 0.28 -0.06 -0.05 0.00 -1.01 0.00 0.00 64.21 63.38 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2nr2 s ASP 21 N -1.74 7.23 0.78 6.43 1.01 -0.71 -4.74 116.67 124.94 2nr2 s ASP 21 Ca 0.35 2.18 -0.11 0.00 0.71 0.00 0.00 52.55 55.67 2nr2 s ASP 21 Cb 0.19 -2.62 0.06 0.00 1.01 0.00 0.00 42.92 41.56 2nr2 s ASP 21 CO 0.29 -0.16 1.09 0.42 0.21 0.00 0.00 175.17 177.02 2nr2 s THR 22 N -1.26 3.23 0.30 -1.27 -4.23 -1.26 -1.67 115.64 109.49 2nr2 s THR 22 Ca 0.46 0.40 0.04 0.00 -1.18 0.00 0.00 61.69 61.42 2nr2 s THR 22 Cb -0.29 -3.15 0.07 0.00 1.34 0.00 0.00 72.50 70.46 2nr2 s THR 22 CO 0.37 -0.52 1.74 0.40 -0.54 0.00 0.00 174.62 176.07 2nr2 h ILE 23 N -1.02 1.27 -0.65 2.99 1.08 -0.29 -1.77 117.51 119.12 2nr2 h ILE 23 Ca -0.46 -1.28 0.12 0.00 -0.39 0.00 0.00 64.86 62.85 2nr2 h ILE 23 Cb 1.26 1.42 -0.09 0.00 -3.07 0.00 0.00 36.82 36.34 2nr2 h ILE 23 CO 0.59 0.40 0.19 -0.08 -0.69 0.00 0.00 178.15 178.56 2nr2 h GLU 24 N 0.34 0.32 0.00 2.37 4.81 -1.63 -0.28 114.58 120.51 2nr2 h GLU 24 Ca 0.05 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.19 2nr2 h GLU 24 Cb 0.67 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2nr2 h GLU 24 CO 0.05 0.21 -0.32 -0.91 -0.73 0.00 0.00 179.01 177.31 2nr2 h ASN 25 N 0.33 0.00 -0.05 1.04 4.21 -1.64 -1.31 115.58 118.16 2nr2 h ASN 25 Ca 0.35 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.74 2nr2 h ASN 25 Cb 0.52 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.73 2nr2 h ASN 25 CO -0.40 0.32 -0.45 0.58 -1.29 0.00 0.00 177.43 176.19 2nr2 h VAL 26 N 0.00 1.42 -0.74 2.81 2.07 -0.99 -2.73 116.25 118.10 2nr2 h VAL 26 Ca -0.00 -1.88 -0.04 0.00 0.82 0.00 0.00 66.70 65.60 2nr2 h VAL 26 Cb 0.60 2.41 -0.03 0.00 -1.52 0.00 0.00 31.29 32.75 2nr2 h VAL 26 CO 0.04 0.55 0.30 0.11 0.02 0.00 0.00 177.57 178.59 2nr2 h LYS 27 N -0.10 1.08 -0.12 1.57 1.57 -1.01 -2.02 116.57 117.54 2nr2 h LYS 27 Ca -0.04 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.45 2nr2 h LYS 27 Cb 1.12 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2nr2 h LYS 27 CO 0.09 0.87 -0.40 0.00 -0.57 0.00 0.00 179.45 179.44 2nr2 h ALA 28 N 1.27 1.10 0.49 3.86 0.00 -1.28 0.25 119.26 124.94 2nr2 h ALA 28 Ca 0.25 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2nr2 h ALA 28 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2nr2 h ALA 28 CO -0.02 0.59 -0.23 0.87 0.00 0.00 0.00 179.25 180.45 2nr2 h LYS 29 N 0.23 -0.63 -1.01 0.00 6.56 -1.28 -2.41 116.57 118.04 2nr2 h LYS 29 Ca 0.02 0.04 0.14 0.00 -1.06 0.00 0.00 60.65 59.79 2nr2 h LYS 29 Cb 0.81 0.14 -0.09 0.00 -0.57 0.00 0.00 32.23 32.52 2nr2 h LYS 29 CO 0.06 -0.39 0.63 0.82 -2.06 0.00 0.00 179.45 178.51 2nr2 h ILE 30 N -0.72 0.86 -0.92 1.86 2.04 -1.14 -2.39 117.51 117.10 2nr2 h ILE 30 Ca -0.07 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.50 2nr2 h ILE 30 Cb 0.54 -0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.41 2nr2 h ILE 30 CO 0.11 0.17 0.60 -0.61 0.00 0.00 0.00 178.15 178.42 2nr2 h GLN 31 N 0.94 1.13 0.26 2.37 4.15 -0.33 0.15 115.11 123.78 2nr2 h GLN 31 Ca 0.52 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.86 2nr2 h GLN 31 Cb 0.60 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2nr2 h GLN 31 CO -0.30 0.75 -0.12 0.22 -1.93 0.00 0.00 178.83 177.45 2nr2 h ASP 32 N 1.17 -0.30 0.00 -0.69 3.58 -1.01 -2.77 116.42 116.40 2nr2 h ASP 32 Ca 0.36 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2nr2 h ASP 32 Cb -0.01 0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2nr2 h ASP 32 CO -0.10 0.16 0.00 0.29 -2.88 0.00 0.00 179.24 176.70 2nr2 n LYS 33 N -5.04 0.00 0.14 0.28 5.02 -0.94 -4.29 118.16 113.33 2nr2 n LYS 33 Ca -0.09 0.22 0.02 0.00 -2.02 0.00 0.00 58.31 56.44 2nr2 n LYS 33 Cb 0.26 -1.07 0.07 0.00 -0.02 0.00 0.00 35.03 34.28 2nr2 n LYS 33 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2nr2 h GLU 34 N 0.00 0.00 0.00 1.97 4.39 -0.90 -3.47 114.58 116.57 2nr2 h GLU 34 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2nr2 h GLU 34 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2nr2 h GLU 34 CO 0.00 0.53 0.00 0.41 -1.16 0.00 0.00 179.01 178.79 2nr2 n GLY 35 N 1.05 0.87 3.69 -3.84 0.00 -1.04 -5.02 105.19 100.89 2nr2 n GLY 35 Ca 0.01 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.00 5.05 0.80 -0.61 1.01 -1.26 -4.98 121.20 119.22 2nr2 s ILE 36 Ca 0.00 1.22 -0.10 0.00 0.00 0.00 0.00 60.65 61.77 2nr2 s ILE 36 Cb 0.00 -3.95 0.08 0.00 0.01 0.00 0.00 42.46 38.59 2nr2 s ILE 36 CO 0.00 0.18 1.10 -2.16 0.00 0.00 0.00 174.94 174.06 2nr2 s PRO 37 N 1.40 1.98 0.00 2.79 0.04 -1.26 -4.13 135.00 135.82 2nr2 s PRO 37 Ca 0.31 1.21 0.29 0.00 0.04 0.00 0.00 61.00 62.85 2nr2 s PRO 37 Cb -0.16 -1.86 1.35 0.00 0.04 0.00 0.00 34.50 33.87 2nr2 s PRO 37 CO 0.12 -1.85 1.97 -0.35 0.04 0.00 0.00 177.00 176.93 2nr2 n PRO 38 N -3.67 0.25 0.15 0.56 -0.04 -1.26 -2.25 135.00 128.74 2nr2 n PRO 38 Ca 0.09 -0.01 0.08 0.00 -0.04 0.00 0.00 63.50 63.62 2nr2 n PRO 38 Cb 0.53 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.56 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2nr2 h ASP 39 N 0.03 0.00 1.81 3.54 3.32 -2.00 -3.33 116.42 119.79 2nr2 h ASP 39 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2nr2 h ASP 39 Cb 0.39 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 2nr2 h ASP 39 CO 0.00 0.22 -0.19 -0.61 -1.72 0.00 0.00 179.24 176.94 2nr2 h GLN 40 N 0.00 0.00 -6.05 3.56 4.15 -1.80 -3.45 115.11 111.51 2nr2 h GLN 40 Ca -0.02 0.00 -0.68 0.00 0.77 0.00 0.00 58.65 58.72 2nr2 h GLN 40 Cb 1.19 0.00 -0.24 0.00 0.21 0.00 0.00 27.48 28.64 2nr2 h GLN 40 CO 0.03 0.13 -0.76 1.14 -1.93 0.00 0.00 178.83 177.44 2nr2 s GLN 41 N -3.15 2.76 -0.07 1.69 -2.07 -1.23 -0.78 119.66 116.81 2nr2 s GLN 41 Ca 0.06 -0.67 0.05 0.00 -1.82 0.00 0.00 55.36 52.98 2nr2 s GLN 41 Cb 0.06 -2.47 -0.01 0.00 -1.09 0.00 0.00 33.01 29.50 2nr2 s GLN 41 CO 0.70 0.52 -0.25 1.03 -1.32 0.00 0.00 175.29 175.97 2nr2 s ARG 42 N -0.46 2.72 -0.24 9.60 3.00 -0.17 -4.94 118.95 128.46 2nr2 s ARG 42 Ca 0.06 -0.90 -0.08 0.00 0.00 0.00 0.00 55.73 54.82 2nr2 s ARG 42 Cb -0.12 -2.21 -0.03 0.00 0.00 0.00 0.00 34.95 32.59 2nr2 s ARG 42 CO 0.02 0.31 0.08 -0.51 0.00 0.00 0.00 175.30 175.20 2nr2 s LEU 43 N 0.01 3.54 -0.14 2.53 1.43 -1.26 -1.07 118.68 123.72 2nr2 s LEU 43 Ca -0.09 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 52.84 2nr2 s LEU 43 Cb -0.15 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.10 2nr2 s LEU 43 CO 0.06 -0.01 -0.08 -0.63 0.23 0.00 0.00 176.35 175.92 2nr2 s ILE 44 N 1.46 3.52 -0.16 -0.59 -1.09 0.21 -0.58 121.20 123.97 2nr2 s ILE 44 Ca 0.06 -0.50 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 2nr2 s ILE 44 Cb -0.15 -2.51 0.03 0.00 -1.58 0.00 0.00 42.46 38.25 2nr2 s ILE 44 CO 0.04 0.52 -0.13 0.12 -1.23 0.00 0.00 174.94 174.25 2nr2 s PHE 45 N 0.23 2.26 0.00 3.97 5.36 0.40 -0.30 117.98 129.91 2nr2 s PHE 45 Ca -0.05 -1.34 0.00 0.00 -0.96 0.00 0.00 56.93 54.58 2nr2 s PHE 45 Cb -0.15 -1.62 0.00 0.00 -0.34 0.00 0.00 43.02 40.91 2nr2 s PHE 45 CO 0.04 -0.70 0.00 0.00 -1.46 0.00 0.00 175.22 173.10 2nr2 n ALA 46 N 4.74 0.00 -0.00 11.12 0.00 -1.26 -2.48 120.51 132.63 2nr2 n ALA 46 Ca -0.16 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.28 2nr2 n ALA 46 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.93 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 0.00 -0.06 3.64 0.00 0.00 -1.26 -5.06 105.19 102.44 2nr2 n GLY 47 Ca 0.00 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.09 3.71 0.37 1.61 1.02 -1.04 -5.08 119.74 118.25 2nr2 s LYS 48 Ca -0.01 -0.37 -0.25 0.00 0.02 0.00 0.00 55.97 55.37 2nr2 s LYS 48 Cb 0.01 -3.08 -0.09 0.00 -0.52 0.00 0.00 37.83 34.14 2nr2 s LYS 48 CO 0.06 0.39 1.04 -1.14 -0.92 0.00 0.00 175.35 174.77 2nr2 s GLN 49 N 0.03 4.29 -0.02 1.68 0.74 -1.26 -0.45 119.66 124.66 2nr2 s GLN 49 Ca 0.04 1.51 -0.07 0.00 0.05 0.00 0.00 55.36 56.90 2nr2 s GLN 49 Cb -0.12 -2.65 -0.05 0.00 1.10 0.00 0.00 33.01 31.29 2nr2 s GLN 49 CO 0.01 -0.03 0.24 -0.51 -0.55 0.00 0.00 175.29 174.45 2nr2 s LEU 50 N -2.42 4.38 -0.09 3.68 1.43 0.25 -4.93 118.68 120.98 2nr2 s LEU 50 Ca 0.55 0.54 -0.13 0.00 -1.03 0.00 0.00 54.13 54.07 2nr2 s LEU 50 Cb -0.22 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.42 2nr2 s LEU 50 CO 0.28 0.29 0.30 -0.70 0.23 0.00 0.00 176.35 176.76 2nr2 s GLU 51 N -1.58 3.95 0.04 1.70 2.56 -1.26 -4.78 118.70 119.33 2nr2 s GLU 51 Ca 0.25 0.16 -0.12 0.00 0.00 0.00 0.00 54.97 55.26 2nr2 s GLU 51 Cb -0.13 -3.30 -0.04 0.00 2.00 0.00 0.00 34.13 32.66 2nr2 s GLU 51 CO 0.14 0.52 1.20 -0.44 -0.56 0.00 0.00 175.26 176.12 2nr2 h ASP 52 N 5.59 -0.65 0.00 -1.70 5.19 -1.98 -2.96 116.42 119.91 2nr2 h ASP 52 Ca -0.48 0.08 -0.24 0.00 -0.62 0.00 0.00 57.03 55.77 2nr2 h ASP 52 Cb 1.20 0.26 -0.03 0.00 0.18 0.00 0.00 39.33 40.94 2nr2 h ASP 52 CO 0.67 -0.16 0.72 0.61 -3.12 0.00 0.00 179.24 177.96 2nr2 n GLY 53 N -1.15 2.81 3.16 2.75 0.00 -1.26 -1.84 105.19 109.67 2nr2 n GLY 53 Ca -0.02 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.91 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 1.85 0.82 0.70 1.61 1.81 -1.12 -4.99 118.95 119.62 2nr2 s ARG 54 Ca 0.51 -1.24 -0.04 0.00 -1.72 0.00 0.00 55.73 53.25 2nr2 s ARG 54 Cb 0.21 -0.31 0.09 0.00 -0.45 0.00 0.00 34.95 34.49 2nr2 s ARG 54 CO -0.01 0.02 0.98 0.95 -0.68 0.00 0.00 175.30 176.55 2nr2 s THR 55 N -3.09 2.31 0.14 0.02 -4.23 -1.26 -0.96 115.64 108.56 2nr2 s THR 55 Ca 0.08 -0.43 -0.09 0.00 -1.18 0.00 0.00 61.69 60.07 2nr2 s THR 55 Cb 0.02 -2.87 -0.11 0.00 1.34 0.00 0.00 72.50 70.87 2nr2 s THR 55 CO -0.03 0.00 1.39 -0.07 -0.54 0.00 0.00 174.62 175.37 2nr2 h LEU 56 N -0.51 0.82 -1.11 4.79 3.38 -0.89 -3.27 115.31 118.51 2nr2 h LEU 56 Ca -0.42 -0.49 0.06 0.00 0.09 0.00 0.00 57.88 57.13 2nr2 h LEU 56 Cb 1.29 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.74 2nr2 h LEU 56 CO 0.50 1.26 0.60 -1.28 0.09 0.00 0.00 178.44 179.62 2nr2 h SER 57 N 0.51 0.95 -0.31 -0.43 0.87 -0.40 -0.46 113.55 114.28 2nr2 h SER 57 Ca -0.02 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2nr2 h SER 57 Cb 1.27 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 63.01 2nr2 h SER 57 CO 0.13 0.61 0.21 0.44 -0.53 0.00 0.00 176.83 177.69 2nr2 h ASP 58 N 1.07 0.33 -0.55 6.23 3.32 -1.83 -1.94 116.42 123.05 2nr2 h ASP 58 Ca 0.40 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.44 2nr2 h ASP 58 Cb 0.18 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2nr2 h ASP 58 CO -0.15 0.23 0.00 -1.22 -1.72 0.00 0.00 179.24 176.38 2nr2 n TYR 59 N -4.49 0.74 -3.97 4.55 4.01 -0.87 -4.93 117.16 112.19 2nr2 n TYR 59 Ca 0.02 -0.37 -0.27 0.00 -0.16 0.00 0.00 57.90 57.12 2nr2 n TYR 59 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.12 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 1.24 -1.43 -4.57 7.72 4.13 -0.73 -4.92 115.26 116.70 2nr2 n ASN 60 Ca 0.20 -0.96 -0.42 0.00 1.68 0.00 0.00 54.58 55.08 2nr2 n ASN 60 Cb 0.51 -3.21 -0.07 0.00 -1.54 0.00 0.00 39.78 35.47 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2nr2 s ILE 61 N -3.73 4.92 0.15 2.41 1.01 -0.23 -4.99 121.20 120.74 2nr2 s ILE 61 Ca 0.21 0.51 0.01 0.00 0.00 0.00 0.00 60.65 61.38 2nr2 s ILE 61 Cb -0.11 -4.05 0.03 0.00 0.01 0.00 0.00 42.46 38.34 2nr2 s ILE 61 CO 0.88 -0.29 0.21 0.00 0.00 0.00 0.00 174.94 175.74 2nr2 n GLN 62 N 5.97 0.73 -2.06 2.79 10.64 -1.26 -4.51 117.38 129.67 2nr2 n GLN 62 Ca -0.02 -0.71 -0.39 0.00 -1.83 0.00 0.00 57.00 54.05 2nr2 n GLN 62 Cb 0.49 -0.10 -0.00 0.00 -0.86 0.00 0.00 30.24 29.77 2nr2 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 2nr2 s LYS 63 N -2.78 3.83 -0.86 2.61 -2.85 -1.26 -3.71 119.74 114.72 2nr2 s LYS 63 Ca 0.15 2.09 0.00 0.00 -1.00 0.00 0.00 55.97 57.21 2nr2 s LYS 63 Cb -0.01 -2.63 0.00 0.00 -2.06 0.00 0.00 37.83 33.13 2nr2 s LYS 63 CO 0.10 -0.58 0.00 0.39 0.10 0.00 0.00 175.35 175.35 2nr2 n GLU 64 N -0.12 -0.68 -2.72 1.78 1.02 0.26 -4.98 120.64 115.20 2nr2 n GLU 64 Ca 0.05 0.75 -0.40 0.00 -0.02 0.00 0.00 57.16 57.54 2nr2 n GLU 64 Cb 0.45 -4.61 -0.06 0.00 -0.02 0.00 0.00 31.44 27.20 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2nr2 s SER 65 N -2.78 7.60 -0.61 1.62 0.01 -1.24 -4.71 113.70 113.60 2nr2 s SER 65 Ca 0.00 1.98 -0.21 0.00 1.31 0.00 0.00 55.95 59.03 2nr2 s SER 65 Cb 0.00 -2.61 0.08 0.00 0.21 0.00 0.00 66.02 63.69 2nr2 s SER 65 CO 0.00 0.11 0.84 -0.89 0.41 0.00 0.00 173.24 173.71 2nr2 s THR 66 N -1.12 4.55 0.32 1.44 2.01 -1.26 -1.19 115.64 120.39 2nr2 s THR 66 Ca 0.42 -0.50 -0.26 0.00 0.31 0.00 0.00 61.69 61.65 2nr2 s THR 66 Cb -0.27 -4.56 -0.10 0.00 0.01 0.00 0.00 72.50 67.59 2nr2 s THR 66 CO 0.33 -1.23 0.95 -0.76 -0.69 0.00 0.00 174.62 173.22 2nr2 s LEU 67 N 3.44 4.36 -0.29 4.42 1.02 -0.33 -4.78 118.68 126.52 2nr2 s LEU 67 Ca 0.19 1.87 -0.07 0.00 0.02 0.00 0.00 54.13 56.14 2nr2 s LEU 67 Cb -0.19 -3.98 0.00 0.00 0.02 0.00 0.00 46.19 42.05 2nr2 s LEU 67 CO 0.10 -0.07 0.07 -1.00 0.02 0.00 0.00 176.35 175.47 2nr2 s HIS 68 N -1.57 3.13 -0.26 0.29 3.76 0.59 -1.84 115.29 119.40 2nr2 s HIS 68 Ca 0.50 -0.91 -0.19 0.00 -0.15 0.00 0.00 55.06 54.31 2nr2 s HIS 68 Cb -0.20 -2.25 -0.02 0.00 1.11 0.00 0.00 32.58 31.22 2nr2 s HIS 68 CO 0.25 -0.55 0.55 -1.17 -0.85 0.00 0.00 174.74 172.97 2nr2 s LEU 69 N 1.51 4.06 0.07 0.89 0.20 0.85 -0.62 118.68 125.65 2nr2 s LEU 69 Ca 0.03 0.56 0.08 0.00 0.69 0.00 0.00 54.13 55.49 2nr2 s LEU 69 Cb -0.17 -2.72 -0.04 0.00 -0.43 0.00 0.00 46.19 42.84 2nr2 s LEU 69 CO 0.02 -0.32 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.90 2nr2 s VAL 70 N 2.37 2.87 0.19 1.68 1.01 -0.23 -3.71 120.40 124.58 2nr2 s VAL 70 Ca 0.23 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 60.94 2nr2 s VAL 70 Cb -0.16 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2nr2 s VAL 70 CO 0.09 0.23 0.22 -0.76 0.00 0.00 0.00 175.10 174.88 2nr2 s LEU 71 N -1.77 4.02 -1.04 3.92 1.43 -1.26 -0.99 118.68 122.98 2nr2 s LEU 71 Ca 0.16 -0.05 -0.23 0.00 -1.03 0.00 0.00 54.13 52.98 2nr2 s LEU 71 Cb -0.11 -2.59 0.02 0.00 0.03 0.00 0.00 46.19 43.54 2nr2 s LEU 71 CO 0.08 0.02 1.67 -0.60 0.23 0.00 0.00 176.35 177.74 2nr2 s ARG 72 N -3.45 3.27 0.07 1.70 3.52 0.04 -4.40 118.95 119.71 2nr2 s ARG 72 Ca 0.33 -1.02 -0.01 0.00 -0.13 0.00 0.00 55.73 54.90 2nr2 s ARG 72 Cb -0.10 -5.29 -0.01 0.00 -1.56 0.00 0.00 34.95 28.00 2nr2 s ARG 72 CO 0.26 -2.68 -0.03 1.28 -0.81 0.00 0.00 175.30 173.32 2nr2 n LEU 73 N 10.66 1.08 -4.79 -0.88 4.77 -1.26 -5.05 117.00 121.53 2nr2 n LEU 73 Ca 0.38 0.14 -0.34 0.00 -0.03 0.00 0.00 56.01 56.16 2nr2 n LEU 73 Cb 0.49 -0.34 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2nr2 n LEU 73 CO 0.66 -0.65 0.73 -0.13 -1.33 0.00 0.00 177.39 176.67 2nr2 s ARG 74 N -2.07 3.64 0.10 3.23 1.81 -1.26 -5.02 118.95 119.38 2nr2 s ARG 74 Ca -0.02 1.40 -0.34 0.00 -1.72 0.00 0.00 55.73 55.04 2nr2 s ARG 74 Cb 0.00 -2.07 -0.14 0.00 -0.45 0.00 0.00 34.95 32.30 2nr2 s ARG 74 CO 0.03 -0.57 1.57 0.78 -0.68 0.00 0.00 175.30 176.43 2nr2 h GLY 75 N 1.34 -1.10 0.00 -3.53 0.00 -1.96 -3.51 103.07 94.32 2nr2 h GLY 75 Ca -0.49 0.59 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2nr2 h GLY 75 CO 0.58 -0.29 0.00 0.61 0.00 0.00 0.00 176.54 177.44