#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 3.05 0.42 2.12 0.74 -1.26 -0.91 119.66 123.82 2nr2 s GLN 2 Ca 0.00 -1.18 0.03 0.00 0.05 0.00 0.00 55.36 54.25 2nr2 s GLN 2 Cb 0.00 -4.15 -0.00 0.00 1.10 0.00 0.00 33.01 29.96 2nr2 s GLN 2 CO 0.00 -1.19 0.62 0.96 -0.55 0.00 0.00 175.29 175.12 2nr2 s ILE 3 N 2.18 3.86 -0.06 -2.34 -4.36 -0.65 -4.33 121.20 115.49 2nr2 s ILE 3 Ca 0.09 -0.68 0.05 0.00 -0.26 0.00 0.00 60.65 59.85 2nr2 s ILE 3 Cb -0.23 -3.40 -0.02 0.00 1.25 0.00 0.00 42.46 40.07 2nr2 s ILE 3 CO 0.08 -0.24 -0.20 -0.36 0.24 0.00 0.00 174.94 174.46 2nr2 s PHE 4 N -2.45 2.55 -0.41 1.37 0.08 -0.25 -1.73 117.98 117.14 2nr2 s PHE 4 Ca 0.48 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.01 2nr2 s PHE 4 Cb -0.10 -1.63 0.11 0.00 -0.57 0.00 0.00 43.02 40.83 2nr2 s PHE 4 CO 0.36 -0.09 0.17 0.08 -0.10 0.00 0.00 175.22 175.64 2nr2 s VAL 5 N -0.29 2.88 0.05 -0.44 1.01 -0.06 0.18 120.40 123.73 2nr2 s VAL 5 Ca 0.01 -2.33 -0.25 0.00 0.00 0.00 0.00 61.98 59.41 2nr2 s VAL 5 Cb -0.13 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 2nr2 s VAL 5 CO 0.03 -0.68 0.77 -0.54 0.00 0.00 0.00 175.10 174.68 2nr2 s LYS 6 N 0.86 4.50 0.45 2.72 1.02 0.33 -1.18 119.74 128.44 2nr2 s LYS 6 Ca 0.11 1.08 -0.06 0.00 0.02 0.00 0.00 55.97 57.12 2nr2 s LYS 6 Cb -0.21 -3.37 0.10 0.00 -0.52 0.00 0.00 37.83 33.83 2nr2 s LYS 6 CO -0.05 0.27 0.62 0.25 -0.92 0.00 0.00 175.35 175.52 2nr2 n THR 7 N 2.83 0.00 0.09 2.17 -2.24 0.11 -0.17 114.28 117.07 2nr2 n THR 7 Ca -0.02 -0.57 -0.23 0.00 -2.27 0.00 0.00 64.05 60.96 2nr2 n THR 7 Cb 0.50 -1.58 -0.15 0.00 -2.10 0.00 0.00 70.33 67.00 2nr2 n THR 7 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2nr2 h LEU 8 N 0.00 0.66 -0.79 3.22 5.85 -1.90 -3.37 115.31 118.99 2nr2 h LEU 8 Ca -0.20 -0.92 -0.03 0.00 0.84 0.00 0.00 57.88 57.57 2nr2 h LEU 8 Cb 0.60 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 2nr2 h LEU 8 CO 0.16 1.64 -0.13 0.71 -0.34 0.00 0.00 178.44 180.48 2nr2 h THR 9 N -0.04 0.27 0.00 1.05 1.35 -1.95 -3.46 112.91 110.13 2nr2 h THR 9 Ca -0.25 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 2nr2 h THR 9 Cb 1.99 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 70.23 2nr2 h THR 9 CO 0.20 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.21 2nr2 n GLY 10 N 0.50 -0.78 3.69 5.82 0.00 -1.26 -5.14 105.19 108.02 2nr2 n GLY 10 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 4.26 -0.43 1.61 2.20 -1.26 -4.84 119.74 121.28 2nr2 s LYS 11 Ca 0.00 0.47 -0.18 0.00 -0.36 0.00 0.00 55.97 55.90 2nr2 s LYS 11 Cb 0.00 -3.51 0.02 0.00 -1.51 0.00 0.00 37.83 32.83 2nr2 s LYS 11 CO 0.00 -0.04 0.50 0.99 -0.36 0.00 0.00 175.35 176.44 2nr2 s THR 12 N 1.27 5.01 0.02 3.43 2.01 -1.26 -0.71 115.64 125.41 2nr2 s THR 12 Ca 0.26 -0.24 -0.19 0.00 0.31 0.00 0.00 61.69 61.82 2nr2 s THR 12 Cb -0.15 -4.10 -0.06 0.00 0.01 0.00 0.00 72.50 68.20 2nr2 s THR 12 CO 0.10 -0.49 0.55 -0.63 -0.69 0.00 0.00 174.62 173.47 2nr2 s ILE 13 N 2.33 4.88 -0.15 1.82 1.01 -0.33 -4.91 121.20 125.85 2nr2 s ILE 13 Ca 0.15 1.16 -0.03 0.00 0.00 0.00 0.00 60.65 61.93 2nr2 s ILE 13 Cb -0.16 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.40 2nr2 s ILE 13 CO 0.15 0.49 -0.06 -0.89 0.00 0.00 0.00 174.94 174.63 2nr2 s THR 14 N -0.62 3.70 -0.06 2.92 2.01 -1.26 -0.88 115.64 121.44 2nr2 s THR 14 Ca 0.29 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 61.87 2nr2 s THR 14 Cb -0.18 -2.61 0.02 0.00 0.01 0.00 0.00 72.50 69.74 2nr2 s THR 14 CO 0.17 0.50 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.79 2nr2 s LEU 15 N 0.39 1.15 -0.38 4.42 1.43 -0.71 -5.02 118.68 119.97 2nr2 s LEU 15 Ca -0.05 -0.16 -0.25 0.00 -1.03 0.00 0.00 54.13 52.64 2nr2 s LEU 15 Cb -0.15 -0.55 0.01 0.00 0.03 0.00 0.00 46.19 45.54 2nr2 s LEU 15 CO 0.03 -0.09 0.86 -1.61 0.23 0.00 0.00 176.35 175.78 2nr2 s GLU 16 N 1.28 3.75 0.41 1.70 2.02 -1.26 -1.64 118.70 124.95 2nr2 s GLU 16 Ca -0.05 0.39 0.05 0.00 0.02 0.00 0.00 54.97 55.37 2nr2 s GLU 16 Cb -0.14 -3.83 -0.06 0.00 0.10 0.00 0.00 34.13 30.21 2nr2 s GLU 16 CO -0.02 -0.95 0.03 0.14 0.02 0.00 0.00 175.26 174.48 2nr2 s VAL 17 N 3.35 1.50 0.17 2.63 -7.23 -0.09 -4.96 120.40 115.78 2nr2 s VAL 17 Ca 0.35 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.60 2nr2 s VAL 17 Cb -0.12 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 2nr2 s VAL 17 CO 0.19 0.00 -0.17 -1.61 -0.31 0.00 0.00 175.10 173.21 2nr2 s GLU 18 N -3.79 1.26 0.00 4.82 0.41 -1.26 -0.04 118.70 120.11 2nr2 s GLU 18 Ca 0.29 -1.45 0.06 0.00 -0.41 0.00 0.00 54.97 53.46 2nr2 s GLU 18 Cb 0.07 -1.22 0.28 0.00 -1.78 0.00 0.00 34.13 31.49 2nr2 s GLU 18 CO 0.14 0.23 1.14 -2.30 -0.49 0.00 0.00 175.26 173.98 2nr2 n PRO 19 N 0.10 0.03 0.00 0.39 -0.02 -1.26 -1.79 135.00 132.45 2nr2 n PRO 19 Ca -0.12 0.33 0.13 0.00 -2.02 0.00 0.00 63.50 61.82 2nr2 n PRO 19 Cb 0.58 -1.50 0.32 0.00 -0.02 0.00 0.00 33.50 32.88 2nr2 n PRO 19 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2nr2 n SER 20 N -1.42 1.80 -4.80 2.55 3.41 -1.26 -1.91 113.62 111.99 2nr2 n SER 20 Ca 0.02 -1.46 -0.32 0.00 -0.26 0.00 0.00 58.87 56.84 2nr2 n SER 20 Cb 0.06 0.10 0.03 0.00 -0.26 0.00 0.00 64.21 64.14 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 -2.19 5.53 0.57 4.04 1.01 -0.74 -4.86 116.67 120.02 2nr2 s ASP 21 Ca 0.30 1.81 0.04 0.00 0.71 0.00 0.00 52.55 55.40 2nr2 s ASP 21 Cb 0.20 -2.53 0.06 0.00 1.01 0.00 0.00 42.92 41.66 2nr2 s ASP 21 CO 0.41 -1.34 0.79 0.42 0.21 0.00 0.00 175.17 175.65 2nr2 s THR 22 N -2.57 2.51 0.09 -1.27 -4.23 -1.26 -1.81 115.64 107.10 2nr2 s THR 22 Ca 0.63 -0.78 -0.17 0.00 -1.18 0.00 0.00 61.69 60.19 2nr2 s THR 22 Cb -0.16 -2.73 -0.07 0.00 1.34 0.00 0.00 72.50 70.88 2nr2 s THR 22 CO 0.42 0.00 1.50 0.40 -0.54 0.00 0.00 174.62 176.40 2nr2 h ILE 23 N 0.07 1.27 -0.87 2.99 1.08 -0.92 -2.66 117.51 118.48 2nr2 h ILE 23 Ca -0.38 -1.05 0.21 0.00 -0.39 0.00 0.00 64.86 63.25 2nr2 h ILE 23 Cb 1.28 1.37 -0.06 0.00 -3.07 0.00 0.00 36.82 36.34 2nr2 h ILE 23 CO 0.46 0.34 0.59 -0.08 -0.69 0.00 0.00 178.15 178.76 2nr2 h GLU 24 N 0.32 0.29 -0.42 2.37 4.81 -1.35 -2.10 114.58 118.49 2nr2 h GLU 24 Ca 0.08 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 2nr2 h GLU 24 Cb 0.51 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 2nr2 h GLU 24 CO 0.02 0.19 -0.05 -0.97 -0.73 0.00 0.00 179.01 177.48 2nr2 h ASN 25 N 0.29 0.77 -0.48 1.04 -0.73 -1.82 -1.83 115.58 112.83 2nr2 h ASN 25 Ca 0.44 -0.33 0.08 0.00 1.87 0.00 0.00 56.30 58.36 2nr2 h ASN 25 Cb 1.25 -0.21 -0.07 0.00 0.27 0.00 0.00 38.32 39.56 2nr2 h ASN 25 CO -0.13 0.92 0.07 0.58 -0.37 0.00 0.00 177.43 178.50 2nr2 h VAL 26 N 0.60 0.70 -0.07 2.57 2.07 -1.08 -2.79 116.25 118.25 2nr2 h VAL 26 Ca 0.11 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 2nr2 h VAL 26 Cb 0.55 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2nr2 h VAL 26 CO 0.03 0.04 -0.25 0.11 0.02 0.00 0.00 177.57 177.52 2nr2 h LYS 27 N 0.19 0.13 -0.56 1.57 1.57 -1.23 -3.08 116.57 115.16 2nr2 h LYS 27 Ca 0.24 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 2nr2 h LYS 27 Cb 0.33 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 2nr2 h LYS 27 CO -0.34 0.37 0.27 0.00 -0.57 0.00 0.00 179.45 179.18 2nr2 h ALA 28 N 1.63 0.72 -0.87 3.86 0.00 -1.07 -0.24 119.26 123.30 2nr2 h ALA 28 Ca 0.02 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.87 2nr2 h ALA 28 Cb 0.51 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2nr2 h ALA 28 CO 0.04 0.29 0.57 0.87 0.00 0.00 0.00 179.25 181.01 2nr2 h LYS 29 N 0.76 0.92 -0.17 0.00 1.57 -1.46 0.27 116.57 118.45 2nr2 h LYS 29 Ca 0.19 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.79 2nr2 h LYS 29 Cb 0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2nr2 h LYS 29 CO -0.02 0.61 -0.44 0.82 -0.57 0.00 0.00 179.45 179.84 2nr2 h ILE 30 N 0.95 1.32 -0.17 1.86 2.04 -1.41 -2.17 117.51 119.92 2nr2 h ILE 30 Ca 0.38 -1.62 -0.12 0.00 1.00 0.00 0.00 64.86 64.51 2nr2 h ILE 30 Cb 0.27 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2nr2 h ILE 30 CO -0.15 0.50 -0.40 -0.61 0.00 0.00 0.00 178.15 177.49 2nr2 h GLN 31 N 0.34 0.39 -0.24 2.37 4.15 0.05 -0.41 115.11 121.76 2nr2 h GLN 31 Ca 0.02 -0.19 -0.15 0.00 0.77 0.00 0.00 58.65 59.11 2nr2 h GLN 31 Cb 0.91 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.60 2nr2 h GLN 31 CO 0.08 0.73 -0.44 0.22 -1.93 0.00 0.00 178.83 177.49 2nr2 h ASP 32 N 0.33 0.80 0.12 -0.69 3.58 -0.58 -3.11 116.42 116.87 2nr2 h ASP 32 Ca 0.03 -0.53 -0.19 0.00 0.42 0.00 0.00 57.03 56.76 2nr2 h ASP 32 Cb 0.84 -0.23 0.02 0.00 1.72 0.00 0.00 39.33 41.68 2nr2 h ASP 32 CO 0.07 1.18 -0.85 0.11 -2.88 0.00 0.00 179.24 176.87 2nr2 h LYS 33 N 0.45 0.26 0.00 0.28 1.57 -1.26 -3.43 116.57 114.44 2nr2 h LYS 33 Ca 0.01 -0.45 -0.24 0.00 -1.87 0.00 0.00 60.65 58.11 2nr2 h LYS 33 Cb 1.04 0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 2nr2 h LYS 33 CO 0.10 1.21 -1.81 -1.91 -0.57 0.00 0.00 179.45 176.47 2nr2 n GLU 34 N -4.14 0.32 0.00 3.15 4.07 -0.20 -5.07 120.64 118.78 2nr2 n GLU 34 Ca -0.16 0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.06 2nr2 n GLU 34 Cb 0.81 -1.10 0.00 0.00 -0.06 0.00 0.00 31.44 31.08 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 2.32 1.39 3.52 8.31 0.00 -0.99 -5.01 105.19 114.73 2nr2 n GLY 35 Ca -0.28 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 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 3.56 0.77 -0.61 1.01 -1.26 -4.99 121.20 117.69 2nr2 s ILE 36 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 2nr2 s ILE 36 Cb 0.00 -2.47 0.05 0.00 0.01 0.00 0.00 42.46 40.05 2nr2 s ILE 36 CO 0.00 0.57 1.09 -2.84 0.00 0.00 0.00 174.94 173.75 2nr2 s PRO 37 N -0.42 2.28 0.58 2.79 0.02 -1.26 -4.19 135.00 134.80 2nr2 s PRO 37 Ca 0.06 1.09 0.37 0.00 0.02 0.00 0.00 61.00 62.54 2nr2 s PRO 37 Cb -0.12 -1.91 1.71 0.00 0.02 0.00 0.00 34.50 34.20 2nr2 s PRO 37 CO 0.02 -1.60 2.10 -1.35 -0.33 0.00 0.00 177.00 175.84 2nr2 h PRO 38 N -1.09 0.00 -0.63 5.54 0.11 -1.93 -2.45 132.00 131.54 2nr2 h PRO 38 Ca -0.44 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 2nr2 h PRO 38 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2nr2 h PRO 38 CO 0.53 0.00 0.26 -0.44 -0.21 0.00 0.00 178.00 178.14 2nr2 h ASP 39 N 0.00 0.84 1.01 -2.05 3.32 -2.00 -3.17 116.42 114.37 2nr2 h ASP 39 Ca 0.00 -0.11 -0.21 0.00 0.02 0.00 0.00 57.03 56.74 2nr2 h ASP 39 Cb 0.34 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 2nr2 h ASP 39 CO 0.00 0.74 -0.99 1.56 -1.72 0.00 0.00 179.24 178.83 2nr2 h GLN 40 N 0.91 0.00 -6.42 3.56 1.08 -1.81 -3.45 115.11 108.98 2nr2 h GLN 40 Ca 0.22 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.88 2nr2 h GLN 40 Cb 0.16 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.56 2nr2 h GLN 40 CO -0.02 0.96 0.29 -0.65 -0.95 0.00 0.00 178.83 178.46 2nr2 s GLN 41 N -2.72 4.59 -0.23 1.46 -0.21 -1.11 -0.90 119.66 120.54 2nr2 s GLN 41 Ca 0.01 1.30 0.01 0.00 0.02 0.00 0.00 55.36 56.70 2nr2 s GLN 41 Cb 0.10 -3.40 0.06 0.00 1.00 0.00 0.00 33.01 30.77 2nr2 s GLN 41 CO 0.82 0.16 -0.08 1.03 -2.12 0.00 0.00 175.29 175.10 2nr2 s ARG 42 N 0.29 1.87 -0.31 2.91 0.52 -0.31 -4.94 118.95 118.99 2nr2 s ARG 42 Ca 0.45 -1.06 -0.12 0.00 -0.52 0.00 0.00 55.73 54.48 2nr2 s ARG 42 Cb -0.22 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.58 2nr2 s ARG 42 CO 0.27 -0.56 0.21 -0.51 0.02 0.00 0.00 175.30 174.73 2nr2 s LEU 43 N 1.32 4.24 -0.27 2.53 1.43 -1.26 -0.79 118.68 125.87 2nr2 s LEU 43 Ca -0.06 -0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 52.80 2nr2 s LEU 43 Cb -0.19 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.91 2nr2 s LEU 43 CO -0.06 -0.13 0.04 -0.63 0.23 0.00 0.00 176.35 175.80 2nr2 s ILE 44 N 1.75 3.74 -0.25 -0.59 -1.09 0.48 -0.98 121.20 124.25 2nr2 s ILE 44 Ca 0.07 -0.67 0.02 0.00 -2.23 0.00 0.00 60.65 57.84 2nr2 s ILE 44 Cb -0.17 -2.88 0.06 0.00 -1.58 0.00 0.00 42.46 37.90 2nr2 s ILE 44 CO 0.11 0.17 -0.09 0.12 -1.23 0.00 0.00 174.94 174.01 2nr2 s PHE 45 N 1.48 2.98 -0.95 3.97 5.36 0.81 -1.29 117.98 130.35 2nr2 s PHE 45 Ca 0.03 -2.14 -0.00 0.00 -0.96 0.00 0.00 56.93 53.86 2nr2 s PHE 45 Cb -0.16 -1.82 0.00 0.00 -0.34 0.00 0.00 43.02 40.70 2nr2 s PHE 45 CO 0.01 -0.85 0.06 0.00 -1.46 0.00 0.00 175.22 172.98 2nr2 n ALA 46 N 4.51 -0.37 0.00 11.12 0.00 -1.26 -2.04 120.51 132.47 2nr2 n ALA 46 Ca -0.13 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2nr2 n ALA 46 Cb 0.43 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.04 2.81 3.72 0.00 0.00 -1.26 -5.03 105.19 104.39 2nr2 n GLY 47 Ca -0.12 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 2nr2 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nr2 s LYS 48 N 0.00 4.60 -0.23 1.61 2.20 -0.87 -4.98 119.74 122.07 2nr2 s LYS 48 Ca 0.00 1.54 -0.19 0.00 -0.36 0.00 0.00 55.97 56.96 2nr2 s LYS 48 Cb 0.00 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2nr2 s LYS 48 CO 0.00 0.05 0.54 1.14 -0.36 0.00 0.00 175.35 176.72 2nr2 s GLN 49 N 0.35 4.14 0.23 4.03 -2.07 -1.26 -0.14 119.66 124.94 2nr2 s GLN 49 Ca 0.50 0.42 -0.30 0.00 -1.82 0.00 0.00 55.36 54.16 2nr2 s GLN 49 Cb -0.25 -3.61 -0.09 0.00 -1.09 0.00 0.00 33.01 27.97 2nr2 s GLN 49 CO 0.30 -0.27 1.27 -0.51 -1.32 0.00 0.00 175.29 174.76 2nr2 s LEU 50 N 2.03 4.44 0.42 2.60 1.43 -0.15 -5.00 118.68 124.44 2nr2 s LEU 50 Ca 0.24 2.41 -0.22 0.00 -1.03 0.00 0.00 54.13 55.52 2nr2 s LEU 50 Cb -0.16 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.35 2nr2 s LEU 50 CO 0.09 -0.46 0.99 -1.61 0.23 0.00 0.00 176.35 175.59 2nr2 s GLU 51 N -0.57 4.17 0.03 1.70 2.02 -1.26 -4.73 118.70 120.05 2nr2 s GLU 51 Ca 0.53 1.28 -0.22 0.00 0.02 0.00 0.00 54.97 56.58 2nr2 s GLU 51 Cb -0.36 -2.32 -0.12 0.00 0.10 0.00 0.00 34.13 31.43 2nr2 s GLU 51 CO 0.41 -0.10 1.19 -0.44 0.02 0.00 0.00 175.26 176.33 2nr2 h ASP 52 N 2.12 -0.68 0.00 -0.19 3.32 -1.96 -3.12 116.42 115.92 2nr2 h ASP 52 Ca -0.49 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 2nr2 h ASP 52 Cb 1.20 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.92 2nr2 h ASP 52 CO 0.61 -0.44 0.04 0.61 -1.72 0.00 0.00 179.24 178.35 2nr2 n GLY 53 N -0.98 1.38 3.60 2.75 0.00 -1.26 -1.03 105.19 109.66 2nr2 n GLY 53 Ca -0.10 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 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 1.52 2.00 0.48 1.61 1.81 -1.18 -4.99 118.95 120.20 2nr2 s ARG 54 Ca 0.07 -1.78 0.04 0.00 -1.72 0.00 0.00 55.73 52.34 2nr2 s ARG 54 Cb 0.03 -1.87 0.02 0.00 -0.45 0.00 0.00 34.95 32.68 2nr2 s ARG 54 CO 0.00 0.16 0.67 0.95 -0.68 0.00 0.00 175.30 176.40 2nr2 s THR 55 N -2.53 2.90 -0.07 0.02 -4.23 -1.26 -1.18 115.64 109.29 2nr2 s THR 55 Ca 0.34 -0.81 0.21 0.00 -1.18 0.00 0.00 61.69 60.25 2nr2 s THR 55 Cb 0.00 -3.03 0.20 0.00 1.34 0.00 0.00 72.50 71.01 2nr2 s THR 55 CO 0.18 -0.02 1.66 -0.07 -0.54 0.00 0.00 174.62 175.84 2nr2 h LEU 56 N 0.35 0.00 -0.86 4.79 3.38 -1.34 -3.21 115.31 118.41 2nr2 h LEU 56 Ca -0.41 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.44 2nr2 h LEU 56 Cb 1.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 2nr2 h LEU 56 CO 0.49 0.28 -0.55 -1.28 0.09 0.00 0.00 178.44 177.46 2nr2 h SER 57 N 0.00 0.00 -0.14 -0.43 0.87 -1.66 -3.10 113.55 109.08 2nr2 h SER 57 Ca -0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.57 2nr2 h SER 57 Cb 1.01 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.95 2nr2 h SER 57 CO 0.04 0.55 0.03 -0.78 -0.53 0.00 0.00 176.83 176.14 2nr2 h ASP 58 N 0.00 0.02 -4.41 6.23 1.82 -1.86 -3.44 116.42 114.78 2nr2 h ASP 58 Ca -0.01 0.02 -0.49 0.00 -0.39 0.00 0.00 57.03 56.16 2nr2 h ASP 58 Cb 1.00 0.02 0.07 0.00 0.68 0.00 0.00 39.33 41.11 2nr2 h ASP 58 CO 0.07 0.03 0.40 -0.31 -1.61 0.00 0.00 179.24 177.82 2nr2 s TYR 59 N -6.19 3.34 -1.15 0.28 2.02 -1.17 -4.97 117.35 109.52 2nr2 s TYR 59 Ca -0.13 1.04 -0.05 0.00 -0.37 0.00 0.00 57.07 57.56 2nr2 s TYR 59 Cb 0.08 -3.02 0.12 0.00 -0.40 0.00 0.00 41.96 38.75 2nr2 s TYR 59 CO 0.68 -1.12 2.42 0.09 -1.57 0.00 0.00 175.55 176.05 2nr2 n ASN 60 N -2.96 7.74 -4.85 2.29 4.13 -1.26 -4.92 115.26 115.42 2nr2 n ASN 60 Ca 0.07 -3.19 -0.36 0.00 1.68 0.00 0.00 54.58 52.78 2nr2 n ASN 60 Cb 0.57 -1.33 -0.06 0.00 -1.54 0.00 0.00 39.78 37.43 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 -1.56 5.03 0.00 2.41 -1.09 -1.26 -5.05 121.20 119.68 2nr2 s ILE 61 Ca 0.54 0.63 0.00 0.00 -2.23 0.00 0.00 60.65 59.59 2nr2 s ILE 61 Cb 0.22 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.42 2nr2 s ILE 61 CO -0.12 0.36 0.00 0.00 -1.23 0.00 0.00 174.94 173.95 2nr2 n GLN 62 N 1.14 0.00 0.00 2.79 1.13 -1.26 -5.03 117.38 116.15 2nr2 n GLN 62 Ca -0.09 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 2nr2 n GLN 62 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.87 2nr2 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 2nr2 n LYS 63 N 0.00 0.00 -2.02 -1.09 4.81 -1.26 -4.91 118.16 113.70 2nr2 n LYS 63 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 2nr2 n LYS 63 Cb 0.00 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.08 2nr2 n LYS 63 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2nr2 n GLU 64 N -1.92 3.26 -3.01 1.64 0.00 -1.26 -4.38 120.64 114.97 2nr2 n GLU 64 Ca 0.00 -3.62 -0.33 0.00 0.00 0.00 0.00 57.16 53.21 2nr2 n GLU 64 Cb 0.00 -2.30 -0.06 0.00 0.00 0.00 0.00 31.44 29.07 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 2nr2 s SER 65 N -0.96 6.88 -0.25 -1.84 0.01 -1.26 -4.76 113.70 111.52 2nr2 s SER 65 Ca 0.50 1.46 -0.10 0.00 1.31 0.00 0.00 55.95 59.13 2nr2 s SER 65 Cb 0.38 -2.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.12 2nr2 s SER 65 CO -0.34 -0.24 0.14 -0.89 0.41 0.00 0.00 173.24 172.33 2nr2 s THR 66 N -2.00 5.08 0.20 1.44 2.01 -1.26 -1.09 115.64 120.02 2nr2 s THR 66 Ca 0.56 0.09 0.08 0.00 0.31 0.00 0.00 61.69 62.72 2nr2 s THR 66 Cb -0.11 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 2nr2 s THR 66 CO 0.16 0.32 0.01 -0.76 -0.69 0.00 0.00 174.62 173.67 2nr2 s LEU 67 N 1.32 3.32 -0.08 4.42 1.02 0.13 -4.86 118.68 123.95 2nr2 s LEU 67 Ca 0.07 -0.45 0.03 0.00 0.02 0.00 0.00 54.13 53.80 2nr2 s LEU 67 Cb -0.15 -1.93 0.01 0.00 0.02 0.00 0.00 46.19 44.14 2nr2 s LEU 67 CO 0.06 0.06 -0.17 -1.00 0.02 0.00 0.00 176.35 175.32 2nr2 s HIS 68 N -1.91 1.92 -0.36 0.29 3.76 -0.41 -0.51 115.29 118.07 2nr2 s HIS 68 Ca 0.29 -0.77 -0.14 0.00 -0.15 0.00 0.00 55.06 54.28 2nr2 s HIS 68 Cb -0.08 -1.35 -0.01 0.00 1.11 0.00 0.00 32.58 32.25 2nr2 s HIS 68 CO 0.19 -0.36 0.31 -1.17 -0.85 0.00 0.00 174.74 172.87 2nr2 s LEU 69 N 0.59 4.60 -0.13 0.89 2.96 0.77 -0.39 118.68 127.98 2nr2 s LEU 69 Ca -0.15 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.28 2nr2 s LEU 69 Cb -0.16 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.25 2nr2 s LEU 69 CO 0.05 -0.33 0.03 -0.69 -1.32 0.00 0.00 176.35 174.08 2nr2 s VAL 70 N 1.87 4.49 -0.06 1.68 1.01 0.03 -3.70 120.40 125.72 2nr2 s VAL 70 Ca 0.09 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.81 2nr2 s VAL 70 Cb -0.17 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2nr2 s VAL 70 CO 0.11 0.55 0.24 -0.76 0.00 0.00 0.00 175.10 175.24 2nr2 s LEU 71 N -0.36 4.41 0.73 3.92 1.43 -1.26 -1.16 118.68 126.39 2nr2 s LEU 71 Ca 0.08 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 53.69 2nr2 s LEU 71 Cb -0.12 -2.34 0.03 0.00 0.03 0.00 0.00 46.19 43.79 2nr2 s LEU 71 CO 0.02 0.35 1.09 -0.60 0.23 0.00 0.00 176.35 177.44 2nr2 s ARG 72 N -1.20 2.62 -0.11 1.70 3.52 -0.08 -4.95 118.95 120.46 2nr2 s ARG 72 Ca 0.20 0.61 -0.29 0.00 -0.13 0.00 0.00 55.73 56.12 2nr2 s ARG 72 Cb -0.14 -1.98 -0.04 0.00 -1.56 0.00 0.00 34.95 31.23 2nr2 s ARG 72 CO 0.09 -1.24 1.52 -1.17 -0.81 0.00 0.00 175.30 173.69 2nr2 s LEU 73 N -5.53 4.23 0.69 -0.88 2.96 -1.26 -5.00 118.68 113.89 2nr2 s LEU 73 Ca 0.59 1.99 -0.16 0.00 -0.22 0.00 0.00 54.13 56.33 2nr2 s LEU 73 Cb -0.13 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 43.05 2nr2 s LEU 73 CO 0.53 -0.90 1.18 0.00 -1.32 0.00 0.00 176.35 175.84 2nr2 s ARG 74 N 3.92 2.41 0.00 1.98 1.70 -1.26 -4.73 118.95 122.97 2nr2 s ARG 74 Ca 0.67 1.68 0.00 0.00 -0.47 0.00 0.00 55.73 57.61 2nr2 s ARG 74 Cb -0.28 -1.87 0.00 0.00 -0.57 0.00 0.00 34.95 32.22 2nr2 s ARG 74 CO 0.24 -1.61 0.00 0.41 -1.08 0.00 0.00 175.30 173.27 2nr2 n GLY 75 N 0.19 0.70 0.37 3.88 0.00 -1.26 -5.29 105.19 103.78 2nr2 n GLY 75 Ca 0.13 0.04 0.05 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