#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 1.43 0.10 3.17 -2.07 -1.26 -0.20 119.66 120.83 2nr2 s GLN 2 Ca 0.00 -0.59 0.07 0.00 -1.82 0.00 0.00 55.36 53.02 2nr2 s GLN 2 Cb 0.00 -1.35 -0.03 0.00 -1.09 0.00 0.00 33.01 30.53 2nr2 s GLN 2 CO 0.00 0.33 -0.18 0.96 -1.32 0.00 0.00 175.29 175.08 2nr2 s ILE 3 N -0.29 1.51 -0.12 3.63 -4.36 -1.10 -0.23 121.20 120.24 2nr2 s ILE 3 Ca 0.04 -1.53 -0.10 0.00 -0.26 0.00 0.00 60.65 58.80 2nr2 s ILE 3 Cb -0.08 -1.44 -0.05 0.00 1.25 0.00 0.00 42.46 42.15 2nr2 s ILE 3 CO -0.00 -0.17 0.21 -0.36 0.24 0.00 0.00 174.94 174.85 2nr2 s PHE 4 N -1.39 3.57 -0.17 1.37 0.08 0.04 -2.06 117.98 119.42 2nr2 s PHE 4 Ca 0.05 0.59 -0.02 0.00 0.12 0.00 0.00 56.93 57.67 2nr2 s PHE 4 Cb -0.09 -2.10 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 2nr2 s PHE 4 CO 0.04 0.57 -0.08 0.08 -0.10 0.00 0.00 175.22 175.73 2nr2 s VAL 5 N -0.58 3.27 -0.19 -0.44 1.01 0.16 -1.38 120.40 122.25 2nr2 s VAL 5 Ca 0.16 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.51 2nr2 s VAL 5 Cb -0.13 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2nr2 s VAL 5 CO 0.05 0.48 0.04 -0.54 0.00 0.00 0.00 175.10 175.13 2nr2 s LYS 6 N 0.81 3.86 0.79 2.72 -0.14 -0.61 -0.69 119.74 126.49 2nr2 s LYS 6 Ca -0.03 -0.40 -0.09 0.00 -1.36 0.00 0.00 55.97 54.09 2nr2 s LYS 6 Cb -0.15 -3.16 0.12 0.00 -1.68 0.00 0.00 37.83 32.96 2nr2 s LYS 6 CO 0.01 0.20 1.12 0.95 -0.76 0.00 0.00 175.35 176.87 2nr2 s THR 7 N 0.56 2.14 0.20 2.17 -4.23 -0.96 -1.86 115.64 113.66 2nr2 s THR 7 Ca 0.02 -0.23 -0.06 0.00 -1.18 0.00 0.00 61.69 60.24 2nr2 s THR 7 Cb -0.13 -2.91 0.03 0.00 1.34 0.00 0.00 72.50 70.83 2nr2 s THR 7 CO 0.01 0.00 1.62 -0.07 -0.54 0.00 0.00 174.62 175.64 2nr2 h LEU 8 N -0.94 0.84 -0.03 4.79 -0.00 -1.91 -2.99 115.31 115.08 2nr2 h LEU 8 Ca -0.43 -0.30 -0.12 0.00 -0.00 0.00 0.00 57.88 57.03 2nr2 h LEU 8 Cb 1.28 -0.23 0.01 0.00 -0.00 0.00 0.00 40.66 41.72 2nr2 h LEU 8 CO 0.50 1.03 -0.43 0.71 -0.00 0.00 0.00 178.44 180.25 2nr2 h THR 9 N 0.72 1.45 0.00 0.22 1.35 -1.98 -3.48 112.91 111.19 2nr2 h THR 9 Ca 0.10 -1.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.03 2nr2 h THR 9 Cb 0.74 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.69 2nr2 h THR 9 CO 0.06 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 2nr2 n GLY 10 N 0.93 0.74 3.82 5.82 0.00 -1.13 -5.16 105.19 110.21 2nr2 n GLY 10 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 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 2.92 -0.19 1.61 2.20 -1.26 -4.89 119.74 120.14 2nr2 s LYS 11 Ca 0.00 -0.98 -0.03 0.00 -0.36 0.00 0.00 55.97 54.60 2nr2 s LYS 11 Cb 0.00 -2.60 -0.02 0.00 -1.51 0.00 0.00 37.83 33.70 2nr2 s LYS 11 CO 0.00 0.43 -0.05 0.99 -0.36 0.00 0.00 175.35 176.36 2nr2 s THR 12 N -1.98 3.50 -0.27 3.43 2.01 -1.26 -2.26 115.64 118.81 2nr2 s THR 12 Ca 0.32 -0.47 -0.11 0.00 0.31 0.00 0.00 61.69 61.74 2nr2 s THR 12 Cb -0.09 -2.56 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 2nr2 s THR 12 CO 0.24 0.46 0.18 -0.63 -0.69 0.00 0.00 174.62 174.18 2nr2 s ILE 13 N 0.98 5.32 -0.33 1.82 1.01 0.14 -4.89 121.20 125.25 2nr2 s ILE 13 Ca -0.00 0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.72 2nr2 s ILE 13 Cb -0.15 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2nr2 s ILE 13 CO 0.01 0.28 0.16 -0.89 0.00 0.00 0.00 174.94 174.49 2nr2 s THR 14 N 1.55 4.51 -0.02 2.92 2.01 -1.26 0.38 115.64 125.72 2nr2 s THR 14 Ca 0.07 -0.57 -0.03 0.00 0.31 0.00 0.00 61.69 61.47 2nr2 s THR 14 Cb -0.15 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2nr2 s THR 14 CO 0.09 -0.01 0.15 -0.76 -0.69 0.00 0.00 174.62 173.40 2nr2 s LEU 15 N 1.58 4.25 -0.38 4.42 1.43 -0.87 -4.99 118.68 124.13 2nr2 s LEU 15 Ca 0.04 0.31 -0.16 0.00 -1.03 0.00 0.00 54.13 53.29 2nr2 s LEU 15 Cb -0.18 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.59 2nr2 s LEU 15 CO 0.06 0.28 0.39 -1.61 0.23 0.00 0.00 176.35 175.70 2nr2 s GLU 16 N -1.77 3.32 0.25 1.70 2.02 -1.26 -2.70 118.70 120.27 2nr2 s GLU 16 Ca 0.25 -0.61 0.01 0.00 0.02 0.00 0.00 54.97 54.64 2nr2 s GLU 16 Cb -0.12 -3.89 -0.05 0.00 0.10 0.00 0.00 34.13 30.17 2nr2 s GLU 16 CO 0.16 -0.68 0.10 0.14 0.02 0.00 0.00 175.26 174.99 2nr2 s VAL 17 N 2.04 0.52 0.28 2.63 -7.23 0.72 -4.96 120.40 114.41 2nr2 s VAL 17 Ca 0.11 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.38 2nr2 s VAL 17 Cb -0.17 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 2nr2 s VAL 17 CO 0.12 -0.01 -0.03 -1.61 -0.31 0.00 0.00 175.10 173.27 2nr2 s GLU 18 N -4.04 2.18 0.04 4.82 0.41 -1.26 0.13 118.70 120.97 2nr2 s GLU 18 Ca 0.38 -1.51 0.14 0.00 -0.41 0.00 0.00 54.97 53.56 2nr2 s GLU 18 Cb 0.08 -2.08 0.59 0.00 -1.78 0.00 0.00 34.13 30.94 2nr2 s GLU 18 CO 0.13 0.32 1.43 -0.35 -0.49 0.00 0.00 175.26 176.31 2nr2 n PRO 19 N -0.87 0.03 0.09 0.39 -0.04 -1.26 -1.41 135.00 131.93 2nr2 n PRO 19 Ca -0.06 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 2nr2 n PRO 19 Cb 0.60 -1.55 0.20 0.00 -0.04 0.00 0.00 33.50 32.70 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2nr2 h SER 20 N 0.00 0.00 -4.03 3.54 4.64 -1.96 -1.39 113.55 114.34 2nr2 h SER 20 Ca 0.00 -0.11 -0.50 0.00 -0.47 0.00 0.00 61.79 60.71 2nr2 h SER 20 Cb 0.22 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.38 2nr2 h SER 20 CO 0.00 0.06 0.46 -1.81 -0.87 0.00 0.00 176.83 174.66 2nr2 s ASP 21 N -4.68 6.04 0.44 4.97 1.01 -0.50 -4.79 116.67 119.17 2nr2 s ASP 21 Ca 0.06 2.23 0.03 0.00 0.71 0.00 0.00 52.55 55.58 2nr2 s ASP 21 Cb 0.12 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.46 2nr2 s ASP 21 CO 0.70 -1.00 0.63 0.42 0.21 0.00 0.00 175.17 176.13 2nr2 s THR 22 N -1.65 3.67 0.37 -1.27 -4.23 -1.26 -2.94 115.64 108.33 2nr2 s THR 22 Ca 0.67 -0.71 0.10 0.00 -1.18 0.00 0.00 61.69 60.56 2nr2 s THR 22 Cb -0.26 -3.32 0.13 0.00 1.34 0.00 0.00 72.50 70.39 2nr2 s THR 22 CO 0.31 -0.19 1.87 0.40 -0.54 0.00 0.00 174.62 176.47 2nr2 h ILE 23 N 0.49 1.21 -0.59 2.99 1.08 -1.21 -0.47 117.51 121.01 2nr2 h ILE 23 Ca -0.45 -0.96 0.11 0.00 -0.39 0.00 0.00 64.86 63.18 2nr2 h ILE 23 Cb 1.26 1.35 -0.11 0.00 -3.07 0.00 0.00 36.82 36.25 2nr2 h ILE 23 CO 0.54 0.29 -0.25 -0.08 -0.69 0.00 0.00 178.15 177.96 2nr2 h GLU 24 N 0.19 -0.09 -0.19 2.37 4.81 -1.54 0.30 114.58 120.43 2nr2 h GLU 24 Ca 0.03 0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.12 2nr2 h GLU 24 Cb 0.48 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 2nr2 h GLU 24 CO 0.03 -0.06 -0.51 -0.91 -0.73 0.00 0.00 179.01 176.83 2nr2 h ASN 25 N -0.10 0.58 -0.01 1.04 2.35 -1.66 -2.46 115.58 115.32 2nr2 h ASN 25 Ca 0.26 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 2nr2 h ASN 25 Cb 0.51 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.72 2nr2 h ASN 25 CO -0.65 0.99 -0.01 0.58 -1.65 0.00 0.00 177.43 176.68 2nr2 h VAL 26 N 0.42 1.40 0.00 2.81 2.07 -0.72 -2.92 116.25 119.31 2nr2 h VAL 26 Ca 0.02 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 2nr2 h VAL 26 Cb 1.03 2.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2nr2 h VAL 26 CO 0.09 0.31 -0.10 0.11 0.02 0.00 0.00 177.57 178.01 2nr2 h LYS 27 N -0.46 0.00 -0.80 1.57 1.57 -0.91 -2.51 116.57 115.02 2nr2 h LYS 27 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2nr2 h LYS 27 Cb 0.52 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 2nr2 h LYS 27 CO 0.00 0.10 0.37 0.00 -0.57 0.00 0.00 179.45 179.35 2nr2 h ALA 28 N 1.90 1.03 0.00 3.86 0.00 -1.39 -2.40 119.26 122.26 2nr2 h ALA 28 Ca -0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2nr2 h ALA 28 Cb 0.20 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2nr2 h ALA 28 CO 0.01 0.61 -0.08 0.87 0.00 0.00 0.00 179.25 180.67 2nr2 h LYS 29 N 1.14 0.00 -0.08 0.00 1.57 -1.25 -2.19 116.57 115.75 2nr2 h LYS 29 Ca 0.27 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.89 2nr2 h LYS 29 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.46 2nr2 h LYS 29 CO -0.03 0.08 -0.61 0.82 -0.57 0.00 0.00 179.45 179.14 2nr2 h ILE 30 N 0.00 1.36 -0.34 1.86 2.04 -1.47 -2.56 117.51 118.41 2nr2 h ILE 30 Ca -0.00 -1.93 -0.03 0.00 1.00 0.00 0.00 64.86 63.90 2nr2 h ILE 30 Cb 0.17 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 2nr2 h ILE 30 CO 0.01 0.58 0.07 -0.61 0.00 0.00 0.00 178.15 178.21 2nr2 h GLN 31 N 0.16 0.50 -0.22 2.37 4.15 -0.99 0.53 115.11 121.61 2nr2 h GLN 31 Ca -0.05 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.27 2nr2 h GLN 31 Cb 1.26 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 2nr2 h GLN 31 CO 0.12 0.47 0.06 0.22 -1.93 0.00 0.00 178.83 177.77 2nr2 h ASP 32 N 0.49 0.33 0.05 -0.69 3.58 -1.46 -2.45 116.42 116.27 2nr2 h ASP 32 Ca 0.11 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.35 2nr2 h ASP 32 Cb 0.20 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2nr2 h ASP 32 CO -0.00 0.45 -0.03 0.50 -2.88 0.00 0.00 179.24 177.29 2nr2 h LYS 33 N 0.18 -0.07 0.00 0.28 3.64 -1.01 -3.41 116.57 116.18 2nr2 h LYS 33 Ca 0.07 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.11 2nr2 h LYS 33 Cb 0.25 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.02 2nr2 h LYS 33 CO -0.00 -0.01 -2.31 0.39 -2.27 0.00 0.00 179.45 175.25 2nr2 n GLU 34 N -4.82 0.88 -0.26 1.90 -0.58 0.17 -5.02 120.64 112.90 2nr2 n GLU 34 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2nr2 n GLU 34 Cb 0.05 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 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 1.87 0.84 3.65 0.62 0.00 -0.41 -4.99 105.19 106.77 2nr2 n GLY 35 Ca -0.32 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 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 5.08 0.42 -0.61 1.01 -1.26 -4.92 121.20 118.93 2nr2 s ILE 36 Ca 0.00 0.99 -0.25 0.00 0.00 0.00 0.00 60.65 61.39 2nr2 s ILE 36 Cb 0.00 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 2nr2 s ILE 36 CO 0.00 0.15 1.24 -2.84 0.00 0.00 0.00 174.94 173.49 2nr2 s PRO 37 N 1.79 3.89 0.50 2.79 0.02 -1.26 -3.90 135.00 138.83 2nr2 s PRO 37 Ca 0.24 1.99 0.27 0.00 0.02 0.00 0.00 61.00 63.52 2nr2 s PRO 37 Cb -0.15 -2.63 1.31 0.00 0.02 0.00 0.00 34.50 33.05 2nr2 s PRO 37 CO 0.10 -0.50 2.00 -1.00 -0.33 0.00 0.00 177.00 177.27 2nr2 h PRO 38 N 2.46 0.00 0.00 5.54 0.13 -1.94 -1.91 132.00 136.28 2nr2 h PRO 38 Ca -0.49 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 2nr2 h PRO 38 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2nr2 h PRO 38 CO 0.62 0.15 -0.24 -0.44 -0.23 0.00 0.00 178.00 177.85 2nr2 h ASP 39 N 0.00 0.00 1.00 1.44 3.32 -1.98 -2.96 116.42 117.24 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 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2nr2 h ASP 39 CO 0.02 0.24 -0.87 -0.61 -1.72 0.00 0.00 179.24 176.30 2nr2 h GLN 40 N 0.00 0.00 -6.15 3.56 4.15 -1.71 -3.46 115.11 111.51 2nr2 h GLN 40 Ca -0.00 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.85 2nr2 h GLN 40 Cb 0.59 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.23 2nr2 h GLN 40 CO 0.03 0.00 0.43 -0.65 -1.93 0.00 0.00 178.83 176.71 2nr2 s GLN 41 N -3.31 4.40 -0.11 1.69 -0.21 -1.12 -1.27 119.66 119.74 2nr2 s GLN 41 Ca 0.01 1.21 0.03 0.00 0.02 0.00 0.00 55.36 56.64 2nr2 s GLN 41 Cb 0.10 -3.53 0.00 0.00 1.00 0.00 0.00 33.01 30.58 2nr2 s GLN 41 CO 0.77 -0.25 -0.23 1.03 -2.12 0.00 0.00 175.29 174.49 2nr2 s ARG 42 N 1.81 3.07 -0.11 2.91 0.52 -0.15 -4.97 118.95 122.03 2nr2 s ARG 42 Ca 0.44 -0.86 -0.05 0.00 -0.52 0.00 0.00 55.73 54.74 2nr2 s ARG 42 Cb -0.18 -2.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 2nr2 s ARG 42 CO 0.17 0.16 0.08 -0.51 0.02 0.00 0.00 175.30 175.22 2nr2 s LEU 43 N 0.40 4.03 0.08 2.53 1.43 -1.26 -1.08 118.68 124.81 2nr2 s LEU 43 Ca -0.17 0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.34 2nr2 s LEU 43 Cb -0.18 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2nr2 s LEU 43 CO 0.07 0.38 -0.25 -0.63 0.23 0.00 0.00 176.35 176.16 2nr2 s ILE 44 N -0.90 2.08 -0.24 -0.59 -1.09 0.12 -1.13 121.20 119.45 2nr2 s ILE 44 Ca 0.14 -1.51 -0.03 0.00 -2.23 0.00 0.00 60.65 57.02 2nr2 s ILE 44 Cb -0.12 -1.81 0.08 0.00 -1.58 0.00 0.00 42.46 39.03 2nr2 s ILE 44 CO 0.03 0.20 0.08 0.12 -1.23 0.00 0.00 174.94 174.15 2nr2 s PHE 45 N -0.93 0.91 0.00 3.97 5.36 -0.66 -0.38 117.98 126.25 2nr2 s PHE 45 Ca 0.11 -1.00 0.00 0.00 -0.96 0.00 0.00 56.93 55.08 2nr2 s PHE 45 Cb -0.10 -1.12 0.00 0.00 -0.34 0.00 0.00 43.02 41.46 2nr2 s PHE 45 CO 0.04 -0.71 0.00 0.00 -1.46 0.00 0.00 175.22 173.08 2nr2 n ALA 46 N 5.08 0.00 -0.65 11.12 0.00 -1.26 -2.00 120.51 132.80 2nr2 n ALA 46 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2nr2 n ALA 46 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 1.00 3.70 0.00 0.00 -1.26 -5.08 105.19 103.55 2nr2 n GLY 47 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 2.91 -0.09 1.61 1.02 -0.85 -5.10 119.74 119.24 2nr2 s LYS 48 Ca 0.00 -0.51 -0.24 0.00 0.02 0.00 0.00 55.97 55.24 2nr2 s LYS 48 Cb 0.00 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 2nr2 s LYS 48 CO 0.00 0.66 0.72 -1.14 -0.92 0.00 0.00 175.35 174.66 2nr2 s GLN 49 N -1.36 4.40 0.07 1.68 0.74 -1.26 -1.66 119.66 122.27 2nr2 s GLN 49 Ca 0.18 0.88 -0.26 0.00 0.05 0.00 0.00 55.36 56.21 2nr2 s GLN 49 Cb -0.12 -3.48 -0.06 0.00 1.10 0.00 0.00 33.01 30.46 2nr2 s GLN 49 CO 0.08 -0.02 0.81 -0.51 -0.55 0.00 0.00 175.29 175.10 2nr2 s LEU 50 N 1.09 4.47 0.43 3.68 1.43 -0.29 -5.00 118.68 124.49 2nr2 s LEU 50 Ca 0.37 1.54 -0.22 0.00 -1.03 0.00 0.00 54.13 54.78 2nr2 s LEU 50 Cb -0.17 -3.31 -0.09 0.00 0.03 0.00 0.00 46.19 42.64 2nr2 s LEU 50 CO 0.17 0.01 1.03 -1.61 0.23 0.00 0.00 176.35 176.18 2nr2 s GLU 51 N -0.11 4.04 0.19 1.70 2.02 -1.26 -4.73 118.70 120.55 2nr2 s GLU 51 Ca 0.40 1.40 -0.06 0.00 0.02 0.00 0.00 54.97 56.73 2nr2 s GLU 51 Cb -0.21 -2.33 0.12 0.00 0.10 0.00 0.00 34.13 31.81 2nr2 s GLU 51 CO 0.25 -0.23 1.58 -0.44 0.02 0.00 0.00 175.26 176.44 2nr2 h ASP 52 N 2.08 0.83 -0.78 -0.19 5.19 -1.96 -3.11 116.42 118.48 2nr2 h ASP 52 Ca -0.49 -0.33 -0.36 0.00 -0.62 0.00 0.00 57.03 55.23 2nr2 h ASP 52 Cb 1.21 -0.23 -0.21 0.00 0.18 0.00 0.00 39.33 40.28 2nr2 h ASP 52 CO 0.61 1.06 0.46 0.61 -3.12 0.00 0.00 179.24 178.86 2nr2 n GLY 53 N -0.11 3.87 3.98 2.75 0.00 -1.26 -1.44 105.19 112.97 2nr2 n GLY 53 Ca -0.01 -0.89 -0.20 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.72 3.17 0.14 1.61 1.81 -1.17 -4.96 118.95 116.82 2nr2 s ARG 54 Ca 0.48 -0.97 0.01 0.00 -1.72 0.00 0.00 55.73 53.53 2nr2 s ARG 54 Cb 0.39 -2.82 0.02 0.00 -0.45 0.00 0.00 34.95 32.10 2nr2 s ARG 54 CO 0.10 0.15 0.19 0.25 -0.68 0.00 0.00 175.30 175.31 2nr2 n THR 55 N -1.57 0.00 0.01 0.02 -2.24 -1.26 -1.52 114.28 107.72 2nr2 n THR 55 Ca -0.02 -0.37 -0.07 0.00 -2.27 0.00 0.00 64.05 61.32 2nr2 n THR 55 Cb 0.58 -1.07 -0.12 0.00 -2.10 0.00 0.00 70.33 67.61 2nr2 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 56 N 0.00 0.00 -1.03 3.22 3.38 -1.46 -3.37 115.31 116.04 2nr2 h LEU 56 Ca -0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2nr2 h LEU 56 Cb 0.26 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2nr2 h LEU 56 CO 0.08 0.92 0.21 -1.28 0.09 0.00 0.00 178.44 178.47 2nr2 h SER 57 N 0.00 0.83 -0.98 -0.43 0.87 -1.45 0.23 113.55 112.63 2nr2 h SER 57 Ca -0.20 -0.13 0.15 0.00 -1.23 0.00 0.00 61.79 60.38 2nr2 h SER 57 Cb 1.89 -0.22 -0.09 0.00 -0.44 0.00 0.00 62.40 63.54 2nr2 h SER 57 CO 0.08 0.77 0.60 0.44 -0.53 0.00 0.00 176.83 178.19 2nr2 h ASP 58 N 0.89 0.82 0.09 6.23 3.32 -1.86 -2.00 116.42 123.91 2nr2 h ASP 58 Ca 0.20 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2nr2 h ASP 58 Cb 0.22 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2nr2 h ASP 58 CO -0.01 0.37 -0.23 -1.22 -1.72 0.00 0.00 179.24 176.42 2nr2 n TYR 59 N -4.71 0.00 -2.57 4.55 4.01 -1.17 -4.95 117.16 112.31 2nr2 n TYR 59 Ca 0.20 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.79 2nr2 n TYR 59 Cb 0.45 -0.05 0.01 0.00 -0.31 0.00 0.00 39.34 39.44 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 -0.10 -4.58 -4.57 7.72 4.13 -0.75 -4.98 115.26 112.13 2nr2 n ASN 60 Ca 0.13 -0.12 -0.41 0.00 1.68 0.00 0.00 54.58 55.86 2nr2 n ASN 60 Cb 0.41 -3.56 -0.03 0.00 -1.54 0.00 0.00 39.78 35.06 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 -2.87 3.63 0.00 2.41 1.01 0.79 -5.00 121.20 121.17 2nr2 s ILE 61 Ca 0.12 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.28 2nr2 s ILE 61 Cb -0.05 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.20 2nr2 s ILE 61 CO 0.15 -1.02 0.00 0.00 0.00 0.00 0.00 174.94 174.07 2nr2 n GLN 62 N 8.80 1.56 -1.74 2.79 6.02 -1.26 -4.35 117.38 129.20 2nr2 n GLN 62 Ca 0.16 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.82 2nr2 n GLN 62 Cb 0.50 0.00 0.04 0.00 1.02 0.00 0.00 30.24 31.80 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 0.11 2.90 -1.74 -1.09 -2.85 -1.26 -3.82 119.74 111.99 2nr2 s LYS 63 Ca 0.00 1.23 0.00 0.00 -1.00 0.00 0.00 55.97 56.20 2nr2 s LYS 63 Cb 0.00 -1.97 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 2nr2 s LYS 63 CO 0.00 -1.15 0.00 0.39 0.10 0.00 0.00 175.35 174.69 2nr2 n GLU 64 N -2.59 -1.55 -3.97 1.78 1.02 0.68 -4.99 120.64 111.03 2nr2 n GLU 64 Ca 0.09 0.99 -0.26 0.00 -0.02 0.00 0.00 57.16 57.96 2nr2 n GLU 64 Cb 0.53 -5.55 -0.04 0.00 -0.02 0.00 0.00 31.44 26.36 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 -2.20 6.17 -0.31 1.62 0.15 -1.25 -4.81 113.70 113.07 2nr2 s SER 65 Ca 0.00 0.11 -0.05 0.00 0.70 0.00 0.00 55.95 56.71 2nr2 s SER 65 Cb 0.00 -1.81 0.03 0.00 -1.71 0.00 0.00 66.02 62.53 2nr2 s SER 65 CO 0.00 0.06 0.07 -0.89 1.20 0.00 0.00 173.24 173.67 2nr2 s THR 66 N -1.74 3.64 0.14 6.45 2.01 -1.26 -0.78 115.64 124.11 2nr2 s THR 66 Ca 0.34 -1.03 -0.09 0.00 0.31 0.00 0.00 61.69 61.21 2nr2 s THR 66 Cb -0.11 -3.00 -0.06 0.00 0.01 0.00 0.00 72.50 69.34 2nr2 s THR 66 CO 0.27 -0.06 0.46 -0.76 -0.69 0.00 0.00 174.62 173.84 2nr2 s LEU 67 N 1.40 4.28 -0.25 4.42 1.43 -0.48 -4.81 118.68 124.68 2nr2 s LEU 67 Ca -0.01 0.82 -0.09 0.00 -1.03 0.00 0.00 54.13 53.82 2nr2 s LEU 67 Cb -0.19 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 2nr2 s LEU 67 CO 0.02 0.07 0.13 -1.00 0.23 0.00 0.00 176.35 175.80 2nr2 s HIS 68 N -1.58 3.22 -0.04 0.29 3.76 0.48 -1.57 115.29 119.85 2nr2 s HIS 68 Ca 0.39 0.01 -0.14 0.00 -0.15 0.00 0.00 55.06 55.17 2nr2 s HIS 68 Cb -0.13 -2.27 -0.05 0.00 1.11 0.00 0.00 32.58 31.24 2nr2 s HIS 68 CO 0.21 -0.10 0.38 -1.17 -0.85 0.00 0.00 174.74 173.21 2nr2 s LEU 69 N 1.32 4.42 0.04 0.89 2.96 -0.78 0.16 118.68 127.70 2nr2 s LEU 69 Ca 0.06 0.86 0.02 0.00 -0.22 0.00 0.00 54.13 54.86 2nr2 s LEU 69 Cb -0.15 -2.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.99 2nr2 s LEU 69 CO 0.06 0.27 -0.08 0.68 -1.32 0.00 0.00 176.35 175.96 2nr2 s VAL 70 N -0.74 0.55 0.24 1.68 -7.23 -0.24 -4.55 120.40 110.12 2nr2 s VAL 70 Ca 0.23 -1.09 0.09 0.00 -1.81 0.00 0.00 61.98 59.40 2nr2 s VAL 70 Cb -0.16 -0.62 -0.04 0.00 0.56 0.00 0.00 36.38 36.12 2nr2 s VAL 70 CO 0.11 -0.38 -0.01 -0.76 -0.31 0.00 0.00 175.10 173.75 2nr2 s LEU 71 N -1.59 3.21 0.62 1.32 1.43 -1.26 -0.98 118.68 121.42 2nr2 s LEU 71 Ca -0.10 -0.59 0.06 0.00 -1.03 0.00 0.00 54.13 52.47 2nr2 s LEU 71 Cb -0.10 -1.76 0.10 0.00 0.03 0.00 0.00 46.19 44.46 2nr2 s LEU 71 CO 0.00 0.02 0.85 -0.13 0.23 0.00 0.00 176.35 177.33 2nr2 s ARG 72 N -3.49 2.11 0.39 1.70 0.52 -0.40 -4.96 118.95 114.83 2nr2 s ARG 72 Ca 0.30 -1.43 -0.08 0.00 -0.52 0.00 0.00 55.73 54.00 2nr2 s ARG 72 Cb -0.07 -2.54 -0.05 0.00 0.52 0.00 0.00 34.95 32.80 2nr2 s ARG 72 CO 0.19 -1.04 0.71 -0.51 0.02 0.00 0.00 175.30 174.68 2nr2 s LEU 73 N -4.82 3.85 0.54 2.53 1.43 -1.26 -5.00 118.68 115.96 2nr2 s LEU 73 Ca 0.63 0.97 -0.09 0.00 -1.03 0.00 0.00 54.13 54.61 2nr2 s LEU 73 Cb -0.06 -3.85 -0.04 0.00 0.03 0.00 0.00 46.19 42.27 2nr2 s LEU 73 CO 0.41 -0.38 0.91 0.00 0.23 0.00 0.00 176.35 177.51 2nr2 s ARG 74 N -3.96 3.61 0.00 1.70 1.70 -1.26 -4.86 118.95 115.89 2nr2 s ARG 74 Ca 0.48 0.52 0.00 0.00 -0.47 0.00 0.00 55.73 56.27 2nr2 s ARG 74 Cb -0.10 -2.23 0.00 0.00 -0.57 0.00 0.00 34.95 32.05 2nr2 s ARG 74 CO 0.34 -0.36 0.00 0.41 -1.08 0.00 0.00 175.30 174.60 2nr2 n GLY 75 N -2.36 -0.88 0.00 3.88 0.00 -1.26 -5.25 105.19 99.31 2nr2 n GLY 75 Ca 0.04 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93