#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 4.07 -0.05 3.17 -1.52 -1.26 -1.25 119.66 122.82 2nr2 s GLN 2 Ca 0.00 0.25 0.06 0.00 -1.95 0.00 0.00 55.36 53.73 2nr2 s GLN 2 Cb 0.00 -3.33 -0.01 0.00 -0.22 0.00 0.00 33.01 29.45 2nr2 s GLN 2 CO 0.00 0.44 -0.25 0.96 -0.25 0.00 0.00 175.29 176.19 2nr2 s ILE 3 N -0.20 1.99 -0.79 1.08 -4.36 -0.85 -0.17 121.20 117.90 2nr2 s ILE 3 Ca 0.21 -1.04 -0.13 0.00 -0.26 0.00 0.00 60.65 59.43 2nr2 s ILE 3 Cb -0.15 -1.68 0.21 0.00 1.25 0.00 0.00 42.46 42.10 2nr2 s ILE 3 CO 0.08 0.56 0.71 -0.36 0.24 0.00 0.00 174.94 176.17 2nr2 s PHE 4 N -0.27 3.69 -0.68 1.37 0.08 -0.42 -1.48 117.98 120.28 2nr2 s PHE 4 Ca 0.00 -2.05 -0.27 0.00 0.12 0.00 0.00 56.93 54.73 2nr2 s PHE 4 Cb -0.12 -3.74 0.00 0.00 -0.57 0.00 0.00 43.02 38.59 2nr2 s PHE 4 CO 0.02 -0.97 1.56 0.08 -0.10 0.00 0.00 175.22 175.81 2nr2 s VAL 5 N 0.21 3.54 -0.11 -0.44 1.01 -0.51 -2.63 120.40 121.47 2nr2 s VAL 5 Ca 0.17 0.31 -0.13 0.00 0.00 0.00 0.00 61.98 62.33 2nr2 s VAL 5 Cb -0.12 -4.44 -0.05 0.00 0.00 0.00 0.00 36.38 31.77 2nr2 s VAL 5 CO -0.08 -1.39 0.29 -0.54 0.00 0.00 0.00 175.10 173.39 2nr2 s LYS 6 N 6.37 3.99 0.80 2.72 1.02 -0.91 -1.43 119.74 132.30 2nr2 s LYS 6 Ca 0.51 0.14 -0.10 0.00 0.02 0.00 0.00 55.97 56.54 2nr2 s LYS 6 Cb -0.10 -3.32 0.18 0.00 -0.52 0.00 0.00 37.83 34.06 2nr2 s LYS 6 CO 0.18 0.48 1.09 0.25 -0.92 0.00 0.00 175.35 176.42 2nr2 n THR 7 N 2.76 0.00 0.12 2.17 -2.24 -0.71 -0.76 114.28 115.63 2nr2 n THR 7 Ca -0.14 -1.08 0.00 0.00 -2.27 0.00 0.00 64.05 60.56 2nr2 n THR 7 Cb 0.53 -1.34 0.02 0.00 -2.10 0.00 0.00 70.33 67.44 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 0.00 -0.12 3.22 5.85 -1.90 -3.35 115.31 119.00 2nr2 h LEU 8 Ca -0.35 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.14 2nr2 h LEU 8 Cb 1.08 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 2nr2 h LEU 8 CO 0.29 0.63 -1.00 0.71 -0.34 0.00 0.00 178.44 178.73 2nr2 h THR 9 N 0.00 1.48 0.00 1.05 1.35 -1.96 -3.47 112.91 111.37 2nr2 h THR 9 Ca -0.01 -2.74 0.00 0.00 -0.55 0.00 0.00 66.41 63.11 2nr2 h THR 9 Cb 1.43 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 70.46 2nr2 h THR 9 CO 0.08 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 2nr2 n GLY 10 N 1.10 -0.48 3.67 5.82 0.00 -1.26 -5.11 105.19 108.93 2nr2 n GLY 10 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 4.30 -0.38 1.61 2.20 -1.26 -4.86 119.74 121.35 2nr2 s LYS 11 Ca 0.00 1.18 -0.15 0.00 -0.36 0.00 0.00 55.97 56.64 2nr2 s LYS 11 Cb 0.00 -3.59 0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2nr2 s LYS 11 CO 0.00 -0.42 0.31 0.99 -0.36 0.00 0.00 175.35 175.87 2nr2 s THR 12 N 2.45 5.24 -0.30 3.43 2.01 -1.26 -1.74 115.64 125.47 2nr2 s THR 12 Ca 0.42 -0.41 -0.17 0.00 0.31 0.00 0.00 61.69 61.84 2nr2 s THR 12 Cb -0.16 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 2nr2 s THR 12 CO 0.11 -0.21 0.45 0.27 -0.69 0.00 0.00 174.62 174.55 2nr2 s ILE 13 N 1.79 5.10 -0.61 1.82 -4.36 -0.52 -4.93 121.20 119.49 2nr2 s ILE 13 Ca 0.07 0.48 -0.16 0.00 -0.26 0.00 0.00 60.65 60.78 2nr2 s ILE 13 Cb -0.18 -3.83 0.14 0.00 1.25 0.00 0.00 42.46 39.84 2nr2 s ILE 13 CO 0.11 -0.02 0.59 -0.89 0.24 0.00 0.00 174.94 174.97 2nr2 s THR 14 N 2.22 5.22 -0.05 8.37 2.01 -1.26 -1.43 115.64 130.72 2nr2 s THR 14 Ca 0.17 -1.60 -0.30 0.00 0.31 0.00 0.00 61.69 60.27 2nr2 s THR 14 Cb -0.16 -4.39 -0.03 0.00 0.01 0.00 0.00 72.50 67.93 2nr2 s THR 14 CO 0.11 -0.95 1.15 -0.76 -0.69 0.00 0.00 174.62 173.48 2nr2 s LEU 15 N 1.52 4.29 -0.62 4.42 1.43 -0.55 -4.85 118.68 124.31 2nr2 s LEU 15 Ca 0.07 1.77 -0.27 0.00 -1.03 0.00 0.00 54.13 54.67 2nr2 s LEU 15 Cb -0.25 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.44 2nr2 s LEU 15 CO 0.01 -0.52 1.17 -0.70 0.23 0.00 0.00 176.35 176.54 2nr2 s GLU 16 N 1.97 3.38 0.44 1.70 2.56 -1.26 -2.01 118.70 125.48 2nr2 s GLU 16 Ca 0.54 -0.01 0.07 0.00 0.00 0.00 0.00 54.97 55.57 2nr2 s GLU 16 Cb -0.24 -4.08 -0.02 0.00 2.00 0.00 0.00 34.13 31.79 2nr2 s GLU 16 CO 0.22 -1.79 0.30 0.14 -0.56 0.00 0.00 175.26 173.56 2nr2 s VAL 17 N 5.00 2.31 0.37 3.70 -7.23 -0.38 -4.86 120.40 119.31 2nr2 s VAL 17 Ca 0.38 -1.52 0.06 0.00 -1.81 0.00 0.00 61.98 59.08 2nr2 s VAL 17 Cb -0.09 -2.84 -0.07 0.00 0.56 0.00 0.00 36.38 33.94 2nr2 s VAL 17 CO 0.21 0.00 0.02 -1.61 -0.31 0.00 0.00 175.10 173.41 2nr2 s GLU 18 N -4.06 1.82 0.28 4.82 0.41 -1.26 0.51 118.70 121.22 2nr2 s GLU 18 Ca 0.42 -2.02 0.25 0.00 -0.41 0.00 0.00 54.97 53.22 2nr2 s GLU 18 Cb 0.00 -1.33 0.75 0.00 -1.78 0.00 0.00 34.13 31.77 2nr2 s GLU 18 CO 0.24 -0.10 1.74 -1.35 -0.49 0.00 0.00 175.26 175.31 2nr2 h PRO 19 N 1.92 0.00 0.00 0.39 0.11 -1.97 -2.78 132.00 129.68 2nr2 h PRO 19 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2nr2 h PRO 19 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2nr2 h PRO 19 CO 0.76 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.21 2nr2 h SER 20 N 0.00 0.00 -3.92 -2.05 4.64 -1.97 -2.74 113.55 107.51 2nr2 h SER 20 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 2nr2 h SER 20 Cb 0.75 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.88 2nr2 h SER 20 CO 0.00 0.00 0.48 -1.81 -0.87 0.00 0.00 176.83 174.63 2nr2 s ASP 21 N -5.26 6.72 0.63 4.97 1.11 -1.05 -4.81 116.67 118.97 2nr2 s ASP 21 Ca -0.01 2.27 -0.05 0.00 0.18 0.00 0.00 52.55 54.94 2nr2 s ASP 21 Cb 0.10 -2.61 0.03 0.00 1.07 0.00 0.00 42.92 41.51 2nr2 s ASP 21 CO 0.46 -0.53 0.93 0.42 1.18 0.00 0.00 175.17 177.63 2nr2 s THR 22 N -1.41 3.00 0.27 -1.27 -4.23 -1.26 -2.06 115.64 108.68 2nr2 s THR 22 Ca 0.55 -0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 60.84 2nr2 s THR 22 Cb -0.29 -3.22 0.14 0.00 1.34 0.00 0.00 72.50 70.47 2nr2 s THR 22 CO 0.37 -0.22 1.81 0.40 -0.54 0.00 0.00 174.62 176.43 2nr2 h ILE 23 N -0.30 1.23 -0.86 2.99 1.08 -1.04 -0.95 117.51 119.66 2nr2 h ILE 23 Ca -0.45 -0.86 0.13 0.00 -0.39 0.00 0.00 64.86 63.30 2nr2 h ILE 23 Cb 1.28 0.71 -0.09 0.00 -3.07 0.00 0.00 36.82 35.65 2nr2 h ILE 23 CO 0.60 0.32 0.47 -0.08 -0.69 0.00 0.00 178.15 178.76 2nr2 h GLU 24 N 0.80 0.68 -0.06 2.37 4.81 -1.72 -1.15 114.58 120.32 2nr2 h GLU 24 Ca 0.17 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.20 2nr2 h GLU 24 Cb 0.33 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2nr2 h GLU 24 CO 0.00 0.45 -0.66 -0.97 -0.73 0.00 0.00 179.01 177.11 2nr2 h ASN 25 N 0.70 0.28 0.03 1.04 -0.73 -1.68 0.16 115.58 115.38 2nr2 h ASN 25 Ca 0.46 -0.17 -0.00 0.00 1.87 0.00 0.00 56.30 58.45 2nr2 h ASN 25 Cb 0.59 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.09 2nr2 h ASN 25 CO -0.33 0.86 -0.02 0.58 -0.37 0.00 0.00 177.43 178.15 2nr2 h VAL 26 N 0.17 1.06 0.00 2.57 2.07 -1.06 -0.46 116.25 120.61 2nr2 h VAL 26 Ca -0.01 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2nr2 h VAL 26 Cb 1.18 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2nr2 h VAL 26 CO 0.10 0.08 0.00 0.11 0.02 0.00 0.00 177.57 177.88 2nr2 h LYS 27 N -0.17 0.00 0.14 1.57 1.57 -0.97 0.08 116.57 118.78 2nr2 h LYS 27 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 2nr2 h LYS 27 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2nr2 h LYS 27 CO 0.01 0.00 -1.33 0.00 -0.57 0.00 0.00 179.45 177.56 2nr2 h ALA 28 N 2.05 0.11 0.21 3.86 0.00 -0.44 -2.99 119.26 122.05 2nr2 h ALA 28 Ca 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 54.91 53.96 2nr2 h ALA 28 Cb 0.32 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2nr2 h ALA 28 CO 0.00 0.99 -0.10 0.87 0.00 0.00 0.00 179.25 181.01 2nr2 h LYS 29 N 0.08 -0.27 -0.71 0.00 1.57 0.19 0.94 116.57 118.37 2nr2 h LYS 29 Ca -0.17 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.80 2nr2 h LYS 29 Cb 2.00 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 34.33 2nr2 h LYS 29 CO 0.20 -0.05 0.49 0.82 -0.57 0.00 0.00 179.45 180.34 2nr2 h ILE 30 N -0.45 0.74 -0.30 1.86 2.04 -1.16 0.10 117.51 120.34 2nr2 h ILE 30 Ca -0.03 -0.08 -0.18 0.00 1.00 0.00 0.00 64.86 65.57 2nr2 h ILE 30 Cb 0.34 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2nr2 h ILE 30 CO 0.05 0.04 -0.53 -0.61 0.00 0.00 0.00 178.15 177.11 2nr2 h GLN 31 N 0.24 0.89 0.41 2.37 4.15 -1.30 0.13 115.11 122.01 2nr2 h GLN 31 Ca 0.35 -0.55 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 2nr2 h GLN 31 Cb 1.01 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2nr2 h GLN 31 CO -0.08 1.19 -0.36 0.22 -1.93 0.00 0.00 178.83 177.88 2nr2 h ASP 32 N 0.69 -0.96 0.29 -0.69 3.58 -0.28 -1.67 116.42 117.38 2nr2 h ASP 32 Ca 0.02 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 2nr2 h ASP 32 Cb 1.14 0.31 0.00 0.00 1.72 0.00 0.00 39.33 42.50 2nr2 h ASP 32 CO 0.12 -0.52 -0.14 0.11 -2.88 0.00 0.00 179.24 175.93 2nr2 h LYS 33 N -0.78 -0.38 0.00 0.28 1.57 -0.75 -3.37 116.57 113.15 2nr2 h LYS 33 Ca -0.04 0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 2nr2 h LYS 33 Cb 0.68 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.05 2nr2 h LYS 33 CO -0.03 -0.05 -1.86 0.39 -0.57 0.00 0.00 179.45 177.33 2nr2 n GLU 34 N -5.05 0.65 -2.07 3.15 -0.58 0.42 -5.01 120.64 112.15 2nr2 n GLU 34 Ca -0.08 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 2nr2 n GLU 34 Cb 0.25 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.49 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 1.44 0.87 3.54 0.62 0.00 -0.63 -4.99 105.19 106.04 2nr2 n GLY 35 Ca -0.14 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.66 3.94 0.39 -0.61 1.01 -1.26 -5.01 121.20 117.01 2nr2 s ILE 36 Ca 0.00 -0.35 -0.26 0.00 0.00 0.00 0.00 60.65 60.03 2nr2 s ILE 36 Cb 0.00 -2.70 -0.09 0.00 0.01 0.00 0.00 42.46 39.68 2nr2 s ILE 36 CO 0.00 0.52 1.23 -2.84 0.00 0.00 0.00 174.94 173.85 2nr2 s PRO 37 N 0.03 4.08 0.00 2.79 0.02 -1.26 -4.08 135.00 136.58 2nr2 s PRO 37 Ca 0.01 2.00 0.21 0.00 0.02 0.00 0.00 61.00 63.23 2nr2 s PRO 37 Cb -0.13 -2.78 0.94 0.00 0.02 0.00 0.00 34.50 32.55 2nr2 s PRO 37 CO 0.03 -0.34 1.68 -0.35 -0.33 0.00 0.00 177.00 177.68 2nr2 n PRO 38 N 0.23 0.06 0.15 5.54 -0.04 -1.26 -1.84 135.00 137.84 2nr2 n PRO 38 Ca 0.03 0.13 0.05 0.00 -0.04 0.00 0.00 63.50 63.67 2nr2 n PRO 38 Cb 0.45 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.46 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2nr2 h ASP 39 N 0.00 0.00 0.16 3.54 2.03 -1.98 -3.36 116.42 116.81 2nr2 h ASP 39 Ca 0.00 0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.97 2nr2 h ASP 39 Cb 0.33 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.83 2nr2 h ASP 39 CO 0.00 0.34 -1.69 -0.61 -1.03 0.00 0.00 179.24 176.25 2nr2 h GLN 40 N 0.00 0.34 -6.68 4.15 4.15 -1.78 -3.46 115.11 111.83 2nr2 h GLN 40 Ca -0.02 -0.58 -0.52 0.00 0.77 0.00 0.00 58.65 58.30 2nr2 h GLN 40 Cb 1.28 0.22 0.03 0.00 0.21 0.00 0.00 27.48 29.21 2nr2 h GLN 40 CO 0.04 1.28 0.64 -0.65 -1.93 0.00 0.00 178.83 178.21 2nr2 s GLN 41 N -2.55 4.40 -0.09 1.69 -0.21 -0.76 -1.67 119.66 120.48 2nr2 s GLN 41 Ca -0.18 2.03 -0.01 0.00 0.02 0.00 0.00 55.36 57.22 2nr2 s GLN 41 Cb 0.05 -3.20 0.03 0.00 1.00 0.00 0.00 33.01 30.89 2nr2 s GLN 41 CO 0.82 -0.23 -0.03 0.50 -2.12 0.00 0.00 175.29 174.23 2nr2 s ARG 42 N -0.15 0.98 -0.31 2.91 3.52 -0.42 -4.92 118.95 120.55 2nr2 s ARG 42 Ca 0.56 -0.04 -0.12 0.00 -0.13 0.00 0.00 55.73 56.00 2nr2 s ARG 42 Cb -0.36 -1.22 -0.03 0.00 -1.56 0.00 0.00 34.95 31.78 2nr2 s ARG 42 CO 0.38 -0.29 0.22 -0.51 -0.81 0.00 0.00 175.30 174.29 2nr2 s LEU 43 N 1.85 4.30 -0.15 -0.88 1.43 -1.26 -1.48 118.68 122.48 2nr2 s LEU 43 Ca 0.05 -0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 52.88 2nr2 s LEU 43 Cb -0.12 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 2nr2 s LEU 43 CO -0.06 -0.15 -0.06 -0.63 0.23 0.00 0.00 176.35 175.68 2nr2 s ILE 44 N 1.74 3.68 -0.04 -0.59 1.01 -0.40 -2.01 121.20 124.58 2nr2 s ILE 44 Ca 0.06 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 2nr2 s ILE 44 Cb -0.17 -2.60 0.02 0.00 0.01 0.00 0.00 42.46 39.72 2nr2 s ILE 44 CO 0.11 0.49 0.11 0.12 0.00 0.00 0.00 174.94 175.77 2nr2 s PHE 45 N 0.44 -0.12 -1.56 3.97 5.36 -0.55 -0.61 117.98 124.92 2nr2 s PHE 45 Ca -0.05 0.31 -0.04 0.00 -0.96 0.00 0.00 56.93 56.19 2nr2 s PHE 45 Cb -0.15 0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.54 2nr2 s PHE 45 CO 0.03 -0.08 0.39 0.00 -1.46 0.00 0.00 175.22 174.10 2nr2 n ALA 46 N 3.32 -0.87 -0.98 11.12 0.00 -1.26 -0.85 120.51 130.97 2nr2 n ALA 46 Ca -0.16 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2nr2 n ALA 46 Cb 0.57 -3.15 0.00 0.00 0.00 0.00 0.00 19.45 16.87 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 -1.30 0.34 3.26 0.00 0.00 -1.26 -5.01 105.19 101.22 2nr2 n GLY 47 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.71 2.15 -0.29 1.61 2.20 -0.03 -5.10 119.74 119.57 2nr2 s LYS 48 Ca 0.00 -0.86 -0.21 0.00 -0.36 0.00 0.00 55.97 54.55 2nr2 s LYS 48 Cb 0.00 -1.96 -0.01 0.00 -1.51 0.00 0.00 37.83 34.35 2nr2 s LYS 48 CO 0.00 0.45 0.66 -0.65 -0.36 0.00 0.00 175.35 175.45 2nr2 s GLN 49 N -0.37 3.98 0.34 4.03 -0.21 -1.26 -1.48 119.66 124.69 2nr2 s GLN 49 Ca 0.04 0.44 -0.11 0.00 0.02 0.00 0.00 55.36 55.74 2nr2 s GLN 49 Cb -0.11 -3.70 -0.07 0.00 1.00 0.00 0.00 33.01 30.13 2nr2 s GLN 49 CO 0.01 -0.54 0.71 -0.51 -2.12 0.00 0.00 175.29 172.84 2nr2 s LEU 50 N 2.64 3.97 0.36 2.90 1.43 -0.85 -5.02 118.68 124.10 2nr2 s LEU 50 Ca 0.27 1.11 0.04 0.00 -1.03 0.00 0.00 54.13 54.52 2nr2 s LEU 50 Cb -0.15 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.11 2nr2 s LEU 50 CO 0.11 -0.28 0.53 -1.61 0.23 0.00 0.00 176.35 175.33 2nr2 s GLU 51 N -3.41 3.17 -0.00 1.70 0.41 -1.26 -4.85 118.70 114.46 2nr2 s GLU 51 Ca 0.51 -0.76 -0.01 0.00 -0.41 0.00 0.00 54.97 54.30 2nr2 s GLU 51 Cb -0.10 -2.73 -0.01 0.00 -1.78 0.00 0.00 34.13 29.50 2nr2 s GLU 51 CO 0.25 0.01 0.38 -0.44 -0.49 0.00 0.00 175.26 174.97 2nr2 h ASP 52 N 0.76 -0.04 0.00 -0.19 3.32 -1.98 -3.36 116.42 114.93 2nr2 h ASP 52 Ca -0.47 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.12 2nr2 h ASP 52 Cb 1.25 0.01 0.02 0.00 0.22 0.00 0.00 39.33 40.83 2nr2 h ASP 52 CO 0.56 0.00 2.95 0.61 -1.72 0.00 0.00 179.24 181.64 2nr2 n GLY 53 N 0.90 3.46 3.04 2.75 0.00 -1.26 -2.26 105.19 111.81 2nr2 n GLY 53 Ca -0.01 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.86 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 2.98 0.37 0.69 1.61 1.81 -1.26 -5.04 118.95 120.10 2nr2 s ARG 54 Ca 0.49 -0.39 -0.06 0.00 -1.72 0.00 0.00 55.73 54.05 2nr2 s ARG 54 Cb 0.13 0.15 0.06 0.00 -0.45 0.00 0.00 34.95 34.84 2nr2 s ARG 54 CO -0.04 -0.08 0.99 0.95 -0.68 0.00 0.00 175.30 176.44 2nr2 s THR 55 N -1.20 2.31 0.20 0.02 -4.23 -1.26 -1.23 115.64 110.26 2nr2 s THR 55 Ca -0.13 -0.32 -0.07 0.00 -1.18 0.00 0.00 61.69 59.99 2nr2 s THR 55 Cb -0.07 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.86 2nr2 s THR 55 CO 0.00 0.00 1.68 -0.07 -0.54 0.00 0.00 174.62 175.69 2nr2 h LEU 56 N -0.53 0.98 -0.94 4.79 3.38 -1.34 -3.17 115.31 118.47 2nr2 h LEU 56 Ca -0.44 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.20 2nr2 h LEU 56 Cb 1.31 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2nr2 h LEU 56 CO 0.59 1.03 0.03 -1.28 0.09 0.00 0.00 178.44 178.89 2nr2 h SER 57 N 0.92 0.76 -0.91 -0.43 0.87 -1.74 -1.51 113.55 111.51 2nr2 h SER 57 Ca 0.17 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2nr2 h SER 57 Cb 0.53 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.24 2nr2 h SER 57 CO 0.03 0.81 0.58 0.44 -0.53 0.00 0.00 176.83 178.16 2nr2 h ASP 58 N 0.75 1.08 0.86 6.23 3.32 -1.86 -0.74 116.42 126.06 2nr2 h ASP 58 Ca 0.15 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2nr2 h ASP 58 Cb 0.42 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2nr2 h ASP 58 CO 0.01 0.81 0.00 -1.22 -1.72 0.00 0.00 179.24 177.12 2nr2 n TYR 59 N -4.41 0.00 -3.24 4.55 4.01 -1.20 -4.95 117.16 111.92 2nr2 n TYR 59 Ca 0.10 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.69 2nr2 n TYR 59 Cb 0.04 -0.50 0.07 0.00 -0.31 0.00 0.00 39.34 38.65 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 -1.50 -2.63 -4.36 7.72 5.15 -0.28 -4.96 115.26 114.41 2nr2 n ASN 60 Ca 0.06 -0.51 -0.45 0.00 -0.60 0.00 0.00 54.58 53.08 2nr2 n ASN 60 Cb 0.29 -4.38 -0.05 0.00 -0.53 0.00 0.00 39.78 35.11 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 -3.30 4.95 0.35 -1.44 1.01 -0.61 -5.03 121.20 117.13 2nr2 s ILE 61 Ca 0.08 -1.14 -0.01 0.00 0.00 0.00 0.00 60.65 59.58 2nr2 s ILE 61 Cb -0.04 -4.43 0.07 0.00 0.01 0.00 0.00 42.46 38.07 2nr2 s ILE 61 CO 0.61 -1.03 0.48 0.00 0.00 0.00 0.00 174.94 175.00 2nr2 n GLN 62 N 5.97 0.17 -1.68 2.79 10.64 -1.26 -4.59 117.38 129.41 2nr2 n GLN 62 Ca -0.11 -1.20 -0.36 0.00 -1.83 0.00 0.00 57.00 53.50 2nr2 n GLN 62 Cb 0.42 -0.35 0.07 0.00 -0.86 0.00 0.00 30.24 29.52 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 -3.72 2.49 -1.35 2.61 -2.85 -1.26 -3.25 119.74 112.40 2nr2 s LYS 63 Ca 0.31 1.88 0.00 0.00 -1.00 0.00 0.00 55.97 57.16 2nr2 s LYS 63 Cb -0.02 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.89 2nr2 s LYS 63 CO 0.21 -1.60 0.00 0.39 0.10 0.00 0.00 175.35 174.45 2nr2 n GLU 64 N -2.15 -0.95 -3.04 1.78 1.02 0.75 -4.98 120.64 113.07 2nr2 n GLU 64 Ca 0.14 0.91 -0.39 0.00 -0.02 0.00 0.00 57.16 57.79 2nr2 n GLU 64 Cb 0.49 -5.00 -0.05 0.00 -0.02 0.00 0.00 31.44 26.86 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 -2.77 7.21 -0.42 1.62 0.01 -1.20 -4.77 113.70 113.38 2nr2 s SER 65 Ca 0.00 1.44 -0.21 0.00 1.31 0.00 0.00 55.95 58.49 2nr2 s SER 65 Cb 0.00 -2.45 0.02 0.00 0.21 0.00 0.00 66.02 63.80 2nr2 s SER 65 CO 0.00 0.11 0.68 -0.89 0.41 0.00 0.00 173.24 173.55 2nr2 s THR 66 N -0.49 4.80 0.04 1.44 2.01 -1.26 -1.31 115.64 120.87 2nr2 s THR 66 Ca 0.36 0.30 -0.20 0.00 0.31 0.00 0.00 61.69 62.46 2nr2 s THR 66 Cb -0.21 -4.21 -0.06 0.00 0.01 0.00 0.00 72.50 68.04 2nr2 s THR 66 CO 0.23 -0.56 0.59 -0.76 -0.69 0.00 0.00 174.62 173.42 2nr2 s LEU 67 N 2.91 4.48 -0.32 4.42 1.43 -1.08 -4.90 118.68 125.62 2nr2 s LEU 67 Ca 0.25 1.23 -0.17 0.00 -1.03 0.00 0.00 54.13 54.40 2nr2 s LEU 67 Cb -0.14 -2.92 -0.01 0.00 0.03 0.00 0.00 46.19 43.15 2nr2 s LEU 67 CO 0.19 0.19 0.48 -1.00 0.23 0.00 0.00 176.35 176.44 2nr2 s HIS 68 N -0.69 3.21 -0.43 0.29 3.76 0.22 -2.13 115.29 119.52 2nr2 s HIS 68 Ca 0.30 0.28 -0.15 0.00 -0.15 0.00 0.00 55.06 55.34 2nr2 s HIS 68 Cb -0.19 -2.81 0.03 0.00 1.11 0.00 0.00 32.58 30.72 2nr2 s HIS 68 CO 0.18 -0.44 0.34 -1.17 -0.85 0.00 0.00 174.74 172.81 2nr2 s LEU 69 N 2.30 5.22 -0.16 0.89 2.96 0.06 -1.27 118.68 128.68 2nr2 s LEU 69 Ca 0.18 -0.99 -0.11 0.00 -0.22 0.00 0.00 54.13 52.99 2nr2 s LEU 69 Cb -0.16 -2.19 -0.05 0.00 0.50 0.00 0.00 46.19 44.30 2nr2 s LEU 69 CO 0.12 -0.52 0.19 -0.69 -1.32 0.00 0.00 176.35 174.13 2nr2 s VAL 70 N 1.72 5.38 -0.34 1.68 1.01 -0.55 -3.68 120.40 125.62 2nr2 s VAL 70 Ca 0.06 0.33 -0.03 0.00 0.00 0.00 0.00 61.98 62.34 2nr2 s VAL 70 Cb -0.20 -3.52 0.07 0.00 0.00 0.00 0.00 36.38 32.73 2nr2 s VAL 70 CO 0.09 0.47 0.09 -0.76 0.00 0.00 0.00 175.10 175.00 2nr2 s LEU 71 N 0.01 4.43 0.88 3.92 1.43 -1.26 -1.30 118.68 126.79 2nr2 s LEU 71 Ca 0.13 -1.48 -0.10 0.00 -1.03 0.00 0.00 54.13 51.65 2nr2 s LEU 71 Cb -0.12 -1.79 0.12 0.00 0.03 0.00 0.00 46.19 44.43 2nr2 s LEU 71 CO 0.02 -0.37 1.12 -0.13 0.23 0.00 0.00 176.35 177.22 2nr2 s ARG 72 N 1.26 1.32 0.47 1.70 0.52 -0.67 -5.04 118.95 118.52 2nr2 s ARG 72 Ca -0.00 1.36 0.06 0.00 -0.52 0.00 0.00 55.73 56.63 2nr2 s ARG 72 Cb -0.21 -1.78 -0.01 0.00 0.52 0.00 0.00 34.95 33.48 2nr2 s ARG 72 CO -0.01 -2.36 0.24 -0.51 0.02 0.00 0.00 175.30 172.68 2nr2 s LEU 73 N -6.41 2.85 0.16 2.53 1.43 -1.26 -4.96 118.68 113.03 2nr2 s LEU 73 Ca 0.65 -1.21 0.03 0.00 -1.03 0.00 0.00 54.13 52.56 2nr2 s LEU 73 Cb -0.21 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 2nr2 s LEU 73 CO 0.58 -0.80 0.29 -0.13 0.23 0.00 0.00 176.35 176.52 2nr2 s ARG 74 N -4.04 3.44 0.00 1.70 0.52 -1.26 -4.73 118.95 114.57 2nr2 s ARG 74 Ca 0.33 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.93 2nr2 s ARG 74 Cb 0.01 -2.96 0.00 0.00 0.52 0.00 0.00 34.95 32.52 2nr2 s ARG 74 CO 0.19 0.51 0.00 0.41 0.02 0.00 0.00 175.30 176.43 2nr2 n GLY 75 N -0.63 1.58 0.00 -3.53 0.00 -1.26 -5.34 105.19 96.01 2nr2 n GLY 75 Ca -0.07 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93