#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 4.38 0.13 2.12 0.74 -1.26 -0.94 119.66 124.83 2nr2 s GLN 2 Ca 0.00 0.80 -0.00 0.00 0.05 0.00 0.00 55.36 56.21 2nr2 s GLN 2 Cb 0.00 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 2nr2 s GLN 2 CO 0.00 0.25 0.04 0.96 -0.55 0.00 0.00 175.29 175.98 2nr2 s ILE 3 N 0.18 0.23 0.05 -2.34 -4.36 -0.48 0.59 121.20 115.08 2nr2 s ILE 3 Ca 0.34 -1.91 0.06 0.00 -0.26 0.00 0.00 60.65 58.87 2nr2 s ILE 3 Cb -0.18 -2.00 -0.04 0.00 1.25 0.00 0.00 42.46 41.50 2nr2 s ILE 3 CO 0.18 -0.53 -0.11 -0.36 0.24 0.00 0.00 174.94 174.36 2nr2 s PHE 4 N -3.96 2.73 -0.27 1.37 0.08 -0.46 -0.13 117.98 117.35 2nr2 s PHE 4 Ca 0.22 -0.15 0.01 0.00 0.12 0.00 0.00 56.93 57.13 2nr2 s PHE 4 Cb 0.07 -1.50 0.08 0.00 -0.57 0.00 0.00 43.02 41.10 2nr2 s PHE 4 CO 0.01 0.36 0.01 0.08 -0.10 0.00 0.00 175.22 175.58 2nr2 s VAL 5 N -1.06 1.42 -0.22 -0.44 1.01 -0.11 -1.46 120.40 119.53 2nr2 s VAL 5 Ca 0.18 -1.42 -0.25 0.00 0.00 0.00 0.00 61.98 60.49 2nr2 s VAL 5 Cb -0.11 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 2nr2 s VAL 5 CO 0.09 -0.35 0.86 -0.75 0.00 0.00 0.00 175.10 174.96 2nr2 s LYS 6 N 1.40 4.23 0.00 2.72 2.20 -0.95 -1.83 119.74 127.50 2nr2 s LYS 6 Ca 0.02 1.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.65 2nr2 s LYS 6 Cb -0.18 -3.63 0.00 0.00 -1.51 0.00 0.00 37.83 32.51 2nr2 s LYS 6 CO -0.12 -0.49 0.00 0.25 -0.36 0.00 0.00 175.35 174.64 2nr2 n THR 7 N 5.13 0.00 0.16 3.43 -2.24 -1.26 -2.05 114.28 117.45 2nr2 n THR 7 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2nr2 n THR 7 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 2nr2 n THR 7 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2nr2 n LEU 8 N 0.00 -2.90 -4.36 3.22 7.94 -1.26 -4.80 117.00 114.84 2nr2 n LEU 8 Ca 0.00 0.62 -0.46 0.00 -1.11 0.00 0.00 56.01 55.06 2nr2 n LEU 8 Cb 0.00 2.85 -0.03 0.00 0.53 0.00 0.00 43.42 46.77 2nr2 n LEU 8 CO 0.00 0.05 0.46 0.42 -1.11 0.00 0.00 177.39 177.21 2nr2 s THR 9 N -1.65 5.23 -1.65 1.96 -4.23 -1.26 -4.86 115.64 109.19 2nr2 s THR 9 Ca 0.00 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 2nr2 s THR 9 Cb 0.00 -4.50 0.00 0.00 1.34 0.00 0.00 72.50 69.34 2nr2 s THR 9 CO 0.00 -1.10 0.00 0.61 -0.54 0.00 0.00 174.62 173.59 2nr2 n GLY 10 N 4.73 0.41 3.95 3.99 0.00 -1.26 -5.10 105.19 111.91 2nr2 n GLY 10 Ca 0.06 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.08 2nr2 n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 11 N -0.95 2.61 -0.31 1.61 -2.85 -1.26 -4.95 119.74 113.65 2nr2 s LYS 11 Ca 0.00 -0.53 -0.10 0.00 -1.00 0.00 0.00 55.97 54.33 2nr2 s LYS 11 Cb 0.00 -2.41 -0.02 0.00 -2.06 0.00 0.00 37.83 33.34 2nr2 s LYS 11 CO 0.00 -0.73 0.17 0.99 0.10 0.00 0.00 175.35 175.88 2nr2 s THR 12 N -2.85 4.88 0.39 3.79 2.01 -1.26 -4.44 115.64 118.16 2nr2 s THR 12 Ca 0.56 -0.23 -0.15 0.00 0.31 0.00 0.00 61.69 62.19 2nr2 s THR 12 Cb -0.10 -3.44 -0.08 0.00 0.01 0.00 0.00 72.50 68.89 2nr2 s THR 12 CO 0.40 0.11 0.81 0.27 -0.69 0.00 0.00 174.62 175.53 2nr2 s ILE 13 N 1.67 4.65 -0.13 1.82 -4.36 -0.76 -4.92 121.20 119.18 2nr2 s ILE 13 Ca 0.06 0.95 0.01 0.00 -0.26 0.00 0.00 60.65 61.41 2nr2 s ILE 13 Cb -0.17 -3.66 -0.01 0.00 1.25 0.00 0.00 42.46 39.87 2nr2 s ILE 13 CO 0.08 -0.38 -0.17 -0.89 0.24 0.00 0.00 174.94 173.81 2nr2 s THR 14 N -2.23 2.60 0.22 8.37 2.01 -1.26 -0.94 115.64 124.41 2nr2 s THR 14 Ca 0.55 -0.82 0.10 0.00 0.31 0.00 0.00 61.69 61.84 2nr2 s THR 14 Cb -0.10 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 2nr2 s THR 14 CO 0.23 0.53 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.74 2nr2 s LEU 15 N 0.48 2.51 -0.23 4.42 1.43 0.82 -4.99 118.68 123.11 2nr2 s LEU 15 Ca -0.12 -0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 51.97 2nr2 s LEU 15 Cb -0.16 -1.00 -0.02 0.00 0.03 0.00 0.00 46.19 45.04 2nr2 s LEU 15 CO 0.05 0.01 0.04 -0.70 0.23 0.00 0.00 176.35 175.98 2nr2 s GLU 16 N -3.15 3.60 0.33 1.70 2.56 -1.26 -1.38 118.70 121.09 2nr2 s GLU 16 Ca 0.23 -0.51 0.03 0.00 0.00 0.00 0.00 54.97 54.72 2nr2 s GLU 16 Cb -0.05 -3.22 -0.05 0.00 2.00 0.00 0.00 34.13 32.81 2nr2 s GLU 16 CO 0.11 -0.15 0.10 0.14 -0.56 0.00 0.00 175.26 174.89 2nr2 s VAL 17 N 1.47 0.78 0.15 3.70 -7.23 -0.11 -4.93 120.40 114.24 2nr2 s VAL 17 Ca 0.05 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.30 2nr2 s VAL 17 Cb -0.15 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.14 2nr2 s VAL 17 CO 0.02 0.00 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.12 2nr2 s GLU 18 N -3.87 2.17 0.50 4.82 2.02 -1.26 0.23 118.70 123.31 2nr2 s GLU 18 Ca 0.33 -1.13 0.29 0.00 0.02 0.00 0.00 54.97 54.48 2nr2 s GLU 18 Cb 0.06 -2.27 1.22 0.00 0.10 0.00 0.00 34.13 33.25 2nr2 s GLU 18 CO 0.15 0.47 1.94 -1.00 0.02 0.00 0.00 175.26 176.84 2nr2 h PRO 19 N 3.13 0.00 0.00 0.39 0.13 -1.94 -2.12 132.00 131.60 2nr2 h PRO 19 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2nr2 h PRO 19 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2nr2 h PRO 19 CO 0.54 0.11 0.00 0.43 -0.23 0.00 0.00 178.00 178.86 2nr2 n SER 20 N -3.29 0.43 -4.75 1.44 7.64 -1.26 -1.14 113.62 112.69 2nr2 n SER 20 Ca -0.00 0.59 -0.41 0.00 1.01 0.00 0.00 58.87 60.06 2nr2 n SER 20 Cb 0.34 -0.69 -0.02 0.00 -1.01 0.00 0.00 64.21 62.83 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 -3.81 6.70 0.79 6.43 1.01 -0.80 -4.83 116.67 122.16 2nr2 s ASP 21 Ca 0.07 2.64 -0.11 0.00 0.71 0.00 0.00 52.55 55.86 2nr2 s ASP 21 Cb 0.11 -2.62 0.07 0.00 1.01 0.00 0.00 42.92 41.48 2nr2 s ASP 21 CO 0.40 -0.66 1.09 0.42 0.21 0.00 0.00 175.17 176.63 2nr2 s THR 22 N -0.13 3.21 0.14 -1.27 -4.23 -1.26 -2.65 115.64 109.46 2nr2 s THR 22 Ca 0.58 0.39 -0.13 0.00 -1.18 0.00 0.00 61.69 61.35 2nr2 s THR 22 Cb -0.41 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.55 2nr2 s THR 22 CO 0.44 -0.51 1.58 0.40 -0.54 0.00 0.00 174.62 175.98 2nr2 h ILE 23 N -1.20 1.27 -0.71 2.99 1.08 -0.85 0.13 117.51 120.21 2nr2 h ILE 23 Ca -0.45 -1.11 0.15 0.00 -0.39 0.00 0.00 64.86 63.07 2nr2 h ILE 23 Cb 1.24 1.06 -0.13 0.00 -3.07 0.00 0.00 36.82 35.92 2nr2 h ILE 23 CO 0.52 0.38 -0.15 -0.08 -0.69 0.00 0.00 178.15 178.13 2nr2 h GLU 24 N 0.67 0.01 -0.22 2.37 4.81 -0.66 0.82 114.58 122.39 2nr2 h GLU 24 Ca 0.13 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2nr2 h GLU 24 Cb 0.55 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2nr2 h GLU 24 CO 0.03 0.01 -0.10 -0.97 -0.73 0.00 0.00 179.01 177.25 2nr2 h ASN 25 N 0.02 0.46 -0.11 1.04 -0.73 -1.60 -1.89 115.58 112.77 2nr2 h ASN 25 Ca 0.35 -0.41 0.03 0.00 1.87 0.00 0.00 56.30 58.14 2nr2 h ASN 25 Cb 0.55 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 39.01 2nr2 h ASN 25 CO -0.72 0.77 0.08 0.58 -0.37 0.00 0.00 177.43 177.77 2nr2 h VAL 26 N 0.16 0.95 -0.27 2.57 2.07 -0.48 -1.65 116.25 119.61 2nr2 h VAL 26 Ca 0.05 -0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.45 2nr2 h VAL 26 Cb 0.59 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2nr2 h VAL 26 CO 0.03 0.00 -0.32 0.11 0.02 0.00 0.00 177.57 177.42 2nr2 h LYS 27 N 0.01 0.56 -0.42 1.57 1.57 -0.64 -2.10 116.57 117.12 2nr2 h LYS 27 Ca 0.05 -0.24 0.04 0.00 -1.87 0.00 0.00 60.65 58.63 2nr2 h LYS 27 Cb 0.19 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 2nr2 h LYS 27 CO -0.00 0.81 0.19 0.00 -0.57 0.00 0.00 179.45 179.87 2nr2 h ALA 28 N 1.18 0.52 -0.61 3.86 0.00 -0.49 -1.87 119.26 121.86 2nr2 h ALA 28 Ca 0.06 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.12 2nr2 h ALA 28 Cb 0.79 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.43 2nr2 h ALA 28 CO 0.06 -0.18 -0.14 0.87 0.00 0.00 0.00 179.25 179.86 2nr2 h LYS 29 N 0.38 0.01 -0.03 0.00 1.57 -1.18 -0.45 116.57 116.87 2nr2 h LYS 29 Ca 0.19 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 2nr2 h LYS 29 Cb 0.13 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2nr2 h LYS 29 CO -0.15 0.01 -0.11 0.82 -0.57 0.00 0.00 179.45 179.44 2nr2 h ILE 30 N 0.01 1.10 -0.22 1.86 2.04 -0.97 -3.23 117.51 118.10 2nr2 h ILE 30 Ca 0.29 -0.46 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 2nr2 h ILE 30 Cb 0.45 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 2nr2 h ILE 30 CO -0.62 0.14 -0.34 -0.61 0.00 0.00 0.00 178.15 176.72 2nr2 h GLN 31 N 0.04 0.46 -0.77 2.37 4.15 -0.26 0.13 115.11 121.23 2nr2 h GLN 31 Ca 0.01 -0.21 -0.02 0.00 0.77 0.00 0.00 58.65 59.20 2nr2 h GLN 31 Cb 0.23 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 2nr2 h GLN 31 CO 0.02 0.75 0.41 0.22 -1.93 0.00 0.00 178.83 178.30 2nr2 h ASP 32 N 0.40 0.97 0.00 -0.69 3.58 -1.54 -2.86 116.42 116.28 2nr2 h ASP 32 Ca 0.05 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2nr2 h ASP 32 Cb 0.79 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.59 2nr2 h ASP 32 CO 0.06 0.80 -0.26 0.29 -2.88 0.00 0.00 179.24 177.26 2nr2 n LYS 33 N -4.43 0.20 0.10 0.28 4.76 -1.04 -4.63 118.16 113.41 2nr2 n LYS 33 Ca 0.07 0.32 0.12 0.00 -2.87 0.00 0.00 58.31 55.95 2nr2 n LYS 33 Cb 0.10 -1.12 0.09 0.00 -1.84 0.00 0.00 35.03 32.26 2nr2 n LYS 33 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2nr2 h GLU 34 N -0.44 0.00 -0.42 1.97 4.39 -1.14 -3.48 114.58 115.47 2nr2 h GLU 34 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2nr2 h GLU 34 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2nr2 h GLU 34 CO 0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 2nr2 n GLY 35 N 1.24 0.66 3.43 -3.84 0.00 -1.08 -5.04 105.19 100.57 2nr2 n GLY 35 Ca 0.02 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.42 4.05 0.49 -0.61 1.01 -1.26 -5.04 121.20 117.42 2nr2 s ILE 36 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 2nr2 s ILE 36 Cb 0.00 -2.86 -0.09 0.00 0.01 0.00 0.00 42.46 39.52 2nr2 s ILE 36 CO 0.00 0.39 0.81 -2.65 0.00 0.00 0.00 174.94 173.49 2nr2 n PRO 37 N 4.62 0.92 0.25 2.79 -0.02 -1.26 -4.13 135.00 138.18 2nr2 n PRO 37 Ca -0.17 0.34 0.13 0.00 -2.02 0.00 0.00 63.50 61.78 2nr2 n PRO 37 Cb 0.51 -1.90 0.63 0.00 -0.02 0.00 0.00 33.50 32.72 2nr2 n PRO 37 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2nr2 h PRO 38 N 0.88 0.00 0.00 0.52 0.13 -1.93 -1.65 132.00 129.96 2nr2 h PRO 38 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2nr2 h PRO 38 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2nr2 h PRO 38 CO 0.52 0.13 -0.41 0.38 -0.23 0.00 0.00 178.00 178.40 2nr2 h ASP 39 N 0.00 0.00 0.92 1.44 2.03 -1.97 -3.37 116.42 115.48 2nr2 h ASP 39 Ca -0.00 -0.03 -0.11 0.00 -0.73 0.00 0.00 57.03 56.15 2nr2 h ASP 39 Cb 0.54 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.02 2nr2 h ASP 39 CO 0.02 0.02 -1.14 -0.61 -1.03 0.00 0.00 179.24 176.49 2nr2 h GLN 40 N 0.00 0.00 -5.64 4.15 4.15 -1.65 -3.46 115.11 112.66 2nr2 h GLN 40 Ca 0.00 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.75 2nr2 h GLN 40 Cb 0.92 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.53 2nr2 h GLN 40 CO 0.00 0.24 -0.49 1.14 -1.93 0.00 0.00 178.83 177.79 2nr2 s GLN 41 N -3.04 3.46 -0.08 1.69 -2.07 -1.20 -2.58 119.66 115.83 2nr2 s GLN 41 Ca -0.01 -0.16 0.04 0.00 -1.82 0.00 0.00 55.36 53.41 2nr2 s GLN 41 Cb 0.09 -3.17 -0.01 0.00 -1.09 0.00 0.00 33.01 28.82 2nr2 s GLN 41 CO 0.79 0.74 -0.22 1.03 -1.32 0.00 0.00 175.29 176.31 2nr2 s ARG 42 N -0.91 2.85 -0.22 9.60 0.52 -0.14 -4.96 118.95 125.68 2nr2 s ARG 42 Ca 0.14 -0.84 -0.11 0.00 -0.52 0.00 0.00 55.73 54.41 2nr2 s ARG 42 Cb -0.12 -2.31 -0.05 0.00 0.52 0.00 0.00 34.95 32.99 2nr2 s ARG 42 CO 0.03 0.31 0.17 -0.51 0.02 0.00 0.00 175.30 175.33 2nr2 s LEU 43 N 0.03 4.16 -0.09 2.53 1.43 -1.26 -0.65 118.68 124.83 2nr2 s LEU 43 Ca -0.08 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.19 2nr2 s LEU 43 Cb -0.15 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 2nr2 s LEU 43 CO 0.05 0.10 -0.02 -0.63 0.23 0.00 0.00 176.35 176.09 2nr2 s ILE 44 N 0.80 4.14 -0.08 -0.59 -1.09 0.13 -0.86 121.20 123.65 2nr2 s ILE 44 Ca 0.09 -0.31 -0.07 0.00 -2.23 0.00 0.00 60.65 58.13 2nr2 s ILE 44 Cb -0.13 -2.74 0.02 0.00 -1.58 0.00 0.00 42.46 38.03 2nr2 s ILE 44 CO 0.02 0.59 0.21 0.12 -1.23 0.00 0.00 174.94 174.65 2nr2 s PHE 45 N -0.67 -0.22 0.00 3.97 5.36 -0.81 -0.61 117.98 124.99 2nr2 s PHE 45 Ca 0.11 0.55 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 2nr2 s PHE 45 Cb -0.12 0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.64 2nr2 s PHE 45 CO 0.02 -0.11 0.00 0.00 -1.46 0.00 0.00 175.22 173.67 2nr2 n ALA 46 N 2.96 0.00 -2.12 11.12 0.00 -1.26 -1.50 120.51 129.71 2nr2 n ALA 46 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.31 2nr2 n ALA 46 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.02 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 0.75 3.35 0.00 0.00 -1.26 -5.10 105.19 102.93 2nr2 n GLY 47 Ca 0.00 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 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 1.46 -0.15 1.61 1.02 -0.56 -5.12 119.74 118.01 2nr2 s LYS 48 Ca 0.08 -1.21 -0.14 0.00 0.02 0.00 0.00 55.97 54.72 2nr2 s LYS 48 Cb 0.09 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.56 2nr2 s LYS 48 CO -0.04 0.44 0.30 -0.65 -0.92 0.00 0.00 175.35 174.48 2nr2 s GLN 49 N -1.71 4.21 -0.22 1.68 -0.21 -1.26 -1.92 119.66 120.24 2nr2 s GLN 49 Ca 0.11 0.12 -0.14 0.00 0.02 0.00 0.00 55.36 55.47 2nr2 s GLN 49 Cb -0.10 -3.41 -0.04 0.00 1.00 0.00 0.00 33.01 30.46 2nr2 s GLN 49 CO 0.04 0.28 0.32 -0.51 -2.12 0.00 0.00 175.29 173.30 2nr2 s LEU 50 N 0.34 4.13 0.20 2.90 1.43 -0.04 -5.01 118.68 122.63 2nr2 s LEU 50 Ca 0.17 0.38 -0.31 0.00 -1.03 0.00 0.00 54.13 53.34 2nr2 s LEU 50 Cb -0.13 -2.38 -0.10 0.00 0.03 0.00 0.00 46.19 43.61 2nr2 s LEU 50 CO 0.05 -0.04 1.45 -1.61 0.23 0.00 0.00 176.35 176.43 2nr2 s GLU 51 N 1.29 4.27 0.38 1.70 2.02 -1.26 -4.56 118.70 122.55 2nr2 s GLU 51 Ca 0.15 2.25 0.08 0.00 0.02 0.00 0.00 54.97 57.48 2nr2 s GLU 51 Cb -0.14 -3.15 0.76 0.00 0.10 0.00 0.00 34.13 31.69 2nr2 s GLU 51 CO 0.07 -0.46 1.93 -0.44 0.02 0.00 0.00 175.26 176.38 2nr2 h ASP 52 N 5.85 0.32 -0.28 -0.19 3.32 -1.97 -2.59 116.42 120.87 2nr2 h ASP 52 Ca -0.44 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 2nr2 h ASP 52 Cb 1.21 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 40.62 2nr2 h ASP 52 CO 0.83 0.42 0.13 0.61 -1.72 0.00 0.00 179.24 179.50 2nr2 n GLY 53 N -0.96 2.49 3.56 2.75 0.00 -1.26 0.04 105.19 111.82 2nr2 n GLY 53 Ca 0.00 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.33 1.85 0.16 1.61 1.81 -0.98 -4.97 118.95 117.10 2nr2 s ARG 54 Ca 0.19 -2.02 0.05 0.00 -1.72 0.00 0.00 55.73 52.23 2nr2 s ARG 54 Cb 0.16 -1.52 -0.04 0.00 -0.45 0.00 0.00 34.95 33.10 2nr2 s ARG 54 CO 0.04 -0.01 0.15 0.95 -0.68 0.00 0.00 175.30 175.76 2nr2 s THR 55 N -2.78 4.61 0.35 0.02 -4.23 -1.26 -0.80 115.64 111.55 2nr2 s THR 55 Ca 0.34 -1.00 0.11 0.00 -1.18 0.00 0.00 61.69 59.96 2nr2 s THR 55 Cb 0.07 -3.35 0.33 0.00 1.34 0.00 0.00 72.50 70.90 2nr2 s THR 55 CO 0.17 -0.09 1.81 -0.07 -0.54 0.00 0.00 174.62 175.89 2nr2 h LEU 56 N 2.43 0.64 -0.03 4.79 3.38 -1.37 -2.24 115.31 122.91 2nr2 h LEU 56 Ca -0.48 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.58 2nr2 h LEU 56 Cb 1.20 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2nr2 h LEU 56 CO 0.64 0.23 -0.02 -1.28 0.09 0.00 0.00 178.44 178.11 2nr2 h SER 57 N 0.63 -0.05 -0.88 -0.43 0.87 -1.44 -0.69 113.55 111.55 2nr2 h SER 57 Ca 0.54 0.01 0.21 0.00 -1.23 0.00 0.00 61.79 61.33 2nr2 h SER 57 Cb 1.02 0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 62.85 2nr2 h SER 57 CO -0.30 -0.02 -0.04 0.44 -0.53 0.00 0.00 176.83 176.38 2nr2 h ASP 58 N -0.01 -0.51 1.22 6.23 3.32 -1.69 -1.32 116.42 123.66 2nr2 h ASP 58 Ca 0.02 0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2nr2 h ASP 58 Cb 0.04 0.45 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2nr2 h ASP 58 CO -0.04 -0.27 0.00 -1.22 -1.72 0.00 0.00 179.24 175.99 2nr2 n TYR 59 N -5.45 0.69 -2.42 4.55 4.01 -1.09 -4.98 117.16 112.48 2nr2 n TYR 59 Ca 0.17 0.21 -0.05 0.00 -0.16 0.00 0.00 57.90 58.08 2nr2 n TYR 59 Cb 0.58 -0.85 0.02 0.00 -0.31 0.00 0.00 39.34 38.79 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 -2.08 -4.79 -4.83 7.72 5.03 -0.30 -5.05 115.26 110.96 2nr2 n ASN 60 Ca 0.05 -0.25 -0.37 0.00 0.87 0.00 0.00 54.58 54.88 2nr2 n ASN 60 Cb 0.37 -3.19 -0.06 0.00 -1.02 0.00 0.00 39.78 35.88 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2nr2 s ILE 61 N -3.13 5.38 0.51 2.41 1.01 -0.98 -5.02 121.20 121.38 2nr2 s ILE 61 Ca 0.15 0.36 0.01 0.00 0.00 0.00 0.00 60.65 61.18 2nr2 s ILE 61 Cb -0.02 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.97 2nr2 s ILE 61 CO 0.41 0.55 0.10 0.00 0.00 0.00 0.00 174.94 176.00 2nr2 n GLN 62 N 2.41 0.77 -2.33 2.79 10.64 -1.26 -4.79 117.38 125.61 2nr2 n GLN 62 Ca -0.17 -3.58 -0.40 0.00 -1.83 0.00 0.00 57.00 51.01 2nr2 n GLN 62 Cb 0.54 0.83 -0.03 0.00 -0.86 0.00 0.00 30.24 30.71 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 -3.90 4.48 -0.58 2.61 -2.85 -1.26 -3.82 119.74 114.41 2nr2 s LYS 63 Ca 0.07 1.95 -0.01 0.00 -1.00 0.00 0.00 55.97 56.98 2nr2 s LYS 63 Cb -0.01 -3.09 0.00 0.00 -2.06 0.00 0.00 37.83 32.68 2nr2 s LYS 63 CO 0.05 0.02 0.49 0.39 0.10 0.00 0.00 175.35 176.39 2nr2 n GLU 64 N 0.93 -3.26 -4.50 1.78 1.02 0.20 -5.00 120.64 111.80 2nr2 n GLU 64 Ca -0.00 0.39 -0.34 0.00 -0.02 0.00 0.00 57.16 57.19 2nr2 n GLU 64 Cb 0.44 -4.05 -0.11 0.00 -0.02 0.00 0.00 31.44 27.70 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 -3.46 4.78 -0.62 1.62 0.01 -1.25 -4.89 113.70 109.89 2nr2 s SER 65 Ca 0.09 -0.05 -0.20 0.00 1.31 0.00 0.00 55.95 57.10 2nr2 s SER 65 Cb -0.04 -1.49 0.09 0.00 0.21 0.00 0.00 66.02 64.79 2nr2 s SER 65 CO 0.33 0.28 0.80 -0.89 0.41 0.00 0.00 173.24 174.17 2nr2 s THR 66 N -0.29 4.66 0.32 1.44 2.01 -1.26 -1.36 115.64 121.16 2nr2 s THR 66 Ca 0.05 -0.80 -0.22 0.00 0.31 0.00 0.00 61.69 61.02 2nr2 s THR 66 Cb -0.13 -4.56 -0.10 0.00 0.01 0.00 0.00 72.50 67.73 2nr2 s THR 66 CO 0.02 -1.24 0.87 -0.76 -0.69 0.00 0.00 174.62 172.82 2nr2 s LEU 67 N 3.13 4.22 -0.09 4.42 1.02 -0.53 -4.84 118.68 126.00 2nr2 s LEU 67 Ca 0.15 1.64 -0.02 0.00 0.02 0.00 0.00 54.13 55.93 2nr2 s LEU 67 Cb -0.21 -4.05 -0.03 0.00 0.02 0.00 0.00 46.19 41.92 2nr2 s LEU 67 CO 0.07 -0.13 -0.02 -1.00 0.02 0.00 0.00 176.35 175.30 2nr2 s HIS 68 N -1.77 3.09 -0.23 0.29 3.76 0.22 -2.25 115.29 118.40 2nr2 s HIS 68 Ca 0.52 0.09 -0.07 0.00 -0.15 0.00 0.00 55.06 55.45 2nr2 s HIS 68 Cb -0.15 -1.80 -0.03 0.00 1.11 0.00 0.00 32.58 31.71 2nr2 s HIS 68 CO 0.20 0.37 0.05 -1.17 -0.85 0.00 0.00 174.74 173.34 2nr2 s LEU 69 N -0.67 3.42 -0.22 0.89 0.20 -0.87 0.19 118.68 121.62 2nr2 s LEU 69 Ca 0.11 -0.18 -0.06 0.00 0.69 0.00 0.00 54.13 54.69 2nr2 s LEU 69 Cb -0.12 -1.90 -0.02 0.00 -0.43 0.00 0.00 46.19 43.72 2nr2 s LEU 69 CO 0.02 0.01 0.02 0.68 -0.29 0.00 0.00 176.35 176.79 2nr2 s VAL 70 N 1.35 4.05 -0.22 1.68 -7.23 0.18 -4.81 120.40 115.39 2nr2 s VAL 70 Ca 0.05 -0.27 -0.10 0.00 -1.81 0.00 0.00 61.98 59.85 2nr2 s VAL 70 Cb -0.15 -2.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.89 2nr2 s VAL 70 CO 0.03 0.39 0.14 -0.22 -0.31 0.00 0.00 175.10 175.13 2nr2 s LEU 71 N 1.28 4.11 -0.27 1.32 2.96 -1.26 -0.97 118.68 125.84 2nr2 s LEU 71 Ca 0.04 0.15 -0.27 0.00 -0.22 0.00 0.00 54.13 53.83 2nr2 s LEU 71 Cb -0.15 -2.08 0.01 0.00 0.50 0.00 0.00 46.19 44.47 2nr2 s LEU 71 CO 0.02 0.11 0.96 -0.60 -1.32 0.00 0.00 176.35 175.52 2nr2 s ARG 72 N 0.76 4.14 -0.19 1.98 3.52 -1.07 -4.88 118.95 123.21 2nr2 s ARG 72 Ca 0.07 1.05 -0.10 0.00 -0.13 0.00 0.00 55.73 56.62 2nr2 s ARG 72 Cb -0.13 -3.68 -0.08 0.00 -1.56 0.00 0.00 34.95 29.50 2nr2 s ARG 72 CO 0.02 -0.69 -0.25 1.28 -0.81 0.00 0.00 175.30 174.84 2nr2 n LEU 73 N 6.40 1.43 0.00 -0.88 4.77 -1.26 -4.90 117.00 122.55 2nr2 n LEU 73 Ca 0.09 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2nr2 n LEU 73 Cb 0.47 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2nr2 n LEU 73 CO 0.53 0.30 0.00 0.54 -1.33 0.00 0.00 177.39 177.43 2nr2 n ARG 74 N -3.92 0.00 0.00 3.23 1.74 -1.26 -5.15 116.66 111.30 2nr2 n ARG 74 Ca -0.35 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.73 2nr2 n ARG 74 Cb 0.72 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nr2 n GLY 75 N 2.41 4.14 0.00 -0.13 0.00 -1.26 -5.24 105.19 105.11 2nr2 n GLY 75 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93