#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 3.85 0.24 3.17 -0.21 -1.26 -0.70 119.66 124.74 2nr2 s GLN 2 Ca 0.00 -0.29 0.03 0.00 0.02 0.00 0.00 55.36 55.11 2nr2 s GLN 2 Cb 0.00 -3.21 -0.05 0.00 1.00 0.00 0.00 33.01 30.75 2nr2 s GLN 2 CO 0.00 0.40 0.03 0.96 -2.12 0.00 0.00 175.29 174.56 2nr2 s ILE 3 N 0.04 0.85 0.10 1.08 -4.36 -0.38 0.04 121.20 118.57 2nr2 s ILE 3 Ca 0.07 -2.01 0.09 0.00 -0.26 0.00 0.00 60.65 58.53 2nr2 s ILE 3 Cb -0.12 -2.43 -0.03 0.00 1.25 0.00 0.00 42.46 41.13 2nr2 s ILE 3 CO 0.00 -0.23 -0.22 -0.36 0.24 0.00 0.00 174.94 174.37 2nr2 s PHE 4 N -3.54 1.89 -0.13 1.37 0.08 -0.45 -1.62 117.98 115.57 2nr2 s PHE 4 Ca 0.31 -0.41 -0.00 0.00 0.12 0.00 0.00 56.93 56.95 2nr2 s PHE 4 Cb 0.07 -1.05 0.03 0.00 -0.57 0.00 0.00 43.02 41.50 2nr2 s PHE 4 CO 0.10 0.21 -0.09 0.08 -0.10 0.00 0.00 175.22 175.42 2nr2 s VAL 5 N -1.08 1.15 -0.16 -0.44 1.01 -0.86 -1.20 120.40 118.82 2nr2 s VAL 5 Ca 0.08 -0.40 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 2nr2 s VAL 5 Cb -0.10 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 2nr2 s VAL 5 CO 0.04 0.36 -0.05 -0.75 0.00 0.00 0.00 175.10 174.70 2nr2 s LYS 6 N 1.65 3.62 0.31 2.72 2.20 -0.92 -1.14 119.74 128.18 2nr2 s LYS 6 Ca 0.05 -0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 55.09 2nr2 s LYS 6 Cb -0.13 -2.89 0.06 0.00 -1.51 0.00 0.00 37.83 33.36 2nr2 s LYS 6 CO -0.09 0.20 0.42 0.25 -0.36 0.00 0.00 175.35 175.78 2nr2 n THR 7 N 3.64 0.00 1.14 3.43 -2.24 -1.06 -2.63 114.28 116.56 2nr2 n THR 7 Ca -0.17 -0.58 0.11 0.00 -2.27 0.00 0.00 64.05 61.14 2nr2 n THR 7 Cb 0.52 -1.31 0.36 0.00 -2.10 0.00 0.00 70.33 67.80 2nr2 n THR 7 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2nr2 n LEU 8 N 0.00 1.93 0.09 3.22 4.77 -1.26 -3.98 117.00 121.77 2nr2 n LEU 8 Ca 0.07 -0.78 -0.06 0.00 -0.03 0.00 0.00 56.01 55.20 2nr2 n LEU 8 Cb 0.23 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2nr2 n LEU 8 CO 0.16 0.39 0.27 0.71 -1.33 0.00 0.00 177.39 177.59 2nr2 h THR 9 N 2.63 1.56 0.00 -5.08 1.35 -1.97 -3.46 112.91 107.93 2nr2 h THR 9 Ca 0.00 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.07 2nr2 h THR 9 Cb 0.57 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 2nr2 h THR 9 CO 0.00 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 176.68 2nr2 n GLY 10 N 0.90 1.01 3.73 5.82 0.00 -1.26 -5.10 105.19 110.29 2nr2 n GLY 10 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 4.20 -0.30 1.61 2.20 -1.26 -4.87 119.74 121.32 2nr2 s LYS 11 Ca 0.00 2.40 -0.11 0.00 -0.36 0.00 0.00 55.97 57.91 2nr2 s LYS 11 Cb 0.00 -3.12 -0.03 0.00 -1.51 0.00 0.00 37.83 33.17 2nr2 s LYS 11 CO 0.00 -0.60 0.18 0.99 -0.36 0.00 0.00 175.35 175.56 2nr2 s THR 12 N 0.87 4.96 -0.38 3.43 2.01 -1.26 -2.55 115.64 122.72 2nr2 s THR 12 Ca 0.68 -0.15 -0.12 0.00 0.31 0.00 0.00 61.69 62.42 2nr2 s THR 12 Cb -0.45 -3.46 0.03 0.00 0.01 0.00 0.00 72.50 68.64 2nr2 s THR 12 CO 0.35 0.14 0.23 -0.63 -0.69 0.00 0.00 174.62 174.01 2nr2 s ILE 13 N 1.69 4.67 0.00 1.82 1.01 -0.29 -4.99 121.20 125.11 2nr2 s ILE 13 Ca 0.06 -0.87 -0.27 0.00 0.00 0.00 0.00 60.65 59.57 2nr2 s ILE 13 Cb -0.17 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 2nr2 s ILE 13 CO 0.08 -0.27 0.83 -0.89 0.00 0.00 0.00 174.94 174.69 2nr2 s THR 14 N 1.57 4.86 -0.00 2.92 2.01 -1.26 -2.02 115.64 123.71 2nr2 s THR 14 Ca 0.02 1.75 0.02 0.00 0.31 0.00 0.00 61.69 63.80 2nr2 s THR 14 Cb -0.19 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.13 2nr2 s THR 14 CO 0.07 0.26 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.42 2nr2 s LEU 15 N 0.57 2.03 -0.16 4.42 1.43 -0.64 -5.00 118.68 121.33 2nr2 s LEU 15 Ca 0.43 -0.16 -0.25 0.00 -1.03 0.00 0.00 54.13 53.12 2nr2 s LEU 15 Cb -0.20 -0.39 -0.02 0.00 0.03 0.00 0.00 46.19 45.61 2nr2 s LEU 15 CO 0.24 0.08 0.83 -1.61 0.23 0.00 0.00 176.35 176.12 2nr2 s GLU 16 N -0.26 4.31 0.05 1.70 2.02 -1.26 -1.24 118.70 124.01 2nr2 s GLU 16 Ca 0.02 1.03 0.03 0.00 0.02 0.00 0.00 54.97 56.07 2nr2 s GLU 16 Cb -0.03 -3.56 -0.02 0.00 0.10 0.00 0.00 34.13 30.61 2nr2 s GLU 16 CO -0.00 -0.30 -0.10 0.14 0.02 0.00 0.00 175.26 175.02 2nr2 s VAL 17 N 2.05 0.70 -0.01 2.63 -7.23 0.12 -4.91 120.40 113.75 2nr2 s VAL 17 Ca 0.39 -1.09 -0.11 0.00 -1.81 0.00 0.00 61.98 59.36 2nr2 s VAL 17 Cb -0.17 -0.73 -0.05 0.00 0.56 0.00 0.00 36.38 35.99 2nr2 s VAL 17 CO 0.13 -0.30 0.32 -0.70 -0.31 0.00 0.00 175.10 174.24 2nr2 s GLU 18 N -1.53 3.72 0.22 4.82 2.56 -1.26 -0.11 118.70 127.12 2nr2 s GLU 18 Ca -0.07 0.16 0.25 0.00 0.00 0.00 0.00 54.97 55.31 2nr2 s GLU 18 Cb -0.09 -3.15 0.64 0.00 2.00 0.00 0.00 34.13 33.53 2nr2 s GLU 18 CO 0.01 0.68 1.65 -1.35 -0.56 0.00 0.00 175.26 175.69 2nr2 h PRO 19 N 4.46 0.00 0.00 4.30 0.10 -1.97 -2.43 132.00 136.46 2nr2 h PRO 19 Ca -0.52 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.58 2nr2 h PRO 19 Cb 1.21 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.31 2nr2 h PRO 19 CO 0.62 0.00 0.00 0.43 0.10 0.00 0.00 178.00 179.15 2nr2 n SER 20 N -2.34 0.26 -4.75 -2.05 7.64 -1.26 -1.60 113.62 109.53 2nr2 n SER 20 Ca 0.05 0.56 -0.31 0.00 1.01 0.00 0.00 58.87 60.17 2nr2 n SER 20 Cb 0.45 -0.62 0.10 0.00 -1.01 0.00 0.00 64.21 63.13 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 -3.49 4.24 0.81 6.43 1.11 -0.92 -4.77 116.67 120.08 2nr2 s ASP 21 Ca 0.07 1.95 -0.07 0.00 0.18 0.00 0.00 52.55 54.68 2nr2 s ASP 21 Cb 0.11 -2.54 0.15 0.00 1.07 0.00 0.00 42.92 41.71 2nr2 s ASP 21 CO 0.35 -2.22 1.12 0.42 1.18 0.00 0.00 175.17 176.02 2nr2 s THR 22 N -2.73 2.09 -0.19 -1.27 -4.23 -1.26 -2.31 115.64 105.74 2nr2 s THR 22 Ca 0.64 -0.36 0.17 0.00 -1.18 0.00 0.00 61.69 60.97 2nr2 s THR 22 Cb -0.19 -2.74 0.03 0.00 1.34 0.00 0.00 72.50 70.94 2nr2 s THR 22 CO 0.54 0.00 1.24 0.40 -0.54 0.00 0.00 174.62 176.26 2nr2 h ILE 23 N -0.94 0.55 0.00 2.99 2.04 -0.65 -3.14 117.51 118.35 2nr2 h ILE 23 Ca -0.40 -1.86 -0.04 0.00 1.00 0.00 0.00 64.86 63.57 2nr2 h ILE 23 Cb 1.26 2.15 -0.01 0.00 -0.74 0.00 0.00 36.82 39.48 2nr2 h ILE 23 CO 0.41 0.31 -0.17 -0.08 0.00 0.00 0.00 178.15 178.62 2nr2 h GLU 24 N 0.00 0.00 -0.10 2.37 4.81 -1.18 -1.81 114.58 118.66 2nr2 h GLU 24 Ca -0.05 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.99 2nr2 h GLU 24 Cb 1.35 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.73 2nr2 h GLU 24 CO 0.04 0.17 -0.73 -0.91 -0.73 0.00 0.00 179.01 176.86 2nr2 h ASN 25 N 0.00 0.60 -0.10 1.04 4.21 -1.82 -3.03 115.58 116.48 2nr2 h ASN 25 Ca -0.00 -0.39 -0.01 0.00 1.21 0.00 0.00 56.30 57.11 2nr2 h ASN 25 Cb 0.34 -0.18 -0.00 0.00 -1.12 0.00 0.00 38.32 37.35 2nr2 h ASN 25 CO 0.02 1.14 0.04 0.58 -1.29 0.00 0.00 177.43 177.92 2nr2 h VAL 26 N 0.35 1.14 -0.53 2.81 2.07 -1.53 -3.18 116.25 117.39 2nr2 h VAL 26 Ca -0.03 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.14 2nr2 h VAL 26 Cb 1.31 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 32.28 2nr2 h VAL 26 CO 0.13 0.12 0.35 0.11 0.02 0.00 0.00 177.57 178.30 2nr2 h LYS 27 N 0.01 0.47 0.00 1.57 1.57 -1.37 -0.39 116.57 118.43 2nr2 h LYS 27 Ca 0.03 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2nr2 h LYS 27 Cb 0.16 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 2nr2 h LYS 27 CO -0.00 0.31 -0.07 0.00 -0.57 0.00 0.00 179.45 179.12 2nr2 h ALA 28 N 1.71 1.31 -0.03 3.86 0.00 -1.51 -1.06 119.26 123.54 2nr2 h ALA 28 Ca 0.23 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 2nr2 h ALA 28 Cb 0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nr2 h ALA 28 CO -0.06 0.08 -0.66 0.87 0.00 0.00 0.00 179.25 179.49 2nr2 h LYS 29 N 0.00 0.14 0.00 0.00 1.57 -1.13 0.36 116.57 117.51 2nr2 h LYS 29 Ca -0.00 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 2nr2 h LYS 29 Cb 0.21 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2nr2 h LYS 29 CO 0.01 0.74 -0.33 0.82 -0.57 0.00 0.00 179.45 180.12 2nr2 h ILE 30 N 0.10 1.03 -0.25 1.86 1.08 -1.33 0.10 117.51 120.10 2nr2 h ILE 30 Ca -0.01 -1.23 -0.18 0.00 -0.39 0.00 0.00 64.86 63.05 2nr2 h ILE 30 Cb 1.17 1.70 -0.00 0.00 -3.07 0.00 0.00 36.82 36.62 2nr2 h ILE 30 CO 0.09 0.33 -0.57 -0.61 -0.69 0.00 0.00 178.15 176.70 2nr2 h GLN 31 N 0.00 0.79 -0.70 2.37 4.15 -0.18 -1.24 115.11 120.30 2nr2 h GLN 31 Ca -0.00 -0.52 -0.04 0.00 0.77 0.00 0.00 58.65 58.86 2nr2 h GLN 31 Cb 0.67 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.40 2nr2 h GLN 31 CO 0.04 1.14 0.29 0.22 -1.93 0.00 0.00 178.83 178.60 2nr2 h ASP 32 N 0.60 0.96 0.00 -0.69 3.58 -0.43 -2.27 116.42 118.17 2nr2 h ASP 32 Ca 0.01 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.28 2nr2 h ASP 32 Cb 1.17 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.97 2nr2 h ASP 32 CO 0.12 0.86 -0.25 0.11 -2.88 0.00 0.00 179.24 177.19 2nr2 h LYS 33 N 0.99 0.00 0.02 0.28 1.79 -0.95 -3.42 116.57 115.28 2nr2 h LYS 33 Ca 0.24 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.31 2nr2 h LYS 33 Cb 0.19 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.78 2nr2 h LYS 33 CO -0.02 0.18 -2.36 0.39 -1.08 0.00 0.00 179.45 176.56 2nr2 n GLU 34 N -4.68 0.65 -0.44 3.15 -0.58 -0.62 -5.06 120.64 113.06 2nr2 n GLU 34 Ca -0.06 0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 2nr2 n GLU 34 Cb 0.19 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 2nr2 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2nr2 n GLY 35 N 1.96 0.80 3.26 0.62 0.00 -0.57 -5.02 105.19 106.25 2nr2 n GLY 35 Ca -0.45 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.07 2.84 0.56 -0.61 1.01 -1.24 -4.97 121.20 116.71 2nr2 s ILE 36 Ca 0.00 -0.69 -0.20 0.00 0.00 0.00 0.00 60.65 59.76 2nr2 s ILE 36 Cb 0.00 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 2nr2 s ILE 36 CO 0.00 0.48 1.19 -2.16 0.00 0.00 0.00 174.94 174.45 2nr2 s PRO 37 N 1.16 3.21 0.00 2.79 0.04 -1.26 -3.82 135.00 137.11 2nr2 s PRO 37 Ca 0.01 1.78 0.10 0.00 0.04 0.00 0.00 61.00 62.93 2nr2 s PRO 37 Cb -0.14 -2.04 0.43 0.00 0.04 0.00 0.00 34.50 32.79 2nr2 s PRO 37 CO -0.04 -1.01 1.27 -2.30 0.04 0.00 0.00 177.00 174.96 2nr2 n PRO 38 N -1.31 0.05 0.06 0.56 -0.02 -1.26 -2.59 135.00 130.49 2nr2 n PRO 38 Ca 0.12 0.29 -0.11 0.00 -2.02 0.00 0.00 63.50 61.77 2nr2 n PRO 38 Cb 0.49 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.46 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2nr2 h ASP 39 N 0.00 0.48 1.48 2.55 1.82 -1.97 -3.17 116.42 117.61 2nr2 h ASP 39 Ca 0.00 -0.36 0.00 0.00 -0.39 0.00 0.00 57.03 56.28 2nr2 h ASP 39 Cb 0.14 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 40.00 2nr2 h ASP 39 CO 0.00 1.13 -0.09 -0.61 -1.61 0.00 0.00 179.24 178.07 2nr2 h GLN 40 N 0.24 0.00 -6.27 0.28 4.15 -1.87 -3.45 115.11 108.19 2nr2 h GLN 40 Ca -0.06 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.80 2nr2 h GLN 40 Cb 1.46 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.12 2nr2 h GLN 40 CO 0.14 0.00 1.07 -0.65 -1.93 0.00 0.00 178.83 177.47 2nr2 s GLN 41 N -3.13 3.93 -0.21 1.69 -0.21 -1.20 -0.78 119.66 119.75 2nr2 s GLN 41 Ca 0.09 1.71 -0.06 0.00 0.02 0.00 0.00 55.36 57.12 2nr2 s GLN 41 Cb 0.11 -3.97 -0.03 0.00 1.00 0.00 0.00 33.01 30.12 2nr2 s GLN 41 CO 0.63 -1.12 0.04 1.03 -2.12 0.00 0.00 175.29 173.75 2nr2 s ARG 42 N 4.35 3.73 -0.17 2.91 0.52 0.28 -4.91 118.95 125.66 2nr2 s ARG 42 Ca 0.68 -0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 55.41 2nr2 s ARG 42 Cb -0.25 -3.19 -0.01 0.00 0.52 0.00 0.00 34.95 32.01 2nr2 s ARG 42 CO 0.27 0.03 -0.08 -1.17 0.02 0.00 0.00 175.30 174.36 2nr2 s LEU 43 N 1.00 2.87 -0.16 2.53 2.96 -1.26 -0.81 118.68 125.81 2nr2 s LEU 43 Ca 0.03 -0.33 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 2nr2 s LEU 43 Cb -0.14 -1.69 -0.01 0.00 0.50 0.00 0.00 46.19 44.85 2nr2 s LEU 43 CO 0.02 0.09 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.39 2nr2 s ILE 44 N 0.84 2.93 -0.07 6.68 -1.09 -0.14 -1.27 121.20 129.09 2nr2 s ILE 44 Ca -0.02 -0.68 -0.02 0.00 -2.23 0.00 0.00 60.65 57.70 2nr2 s ILE 44 Cb -0.15 -2.25 0.03 0.00 -1.58 0.00 0.00 42.46 38.51 2nr2 s ILE 44 CO 0.01 0.50 0.04 0.12 -1.23 0.00 0.00 174.94 174.38 2nr2 s PHE 45 N 0.77 0.32 -0.72 3.97 5.36 -0.05 -2.61 117.98 125.02 2nr2 s PHE 45 Ca -0.05 0.02 -0.03 0.00 -0.96 0.00 0.00 56.93 55.91 2nr2 s PHE 45 Cb -0.15 -0.63 0.00 0.00 -0.34 0.00 0.00 43.02 41.90 2nr2 s PHE 45 CO 0.01 -0.28 0.34 0.00 -1.46 0.00 0.00 175.22 173.82 2nr2 n ALA 46 N 5.24 -0.49 0.00 11.12 0.00 -1.26 -2.47 120.51 132.64 2nr2 n ALA 46 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2nr2 n ALA 46 Cb 0.50 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.70 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 -1.13 3.16 3.90 0.00 0.00 -1.26 -5.02 105.19 104.84 2nr2 n GLY 47 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.40 3.40 -0.20 1.61 1.02 -1.03 -5.07 119.74 119.07 2nr2 s LYS 48 Ca 0.00 -0.41 -0.29 0.00 0.02 0.00 0.00 55.97 55.29 2nr2 s LYS 48 Cb 0.00 -3.04 -0.01 0.00 -0.52 0.00 0.00 37.83 34.26 2nr2 s LYS 48 CO 0.00 0.63 1.21 -1.14 -0.92 0.00 0.00 175.35 175.14 2nr2 s GLN 49 N -2.26 4.20 0.27 1.68 0.74 -1.26 -0.87 119.66 122.15 2nr2 s GLN 49 Ca 0.31 1.53 -0.17 0.00 0.05 0.00 0.00 55.36 57.08 2nr2 s GLN 49 Cb -0.13 -3.75 -0.09 0.00 1.10 0.00 0.00 33.01 30.15 2nr2 s GLN 49 CO 0.24 -0.74 0.72 -0.51 -0.55 0.00 0.00 175.29 174.45 2nr2 s LEU 50 N 3.54 4.21 -0.03 3.68 1.43 -0.39 -4.99 118.68 126.14 2nr2 s LEU 50 Ca 0.52 1.34 -0.17 0.00 -1.03 0.00 0.00 54.13 54.80 2nr2 s LEU 50 Cb -0.19 -3.80 -0.05 0.00 0.03 0.00 0.00 46.19 42.17 2nr2 s LEU 50 CO 0.14 -0.07 0.45 -1.61 0.23 0.00 0.00 176.35 175.49 2nr2 s GLU 51 N -2.44 4.11 0.14 1.70 2.02 -1.26 -4.74 118.70 118.23 2nr2 s GLU 51 Ca 0.48 0.47 -0.13 0.00 0.02 0.00 0.00 54.97 55.81 2nr2 s GLU 51 Cb -0.14 -3.30 0.01 0.00 0.10 0.00 0.00 34.13 30.80 2nr2 s GLU 51 CO 0.19 0.51 1.60 -0.44 0.02 0.00 0.00 175.26 177.13 2nr2 h ASP 52 N 5.35 0.80 0.48 -0.19 3.32 -1.98 -2.59 116.42 121.61 2nr2 h ASP 52 Ca -0.48 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.27 2nr2 h ASP 52 Cb 1.20 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.54 2nr2 h ASP 52 CO 0.66 0.90 0.00 0.61 -1.72 0.00 0.00 179.24 179.70 2nr2 n GLY 53 N -0.39 -1.10 3.85 2.75 0.00 -1.26 -0.67 105.19 108.37 2nr2 n GLY 53 Ca 0.00 0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.33 3.24 0.40 1.61 0.52 -0.98 -4.85 118.95 115.56 2nr2 s ARG 54 Ca 0.03 0.80 -0.02 0.00 -0.52 0.00 0.00 55.73 56.01 2nr2 s ARG 54 Cb 0.08 -2.04 -0.04 0.00 0.52 0.00 0.00 34.95 33.48 2nr2 s ARG 54 CO 0.31 -0.84 0.65 0.95 0.02 0.00 0.00 175.30 176.39 2nr2 s THR 55 N -3.14 5.01 0.24 0.02 -4.23 -1.26 -1.88 115.64 110.40 2nr2 s THR 55 Ca 0.57 -0.13 0.20 0.00 -1.18 0.00 0.00 61.69 61.14 2nr2 s THR 55 Cb -0.12 -3.85 0.17 0.00 1.34 0.00 0.00 72.50 70.03 2nr2 s THR 55 CO 0.54 -0.66 1.82 -0.07 -0.54 0.00 0.00 174.62 175.71 2nr2 h LEU 56 N 0.61 0.00 -0.26 4.79 3.38 -1.31 -2.85 115.31 119.67 2nr2 h LEU 56 Ca -0.48 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.30 2nr2 h LEU 56 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2nr2 h LEU 56 CO 0.62 0.31 -0.88 0.77 0.09 0.00 0.00 178.44 179.35 2nr2 h SER 57 N 0.00 0.08 -0.65 -0.43 4.64 -1.56 0.13 113.55 115.76 2nr2 h SER 57 Ca -0.00 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2nr2 h SER 57 Cb 0.74 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.78 2nr2 h SER 57 CO 0.04 0.92 0.39 -0.78 -0.87 0.00 0.00 176.83 176.53 2nr2 h ASP 58 N 0.03 0.78 0.44 4.97 1.82 -1.81 -1.71 116.42 120.94 2nr2 h ASP 58 Ca -0.02 -0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.56 2nr2 h ASP 58 Cb 1.54 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 41.35 2nr2 h ASP 58 CO 0.12 0.61 -0.16 -1.22 -1.61 0.00 0.00 179.24 176.99 2nr2 n TYR 59 N -4.58 0.00 -2.78 0.28 4.01 -1.15 -4.98 117.16 107.97 2nr2 n TYR 59 Ca 0.05 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.70 2nr2 n TYR 59 Cb 0.06 -0.22 0.05 0.00 -0.31 0.00 0.00 39.34 38.91 2nr2 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2nr2 n ASN 60 N -1.05 -2.16 -4.64 7.72 5.15 -0.48 -5.01 115.26 114.79 2nr2 n ASN 60 Ca 0.12 -0.35 -0.37 0.00 -0.60 0.00 0.00 54.58 53.39 2nr2 n ASN 60 Cb 0.30 -3.07 -0.10 0.00 -0.53 0.00 0.00 39.78 36.38 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2nr2 s ILE 61 N -3.20 5.28 0.17 -1.44 1.01 0.33 -5.00 121.20 118.36 2nr2 s ILE 61 Ca 0.01 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.83 2nr2 s ILE 61 Cb -0.00 -3.47 0.01 0.00 0.01 0.00 0.00 42.46 39.01 2nr2 s ILE 61 CO 0.41 0.33 0.12 0.00 0.00 0.00 0.00 174.94 175.80 2nr2 n GLN 62 N 4.42 1.27 -1.66 2.79 6.02 -1.26 -4.63 117.38 124.33 2nr2 n GLN 62 Ca -0.15 -1.11 -0.57 0.00 -0.01 0.00 0.00 57.00 55.16 2nr2 n GLN 62 Cb 0.52 0.14 -0.07 0.00 1.02 0.00 0.00 30.24 31.84 2nr2 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2nr2 n LYS 63 N -0.87 0.91 -3.43 -1.09 4.81 -1.26 -3.02 118.16 114.21 2nr2 n LYS 63 Ca -0.01 0.33 -0.20 0.00 -0.87 0.00 0.00 58.31 57.56 2nr2 n LYS 63 Cb 0.20 -1.97 0.08 0.00 0.02 0.00 0.00 35.03 33.36 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2nr2 n GLU 64 N 3.99 -6.85 -3.89 1.64 1.02 0.11 -5.00 120.64 111.65 2nr2 n GLU 64 Ca 0.24 0.76 -0.28 0.00 -0.02 0.00 0.00 57.16 57.86 2nr2 n GLU 64 Cb 0.12 -5.56 -0.03 0.00 -0.02 0.00 0.00 31.44 25.95 2nr2 n GLU 64 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2nr2 s SER 65 N -3.59 6.36 -0.46 1.62 0.15 -1.17 -4.80 113.70 111.81 2nr2 s SER 65 Ca 0.37 0.25 -0.17 0.00 0.70 0.00 0.00 55.95 57.09 2nr2 s SER 65 Cb -0.16 -1.94 0.05 0.00 -1.71 0.00 0.00 66.02 62.25 2nr2 s SER 65 CO 0.66 0.07 0.47 -0.89 1.20 0.00 0.00 173.24 174.74 2nr2 s THR 66 N -1.70 5.09 0.09 6.45 2.01 -1.26 -1.35 115.64 124.97 2nr2 s THR 66 Ca 0.35 -0.62 -0.20 0.00 0.31 0.00 0.00 61.69 61.53 2nr2 s THR 66 Cb -0.12 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.20 2nr2 s THR 66 CO 0.28 -0.56 0.61 -0.76 -0.69 0.00 0.00 174.62 173.50 2nr2 s LEU 67 N 2.09 4.54 -0.13 4.42 1.43 -0.34 -4.97 118.68 125.71 2nr2 s LEU 67 Ca 0.10 1.33 -0.04 0.00 -1.03 0.00 0.00 54.13 54.49 2nr2 s LEU 67 Cb -0.20 -2.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.02 2nr2 s LEU 67 CO 0.11 0.26 -0.01 -1.00 0.23 0.00 0.00 176.35 175.94 2nr2 s HIS 68 N -1.08 3.11 -0.21 0.29 3.76 -1.07 -2.17 115.29 117.91 2nr2 s HIS 68 Ca 0.30 -0.05 -0.04 0.00 -0.15 0.00 0.00 55.06 55.12 2nr2 s HIS 68 Cb -0.20 -1.92 -0.01 0.00 1.11 0.00 0.00 32.58 31.56 2nr2 s HIS 68 CO 0.20 0.18 -0.04 -1.17 -0.85 0.00 0.00 174.74 173.06 2nr2 s LEU 69 N -0.08 2.96 0.34 0.89 2.96 -1.08 -0.96 118.68 123.70 2nr2 s LEU 69 Ca 0.03 -0.36 0.09 0.00 -0.22 0.00 0.00 54.13 53.68 2nr2 s LEU 69 Cb -0.13 -1.75 -0.06 0.00 0.50 0.00 0.00 46.19 44.75 2nr2 s LEU 69 CO 0.02 -0.00 -0.03 0.68 -1.32 0.00 0.00 176.35 175.70 2nr2 s VAL 70 N 1.37 2.45 0.24 1.68 -7.23 0.01 -4.44 120.40 114.49 2nr2 s VAL 70 Ca 0.04 -2.07 0.07 0.00 -1.81 0.00 0.00 61.98 58.21 2nr2 s VAL 70 Cb -0.14 -2.74 -0.04 0.00 0.56 0.00 0.00 36.38 34.03 2nr2 s VAL 70 CO -0.02 -0.20 0.22 -0.76 -0.31 0.00 0.00 175.10 174.03 2nr2 s LEU 71 N -3.67 3.88 0.20 1.32 1.43 -1.26 -0.56 118.68 120.02 2nr2 s LEU 71 Ca 0.34 -0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 52.94 2nr2 s LEU 71 Cb 0.01 -2.42 -0.08 0.00 0.03 0.00 0.00 46.19 43.73 2nr2 s LEU 71 CO 0.18 -0.04 1.16 0.00 0.23 0.00 0.00 176.35 177.88 2nr2 s ARG 72 N -3.81 4.54 0.17 1.70 1.70 0.04 -4.81 118.95 118.48 2nr2 s ARG 72 Ca 0.33 1.82 0.08 0.00 -0.47 0.00 0.00 55.73 57.49 2nr2 s ARG 72 Cb -0.08 -3.24 -0.04 0.00 -0.57 0.00 0.00 34.95 31.02 2nr2 s ARG 72 CO 0.25 0.00 -0.06 -0.51 -1.08 0.00 0.00 175.30 173.91 2nr2 s LEU 73 N -0.49 3.12 0.41 -1.89 1.43 -1.26 -5.09 118.68 114.91 2nr2 s LEU 73 Ca 0.50 -0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 52.93 2nr2 s LEU 73 Cb -0.32 -1.80 -0.10 0.00 0.03 0.00 0.00 46.19 44.00 2nr2 s LEU 73 CO 0.37 0.11 0.90 -0.13 0.23 0.00 0.00 176.35 177.83 2nr2 s ARG 74 N -2.81 4.15 0.40 1.70 0.52 -1.26 -4.43 118.95 117.21 2nr2 s ARG 74 Ca 0.26 0.99 0.00 0.00 -0.52 0.00 0.00 55.73 56.45 2nr2 s ARG 74 Cb -0.09 -2.24 0.00 0.00 0.52 0.00 0.00 34.95 33.14 2nr2 s ARG 74 CO 0.16 -0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.89 2nr2 n GLY 75 N -0.67 1.21 0.63 -3.53 0.00 -1.26 -5.33 105.19 96.24 2nr2 n GLY 75 Ca 0.06 -0.50 0.13 0.00 0.00 0.00 0.00 46.02 45.71 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93