#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 4.13 0.33 3.17 1.11 -1.26 -0.66 119.66 126.48 2nr2 s GLN 2 Ca 0.00 -0.19 0.09 0.00 0.01 0.00 0.00 55.36 55.27 2nr2 s GLN 2 Cb 0.00 -3.49 -0.05 0.00 -1.01 0.00 0.00 33.01 28.46 2nr2 s GLN 2 CO 0.00 0.14 0.04 0.96 0.01 0.00 0.00 175.29 176.44 2nr2 s ILE 3 N 0.81 2.79 -0.06 1.08 -4.36 -0.23 -1.98 121.20 119.25 2nr2 s ILE 3 Ca 0.09 -1.90 0.05 0.00 -0.26 0.00 0.00 60.65 58.64 2nr2 s ILE 3 Cb -0.13 -2.84 -0.01 0.00 1.25 0.00 0.00 42.46 40.73 2nr2 s ILE 3 CO 0.03 -0.21 -0.23 -0.36 0.24 0.00 0.00 174.94 174.40 2nr2 s PHE 4 N -2.48 2.49 -0.21 1.37 0.08 -0.09 -1.24 117.98 117.90 2nr2 s PHE 4 Ca 0.35 -0.70 -0.00 0.00 0.12 0.00 0.00 56.93 56.70 2nr2 s PHE 4 Cb -0.01 -1.62 0.02 0.00 -0.57 0.00 0.00 43.02 40.83 2nr2 s PHE 4 CO 0.20 -0.20 -0.14 0.08 -0.10 0.00 0.00 175.22 175.06 2nr2 s VAL 5 N -0.14 2.44 -0.11 -0.44 1.01 -0.23 -0.85 120.40 122.08 2nr2 s VAL 5 Ca -0.04 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 2nr2 s VAL 5 Cb -0.14 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2nr2 s VAL 5 CO 0.04 0.41 -0.04 -0.75 0.00 0.00 0.00 175.10 174.76 2nr2 s LYS 6 N 1.31 3.18 0.60 2.72 2.20 0.66 -1.25 119.74 129.16 2nr2 s LYS 6 Ca 0.03 -0.50 -0.05 0.00 -0.36 0.00 0.00 55.97 55.09 2nr2 s LYS 6 Cb -0.14 -2.77 0.13 0.00 -1.51 0.00 0.00 37.83 33.53 2nr2 s LYS 6 CO -0.09 0.50 0.82 0.25 -0.36 0.00 0.00 175.35 176.48 2nr2 n THR 7 N 2.73 0.00 0.13 3.43 -2.24 -1.12 -1.78 114.28 115.43 2nr2 n THR 7 Ca -0.18 -0.96 -0.02 0.00 -2.27 0.00 0.00 64.05 60.62 2nr2 n THR 7 Cb 0.53 -1.28 0.15 0.00 -2.10 0.00 0.00 70.33 67.63 2nr2 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 8 N 0.00 0.03 0.01 3.22 3.38 -1.92 -3.30 115.31 116.73 2nr2 h LEU 8 Ca -0.27 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 2nr2 h LEU 8 Cb 0.87 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2nr2 h LEU 8 CO 0.24 0.66 -0.01 0.71 0.09 0.00 0.00 178.44 180.14 2nr2 h THR 9 N 0.02 1.54 0.00 0.22 1.35 -1.95 -3.48 112.91 110.61 2nr2 h THR 9 Ca -0.01 -1.98 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 2nr2 h THR 9 Cb 1.14 2.82 0.00 0.00 -1.73 0.00 0.00 68.15 70.38 2nr2 h THR 9 CO 0.09 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.46 2nr2 n GLY 10 N 1.34 0.00 3.39 5.82 0.00 -1.24 -5.12 105.19 109.38 2nr2 n GLY 10 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 2.87 -0.36 1.61 2.47 -1.26 -4.90 119.74 120.18 2nr2 s LYS 11 Ca 0.00 -1.16 -0.26 0.00 -1.56 0.00 0.00 55.97 52.99 2nr2 s LYS 11 Cb 0.00 -3.90 0.01 0.00 -1.46 0.00 0.00 37.83 32.49 2nr2 s LYS 11 CO 0.00 -0.81 0.93 0.99 0.16 0.00 0.00 175.35 176.62 2nr2 s THR 12 N 1.60 4.59 0.00 3.43 2.01 -1.26 -2.79 115.64 123.22 2nr2 s THR 12 Ca 0.03 1.27 -0.02 0.00 0.31 0.00 0.00 61.69 63.29 2nr2 s THR 12 Cb -0.21 -4.33 -0.04 0.00 0.01 0.00 0.00 72.50 67.94 2nr2 s THR 12 CO 0.07 -0.50 0.15 -0.63 -0.69 0.00 0.00 174.62 173.02 2nr2 s ILE 13 N 3.45 5.18 -0.10 1.82 1.01 -0.38 -4.96 121.20 127.22 2nr2 s ILE 13 Ca 0.39 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.79 2nr2 s ILE 13 Cb -0.12 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 2nr2 s ILE 13 CO 0.18 0.31 -0.21 -0.89 0.00 0.00 0.00 174.94 174.33 2nr2 s THR 14 N -1.30 2.36 -0.01 2.92 2.01 -1.26 -1.06 115.64 119.29 2nr2 s THR 14 Ca 0.27 -0.92 0.06 0.00 0.31 0.00 0.00 61.69 61.41 2nr2 s THR 14 Cb -0.12 -1.92 -0.01 0.00 0.01 0.00 0.00 72.50 70.45 2nr2 s THR 14 CO 0.18 0.55 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.72 2nr2 s LEU 15 N 0.26 2.04 -0.18 4.42 1.43 -0.37 -5.00 118.68 121.27 2nr2 s LEU 15 Ca -0.14 -0.33 -0.08 0.00 -1.03 0.00 0.00 54.13 52.54 2nr2 s LEU 15 Cb -0.17 -0.95 -0.04 0.00 0.03 0.00 0.00 46.19 45.06 2nr2 s LEU 15 CO 0.07 0.23 0.07 -1.61 0.23 0.00 0.00 176.35 175.34 2nr2 s GLU 16 N -0.43 4.00 0.17 1.70 2.02 -1.26 -1.07 118.70 123.83 2nr2 s GLU 16 Ca 0.07 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.73 2nr2 s GLU 16 Cb -0.07 -3.24 -0.04 0.00 0.10 0.00 0.00 34.13 30.88 2nr2 s GLU 16 CO -0.01 0.28 0.05 0.14 0.02 0.00 0.00 175.26 175.74 2nr2 s VAL 17 N 0.37 0.37 0.37 2.63 -7.23 0.17 -4.90 120.40 112.17 2nr2 s VAL 17 Ca 0.04 -1.96 0.08 0.00 -1.81 0.00 0.00 61.98 58.32 2nr2 s VAL 17 Cb -0.12 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.59 2nr2 s VAL 17 CO -0.00 -0.35 0.36 -1.61 -0.31 0.00 0.00 175.10 173.19 2nr2 s GLU 18 N -4.01 2.69 0.17 4.82 0.41 -1.26 -0.10 118.70 121.42 2nr2 s GLU 18 Ca 0.28 -1.36 0.21 0.00 -0.41 0.00 0.00 54.97 53.69 2nr2 s GLU 18 Cb 0.07 -2.49 0.87 0.00 -1.78 0.00 0.00 34.13 30.80 2nr2 s GLU 18 CO 0.05 -0.04 1.65 -2.30 -0.49 0.00 0.00 175.26 174.13 2nr2 n PRO 19 N -1.49 0.13 -0.11 0.39 -0.02 -1.26 -2.66 135.00 129.99 2nr2 n PRO 19 Ca 0.01 0.34 0.11 0.00 -2.02 0.00 0.00 63.50 61.95 2nr2 n PRO 19 Cb 0.60 -1.74 0.32 0.00 -0.02 0.00 0.00 33.50 32.66 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 -1.99 2.24 -4.78 2.55 3.41 -1.26 -0.26 113.62 113.53 2nr2 n SER 20 Ca 0.03 -1.80 -0.37 0.00 -0.26 0.00 0.00 58.87 56.47 2nr2 n SER 20 Cb 0.23 -0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.58 7.34 0.59 4.04 1.01 -1.09 -4.82 116.67 122.16 2nr2 s ASP 21 Ca 0.34 1.82 -0.12 0.00 0.71 0.00 0.00 52.55 55.30 2nr2 s ASP 21 Cb 0.19 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 2nr2 s ASP 21 CO 0.28 -0.06 1.01 0.42 0.21 0.00 0.00 175.17 177.03 2nr2 s THR 22 N -1.60 4.67 0.27 -1.27 -4.23 -1.26 -1.57 115.64 110.64 2nr2 s THR 22 Ca 0.50 0.94 -0.01 0.00 -1.18 0.00 0.00 61.69 61.93 2nr2 s THR 22 Cb -0.19 -3.83 0.12 0.00 1.34 0.00 0.00 72.50 69.94 2nr2 s THR 22 CO 0.24 -1.02 1.77 0.40 -0.54 0.00 0.00 174.62 175.47 2nr2 h ILE 23 N 0.01 1.24 -0.53 2.99 1.08 -0.59 -1.65 117.51 120.05 2nr2 h ILE 23 Ca -0.45 -0.97 0.07 0.00 -0.39 0.00 0.00 64.86 63.12 2nr2 h ILE 23 Cb 1.19 0.87 -0.06 0.00 -3.07 0.00 0.00 36.82 35.75 2nr2 h ILE 23 CO 0.62 0.34 0.20 -0.08 -0.69 0.00 0.00 178.15 178.54 2nr2 h GLU 24 N 0.72 0.38 -0.59 2.37 4.81 -1.22 -1.26 114.58 119.79 2nr2 h GLU 24 Ca 0.14 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2nr2 h GLU 24 Cb 0.43 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2nr2 h GLU 24 CO 0.02 0.25 0.12 -0.97 -0.73 0.00 0.00 179.01 177.70 2nr2 h ASN 25 N 0.39 0.87 -0.70 1.04 -0.73 -1.63 -1.78 115.58 113.04 2nr2 h ASN 25 Ca 0.25 -0.18 0.11 0.00 1.87 0.00 0.00 56.30 58.36 2nr2 h ASN 25 Cb 0.27 -0.23 -0.08 0.00 0.27 0.00 0.00 38.32 38.55 2nr2 h ASN 25 CO -0.25 0.86 0.30 0.58 -0.37 0.00 0.00 177.43 178.56 2nr2 h VAL 26 N 0.89 0.75 -0.29 2.57 2.07 -0.96 -0.36 116.25 120.93 2nr2 h VAL 26 Ca 0.19 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2nr2 h VAL 26 Cb 0.35 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2nr2 h VAL 26 CO 0.00 0.09 0.13 0.11 0.02 0.00 0.00 177.57 177.93 2nr2 h LYS 27 N 0.49 0.41 -0.85 1.57 1.57 -0.97 -1.18 116.57 117.62 2nr2 h LYS 27 Ca 0.36 -0.06 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 2nr2 h LYS 27 Cb 0.47 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 2nr2 h LYS 27 CO -0.33 0.41 0.55 0.00 -0.57 0.00 0.00 179.45 179.51 2nr2 h ALA 28 N 0.99 1.69 -0.06 3.86 0.00 -1.03 -1.24 119.26 123.47 2nr2 h ALA 28 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2nr2 h ALA 28 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2nr2 h ALA 28 CO -0.01 0.13 -0.40 -0.22 0.00 0.00 0.00 179.25 178.76 2nr2 h LYS 29 N 0.82 0.12 -0.38 0.00 3.64 -0.62 -1.64 116.57 118.50 2nr2 h LYS 29 Ca 0.39 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.60 2nr2 h LYS 29 Cb 0.42 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2nr2 h LYS 29 CO -0.16 0.50 -0.22 0.82 -2.27 0.00 0.00 179.45 178.12 2nr2 h ILE 30 N 0.10 1.28 -0.63 2.00 2.04 -0.12 -1.24 117.51 120.94 2nr2 h ILE 30 Ca 0.01 -1.37 0.10 0.00 1.00 0.00 0.00 64.86 64.60 2nr2 h ILE 30 Cb 0.75 1.34 -0.08 0.00 -0.74 0.00 0.00 36.82 38.09 2nr2 h ILE 30 CO 0.06 0.45 0.24 -0.61 0.00 0.00 0.00 178.15 178.29 2nr2 h GLN 31 N 0.63 0.41 0.11 2.37 4.15 -0.93 0.18 115.11 122.03 2nr2 h GLN 31 Ca 0.08 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 2nr2 h GLN 31 Cb 0.78 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 2nr2 h GLN 31 CO 0.06 0.27 -0.10 0.22 -1.93 0.00 0.00 178.83 177.35 2nr2 h ASP 32 N 0.42 -0.27 0.54 -0.69 3.58 -1.24 -3.02 116.42 115.74 2nr2 h ASP 32 Ca 0.32 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.77 2nr2 h ASP 32 Cb 0.41 0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2nr2 h ASP 32 CO -0.32 -0.13 -0.27 0.50 -2.88 0.00 0.00 179.24 176.14 2nr2 h LYS 33 N -0.21 -0.71 0.00 0.28 3.64 -0.95 -3.39 116.57 115.24 2nr2 h LYS 33 Ca -0.01 0.05 -0.31 0.00 -1.27 0.00 0.00 60.65 59.10 2nr2 h LYS 33 Cb 0.18 0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 2nr2 h LYS 33 CO -0.01 -0.47 -1.78 0.39 -2.27 0.00 0.00 179.45 175.31 2nr2 n GLU 34 N -5.41 0.57 0.00 1.90 -0.58 0.60 -5.06 120.64 112.66 2nr2 n GLU 34 Ca -0.12 0.41 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 2nr2 n GLU 34 Cb 0.31 -1.61 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 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 1.36 1.99 3.71 0.62 0.00 -0.98 -5.01 105.19 106.88 2nr2 n GLY 35 Ca -0.40 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 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 4.84 0.28 -0.61 -1.09 -1.26 -4.94 121.20 116.43 2nr2 s ILE 36 Ca 0.00 -0.03 -0.29 0.00 -2.23 0.00 0.00 60.65 58.10 2nr2 s ILE 36 Cb 0.00 -3.13 -0.10 0.00 -1.58 0.00 0.00 42.46 37.65 2nr2 s ILE 36 CO 0.00 0.54 1.33 -2.84 -1.23 0.00 0.00 174.94 172.74 2nr2 s PRO 37 N -0.31 4.36 0.65 2.79 0.02 -1.26 -3.79 135.00 137.45 2nr2 s PRO 37 Ca 0.09 2.18 0.40 0.00 0.02 0.00 0.00 61.00 63.69 2nr2 s PRO 37 Cb -0.12 -3.11 2.23 0.00 0.02 0.00 0.00 34.50 33.52 2nr2 s PRO 37 CO 0.02 -0.24 2.30 -1.00 -0.33 0.00 0.00 177.00 177.75 2nr2 h PRO 38 N 4.21 0.00 -0.77 5.54 0.13 -1.96 -2.72 132.00 136.43 2nr2 h PRO 38 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2nr2 h PRO 38 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 2nr2 h PRO 38 CO 0.71 0.00 0.34 -0.44 -0.23 0.00 0.00 178.00 178.38 2nr2 h ASP 39 N 0.00 1.02 0.84 1.44 3.32 -1.97 -3.10 116.42 117.97 2nr2 h ASP 39 Ca 0.00 -0.13 -0.19 0.00 0.02 0.00 0.00 57.03 56.73 2nr2 h ASP 39 Cb 0.09 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 2nr2 h ASP 39 CO -0.00 0.88 -0.91 1.56 -1.72 0.00 0.00 179.24 179.05 2nr2 h GLN 40 N 1.10 0.04 -7.09 3.56 4.20 -1.87 -3.46 115.11 111.60 2nr2 h GLN 40 Ca 0.26 -0.06 -0.45 0.00 0.06 0.00 0.00 58.65 58.47 2nr2 h GLN 40 Cb 0.15 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2nr2 h GLN 40 CO -0.03 0.92 0.35 -0.65 -0.67 0.00 0.00 178.83 178.75 2nr2 s GLN 41 N -2.98 4.12 0.04 1.46 -0.21 -1.17 -1.28 119.66 119.64 2nr2 s GLN 41 Ca -0.00 1.11 -0.00 0.00 0.02 0.00 0.00 55.36 56.48 2nr2 s GLN 41 Cb 0.10 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 2nr2 s GLN 41 CO 0.81 -0.13 -0.03 1.03 -2.12 0.00 0.00 175.29 174.85 2nr2 s ARG 42 N -3.39 0.50 -0.04 2.91 0.52 0.22 -4.61 118.95 115.06 2nr2 s ARG 42 Ca 0.62 -0.99 -0.00 0.00 -0.52 0.00 0.00 55.73 54.84 2nr2 s ARG 42 Cb -0.10 0.15 0.03 0.00 0.52 0.00 0.00 34.95 35.55 2nr2 s ARG 42 CO 0.18 -0.08 -0.00 -0.51 0.02 0.00 0.00 175.30 174.90 2nr2 s LEU 43 N -2.35 0.97 0.01 2.53 1.43 -1.26 -1.51 118.68 118.49 2nr2 s LEU 43 Ca -0.02 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2nr2 s LEU 43 Cb 0.01 -0.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 2nr2 s LEU 43 CO -0.06 -0.13 0.08 -0.63 0.23 0.00 0.00 176.35 175.84 2nr2 s ILE 44 N 1.33 4.69 -0.06 -0.59 -1.09 0.10 -1.40 121.20 124.18 2nr2 s ILE 44 Ca -0.05 -0.46 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 2nr2 s ILE 44 Cb -0.13 -3.15 0.02 0.00 -1.58 0.00 0.00 42.46 37.62 2nr2 s ILE 44 CO -0.02 0.32 -0.03 0.12 -1.23 0.00 0.00 174.94 174.10 2nr2 s PHE 45 N -1.21 0.77 0.00 3.97 5.36 0.48 -0.74 117.98 126.60 2nr2 s PHE 45 Ca 0.24 -0.23 0.00 0.00 -0.96 0.00 0.00 56.93 55.98 2nr2 s PHE 45 Cb -0.12 -0.73 0.00 0.00 -0.34 0.00 0.00 43.02 41.83 2nr2 s PHE 45 CO 0.15 -0.25 0.00 0.00 -1.46 0.00 0.00 175.22 173.66 2nr2 n ALA 46 N 4.40 0.00 -0.25 11.12 0.00 -1.26 -1.42 120.51 133.10 2nr2 n ALA 46 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2nr2 n ALA 46 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.32 3.96 0.00 0.00 -1.26 -5.14 105.19 103.06 2nr2 n GLY 47 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 3.28 -0.15 1.61 1.02 -0.50 -5.10 119.74 119.90 2nr2 s LYS 48 Ca 0.00 -0.53 0.01 0.00 0.02 0.00 0.00 55.97 55.47 2nr2 s LYS 48 Cb 0.00 -2.67 -0.00 0.00 -0.52 0.00 0.00 37.83 34.64 2nr2 s LYS 48 CO 0.00 0.01 -0.16 -1.14 -0.92 0.00 0.00 175.35 173.14 2nr2 s GLN 49 N -4.35 3.21 -0.07 1.68 0.74 -1.26 -0.39 119.66 119.22 2nr2 s GLN 49 Ca 0.43 -0.76 -0.19 0.00 0.05 0.00 0.00 55.36 54.89 2nr2 s GLN 49 Cb -0.10 -2.59 -0.05 0.00 1.10 0.00 0.00 33.01 31.38 2nr2 s GLN 49 CO 0.35 0.05 0.53 -0.51 -0.55 0.00 0.00 175.29 175.17 2nr2 s LEU 50 N 0.72 4.34 0.48 3.68 1.43 -0.49 -4.98 118.68 123.85 2nr2 s LEU 50 Ca -0.07 0.98 -0.24 0.00 -1.03 0.00 0.00 54.13 53.76 2nr2 s LEU 50 Cb -0.16 -2.80 -0.07 0.00 0.03 0.00 0.00 46.19 43.19 2nr2 s LEU 50 CO 0.01 0.04 1.42 -1.61 0.23 0.00 0.00 176.35 176.45 2nr2 s GLU 51 N 0.26 3.51 0.08 1.70 2.02 -1.26 -4.77 118.70 120.24 2nr2 s GLU 51 Ca 0.29 2.40 -0.16 0.00 0.02 0.00 0.00 54.97 57.52 2nr2 s GLU 51 Cb -0.16 -2.54 -0.10 0.00 0.10 0.00 0.00 34.13 31.42 2nr2 s GLU 51 CO 0.14 -0.95 1.39 -0.44 0.02 0.00 0.00 175.26 175.41 2nr2 h ASP 52 N 2.06 0.68 -1.83 -0.19 3.32 -1.96 -2.37 116.42 116.13 2nr2 h ASP 52 Ca -0.51 -0.49 -0.73 0.00 0.02 0.00 0.00 57.03 55.32 2nr2 h ASP 52 Cb 1.28 -0.19 -0.24 0.00 0.22 0.00 0.00 39.33 40.39 2nr2 h ASP 52 CO 0.60 1.04 1.05 0.61 -1.72 0.00 0.00 179.24 180.82 2nr2 n GLY 53 N 0.23 5.45 3.41 2.75 0.00 -1.26 -0.74 105.19 115.04 2nr2 n GLY 53 Ca -0.05 -2.37 -0.26 0.00 0.00 0.00 0.00 46.02 43.35 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 -3.51 1.50 0.56 1.61 0.52 -0.89 -4.99 118.95 113.75 2nr2 s ARG 54 Ca 0.50 -1.54 -0.02 0.00 -0.52 0.00 0.00 55.73 54.15 2nr2 s ARG 54 Cb 0.35 -1.75 0.02 0.00 0.52 0.00 0.00 34.95 34.10 2nr2 s ARG 54 CO -0.29 0.37 0.81 0.95 0.02 0.00 0.00 175.30 177.16 2nr2 s THR 55 N -1.86 3.17 0.14 0.02 -4.23 -1.26 -1.91 115.64 109.72 2nr2 s THR 55 Ca 0.21 -0.42 -0.13 0.00 -1.18 0.00 0.00 61.69 60.17 2nr2 s THR 55 Cb -0.07 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.56 2nr2 s THR 55 CO 0.10 -0.19 1.63 -0.07 -0.54 0.00 0.00 174.62 175.55 2nr2 h LEU 56 N 0.00 0.76 -1.00 4.79 3.38 -1.10 -2.82 115.31 119.32 2nr2 h LEU 56 Ca -0.44 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.30 2nr2 h LEU 56 Cb 1.28 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 2nr2 h LEU 56 CO 0.57 0.83 0.66 -1.28 0.09 0.00 0.00 178.44 179.30 2nr2 h SER 57 N 0.67 1.11 -0.85 -0.43 0.87 -0.89 -0.79 113.55 113.23 2nr2 h SER 57 Ca 0.15 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 2nr2 h SER 57 Cb 0.40 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 2nr2 h SER 57 CO 0.01 0.77 0.50 -0.78 -0.53 0.00 0.00 176.83 176.80 2nr2 h ASP 58 N 1.29 1.03 0.96 6.23 3.58 -1.80 -1.79 116.42 125.92 2nr2 h ASP 58 Ca 0.39 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.76 2nr2 h ASP 58 Cb -0.04 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.75 2nr2 h ASP 58 CO -0.11 0.81 0.00 -1.22 -2.88 0.00 0.00 179.24 175.83 2nr2 n TYR 59 N -4.41 0.02 -3.14 0.28 4.01 -1.07 -4.94 117.16 107.91 2nr2 n TYR 59 Ca 0.09 0.01 -0.14 0.00 -0.16 0.00 0.00 57.90 57.69 2nr2 n TYR 59 Cb 0.07 -0.51 0.05 0.00 -0.31 0.00 0.00 39.34 38.64 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 -1.52 -4.52 -4.76 7.72 4.13 -0.67 -5.05 115.26 110.59 2nr2 n ASN 60 Ca 0.07 -0.32 -0.40 0.00 1.68 0.00 0.00 54.58 55.61 2nr2 n ASN 60 Cb 0.33 -3.15 -0.04 0.00 -1.54 0.00 0.00 39.78 35.38 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 -3.19 3.30 0.45 2.41 1.01 -0.38 -4.99 121.20 119.82 2nr2 s ILE 61 Ca 0.34 1.29 0.00 0.00 0.00 0.00 0.00 60.65 62.28 2nr2 s ILE 61 Cb -0.15 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.50 2nr2 s ILE 61 CO 0.43 0.30 0.03 0.00 0.00 0.00 0.00 174.94 175.69 2nr2 n GLN 62 N 1.20 0.90 -2.03 2.79 6.02 -1.26 -4.64 117.38 120.36 2nr2 n GLN 62 Ca -0.00 -3.25 -0.37 0.00 -0.01 0.00 0.00 57.00 53.36 2nr2 n GLN 62 Cb 0.44 0.83 0.02 0.00 1.02 0.00 0.00 30.24 32.55 2nr2 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2nr2 s LYS 63 N -3.65 3.30 -1.05 -1.09 -2.85 -1.26 -3.86 119.74 109.28 2nr2 s LYS 63 Ca 0.02 1.93 0.00 0.00 -1.00 0.00 0.00 55.97 56.92 2nr2 s LYS 63 Cb -0.00 -2.19 0.00 0.00 -2.06 0.00 0.00 37.83 33.58 2nr2 s LYS 63 CO 0.01 -0.97 0.00 0.39 0.10 0.00 0.00 175.35 174.88 2nr2 n GLU 64 N -1.04 -0.72 -3.49 1.78 1.02 -0.84 -5.00 120.64 112.36 2nr2 n GLU 64 Ca 0.10 0.80 -0.37 0.00 -0.02 0.00 0.00 57.16 57.67 2nr2 n GLU 64 Cb 0.48 -4.75 -0.06 0.00 -0.02 0.00 0.00 31.44 27.08 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 -2.84 6.81 -0.57 1.62 0.01 -1.25 -4.83 113.70 112.65 2nr2 s SER 65 Ca 0.00 0.97 -0.18 0.00 1.31 0.00 0.00 55.95 58.05 2nr2 s SER 65 Cb 0.00 -2.25 0.11 0.00 0.21 0.00 0.00 66.02 64.09 2nr2 s SER 65 CO 0.00 0.28 0.64 -0.89 0.41 0.00 0.00 173.24 173.68 2nr2 s THR 66 N -1.16 4.94 0.39 1.44 2.01 -1.26 -0.92 115.64 121.08 2nr2 s THR 66 Ca 0.27 -1.09 -0.17 0.00 0.31 0.00 0.00 61.69 61.00 2nr2 s THR 66 Cb -0.16 -4.43 -0.09 0.00 0.01 0.00 0.00 72.50 67.83 2nr2 s THR 66 CO 0.15 -1.02 0.84 -0.76 -0.69 0.00 0.00 174.62 173.14 2nr2 s LEU 67 N 2.37 3.95 -0.50 4.42 1.43 -0.03 -4.73 118.68 125.60 2nr2 s LEU 67 Ca 0.09 1.44 -0.09 0.00 -1.03 0.00 0.00 54.13 54.55 2nr2 s LEU 67 Cb -0.25 -4.29 0.13 0.00 0.03 0.00 0.00 46.19 41.81 2nr2 s LEU 67 CO 0.06 -0.32 0.37 -1.00 0.23 0.00 0.00 176.35 175.69 2nr2 s HIS 68 N -2.16 3.44 -0.09 0.29 3.76 0.08 -0.25 115.29 120.36 2nr2 s HIS 68 Ca 0.57 -1.94 -0.29 0.00 -0.15 0.00 0.00 55.06 53.25 2nr2 s HIS 68 Cb -0.10 -3.50 -0.06 0.00 1.11 0.00 0.00 32.58 30.04 2nr2 s HIS 68 CO 0.18 -0.99 1.88 -1.17 -0.85 0.00 0.00 174.74 173.80 2nr2 s LEU 69 N 1.21 4.08 0.00 0.89 2.96 -0.73 -0.72 118.68 126.36 2nr2 s LEU 69 Ca 0.07 2.18 0.04 0.00 -0.22 0.00 0.00 54.13 56.20 2nr2 s LEU 69 Cb -0.25 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.90 2nr2 s LEU 69 CO -0.01 -1.27 0.15 1.33 -1.32 0.00 0.00 176.35 175.22 2nr2 n VAL 70 N 6.21 0.00 -4.56 1.68 0.24 -0.57 -3.90 118.33 117.44 2nr2 n VAL 70 Ca 0.21 -2.20 -0.30 0.00 -2.04 0.00 0.00 64.34 60.02 2nr2 n VAL 70 Cb 0.43 0.82 -0.08 0.00 -1.47 0.00 0.00 33.84 33.54 2nr2 n VAL 70 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2nr2 s LEU 71 N 0.00 2.64 0.19 1.34 1.43 -1.26 -0.61 118.68 122.40 2nr2 s LEU 71 Ca 0.21 -1.45 -0.14 0.00 -1.03 0.00 0.00 54.13 51.72 2nr2 s LEU 71 Cb 0.01 -0.92 0.19 0.00 0.03 0.00 0.00 46.19 45.50 2nr2 s LEU 71 CO 0.15 -0.69 1.68 0.08 0.23 0.00 0.00 176.35 177.79 2nr2 h ARG 72 N 1.46 0.10 -6.10 1.70 0.11 -1.44 -3.40 114.38 106.81 2nr2 h ARG 72 Ca -0.43 -0.01 -0.58 0.00 0.10 0.00 0.00 59.98 59.06 2nr2 h ARG 72 Cb 1.28 -0.02 -0.06 0.00 1.11 0.00 0.00 29.97 32.28 2nr2 h ARG 72 CO 0.75 0.07 0.79 -0.51 0.10 0.00 0.00 179.97 181.16 2nr2 s LEU 73 N -10.59 4.12 -0.06 0.08 1.43 -1.26 -5.03 118.68 107.37 2nr2 s LEU 73 Ca -0.14 1.42 -0.30 0.00 -1.03 0.00 0.00 54.13 54.09 2nr2 s LEU 73 Cb 0.16 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 2nr2 s LEU 73 CO 0.72 -0.66 1.42 -0.60 0.23 0.00 0.00 176.35 177.47 2nr2 s ARG 74 N 3.12 4.25 -0.30 1.70 3.52 -1.26 -4.97 118.95 125.01 2nr2 s ARG 74 Ca 0.45 1.93 -0.10 0.00 -0.13 0.00 0.00 55.73 57.89 2nr2 s ARG 74 Cb -0.16 -3.73 0.18 0.00 -1.56 0.00 0.00 34.95 29.68 2nr2 s ARG 74 CO 0.08 -0.67 0.95 0.20 -0.81 0.00 0.00 175.30 175.04 2nr2 s GLY 75 N 2.27 -0.55 0.00 8.12 0.00 -1.26 -5.16 107.32 110.74 2nr2 s GLY 75 Ca 0.64 2.49 0.00 0.00 0.00 0.00 0.00 44.72 47.84 2nr2 s GLY 75 CO 0.24 3.75 0.00 0.61 0.00 0.00 0.00 173.10 177.70