#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 4.00 0.32 2.12 0.74 -1.26 -0.85 119.66 124.72 2nr2 s GLN 2 Ca 0.00 -0.31 0.10 0.00 0.05 0.00 0.00 55.36 55.20 2nr2 s GLN 2 Cb 0.00 -3.54 -0.06 0.00 1.10 0.00 0.00 33.01 30.51 2nr2 s GLN 2 CO 0.00 -0.02 -0.12 0.96 -0.55 0.00 0.00 175.29 175.57 2nr2 s ILE 3 N 1.26 2.20 0.03 -2.34 -4.36 -0.52 -0.19 121.20 117.28 2nr2 s ILE 3 Ca 0.07 -2.24 0.09 0.00 -0.26 0.00 0.00 60.65 58.31 2nr2 s ILE 3 Cb -0.14 -2.52 -0.03 0.00 1.25 0.00 0.00 42.46 41.02 2nr2 s ILE 3 CO 0.06 -0.27 -0.26 -0.36 0.24 0.00 0.00 174.94 174.35 2nr2 s PHE 4 N -2.65 2.33 -0.24 1.37 0.08 -0.23 -1.86 117.98 116.78 2nr2 s PHE 4 Ca 0.31 -0.42 -0.00 0.00 0.12 0.00 0.00 56.93 56.94 2nr2 s PHE 4 Cb 0.01 -1.43 0.03 0.00 -0.57 0.00 0.00 43.02 41.06 2nr2 s PHE 4 CO 0.15 0.08 -0.09 0.08 -0.10 0.00 0.00 175.22 175.34 2nr2 s VAL 5 N -0.75 2.61 0.03 -0.44 1.01 -0.90 -0.99 120.40 120.98 2nr2 s VAL 5 Ca 0.11 -1.12 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 2nr2 s VAL 5 Cb -0.10 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2nr2 s VAL 5 CO 0.01 0.21 0.34 -0.75 0.00 0.00 0.00 175.10 174.92 2nr2 s LYS 6 N 1.28 3.70 0.59 2.72 2.47 0.93 -1.03 119.74 130.41 2nr2 s LYS 6 Ca -0.01 0.11 0.09 0.00 -1.56 0.00 0.00 55.97 54.61 2nr2 s LYS 6 Cb -0.17 -3.07 0.09 0.00 -1.46 0.00 0.00 37.83 33.22 2nr2 s LYS 6 CO -0.06 0.63 0.77 0.95 0.16 0.00 0.00 175.35 177.79 2nr2 s THR 7 N -1.29 1.96 -0.98 3.43 -4.23 -0.64 -0.71 115.64 113.18 2nr2 s THR 7 Ca 0.28 -1.07 0.28 0.00 -1.18 0.00 0.00 61.69 60.01 2nr2 s THR 7 Cb -0.14 -2.03 0.24 0.00 1.34 0.00 0.00 72.50 71.92 2nr2 s THR 7 CO 0.16 0.00 1.91 0.18 -0.54 0.00 0.00 174.62 176.32 2nr2 n LEU 8 N -2.23 0.07 -0.09 4.79 4.77 -1.25 -4.06 117.00 119.00 2nr2 n LEU 8 Ca 0.14 0.51 -0.17 0.00 -0.03 0.00 0.00 56.01 56.46 2nr2 n LEU 8 Cb 0.62 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 41.13 2nr2 n LEU 8 CO 0.40 -0.02 -0.21 0.71 -1.33 0.00 0.00 177.39 176.93 2nr2 h THR 9 N 0.00 1.02 0.00 -5.08 1.35 -1.96 -3.49 112.91 104.75 2nr2 h THR 9 Ca 0.00 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.83 2nr2 h THR 9 Cb 0.51 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2nr2 h THR 9 CO 0.00 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 2nr2 n GLY 10 N 1.52 -0.31 3.77 5.82 0.00 -1.26 -5.14 105.19 109.59 2nr2 n GLY 10 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 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 4.61 -0.14 1.61 2.20 -1.26 -4.86 119.74 121.90 2nr2 s LYS 11 Ca 0.00 1.49 -0.03 0.00 -0.36 0.00 0.00 55.97 57.07 2nr2 s LYS 11 Cb 0.00 -2.97 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 2nr2 s LYS 11 CO 0.00 0.27 -0.02 0.99 -0.36 0.00 0.00 175.35 176.23 2nr2 s THR 12 N -1.42 4.10 0.08 3.43 2.01 -1.26 -1.62 115.64 120.96 2nr2 s THR 12 Ca 0.48 -0.30 0.05 0.00 0.31 0.00 0.00 61.69 62.23 2nr2 s THR 12 Cb -0.24 -2.78 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 2nr2 s THR 12 CO 0.30 0.52 -0.03 -0.63 -0.69 0.00 0.00 174.62 174.09 2nr2 s ILE 13 N 0.00 3.83 -0.12 1.82 1.01 -0.19 -4.96 121.20 122.59 2nr2 s ILE 13 Ca 0.02 -1.02 0.02 0.00 0.00 0.00 0.00 60.65 59.67 2nr2 s ILE 13 Cb -0.13 -2.80 0.01 0.00 0.01 0.00 0.00 42.46 39.55 2nr2 s ILE 13 CO 0.02 0.16 -0.18 -0.89 0.00 0.00 0.00 174.94 174.05 2nr2 s THR 14 N -1.25 1.70 0.20 2.92 2.01 -1.26 -2.11 115.64 117.84 2nr2 s THR 14 Ca 0.24 -0.76 0.08 0.00 0.31 0.00 0.00 61.69 61.55 2nr2 s THR 14 Cb -0.11 -1.53 -0.05 0.00 0.01 0.00 0.00 72.50 70.82 2nr2 s THR 14 CO 0.16 0.48 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.66 2nr2 s LEU 15 N 0.94 2.53 -0.13 4.42 1.43 -0.78 -5.01 118.68 122.09 2nr2 s LEU 15 Ca -0.06 -0.99 0.03 0.00 -1.03 0.00 0.00 54.13 52.07 2nr2 s LEU 15 Cb -0.15 -0.69 0.01 0.00 0.03 0.00 0.00 46.19 45.39 2nr2 s LEU 15 CO -0.02 -0.15 -0.21 -1.61 0.23 0.00 0.00 176.35 174.59 2nr2 s GLU 16 N -3.49 2.88 0.13 1.70 2.02 -1.26 -1.44 118.70 119.24 2nr2 s GLU 16 Ca 0.21 -0.81 0.04 0.00 0.02 0.00 0.00 54.97 54.43 2nr2 s GLU 16 Cb -0.02 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.86 2nr2 s GLU 16 CO 0.07 0.01 -0.10 0.14 0.02 0.00 0.00 175.26 175.39 2nr2 s VAL 17 N 0.77 1.07 -0.03 2.63 -7.23 -0.03 -4.98 120.40 112.59 2nr2 s VAL 17 Ca -0.09 -1.91 0.04 0.00 -1.81 0.00 0.00 61.98 58.21 2nr2 s VAL 17 Cb -0.16 -1.68 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 2nr2 s VAL 17 CO -0.00 -0.69 -0.15 -1.61 -0.31 0.00 0.00 175.10 172.34 2nr2 s GLU 18 N -3.43 2.43 0.00 4.82 0.41 -1.26 -1.56 118.70 120.10 2nr2 s GLU 18 Ca 0.13 -0.75 0.03 0.00 -0.41 0.00 0.00 54.97 53.97 2nr2 s GLU 18 Cb 0.01 -2.35 0.14 0.00 -1.78 0.00 0.00 34.13 30.15 2nr2 s GLU 18 CO -0.00 0.61 0.99 -2.30 -0.49 0.00 0.00 175.26 174.06 2nr2 n PRO 19 N 2.13 0.02 0.12 0.39 -0.02 -1.26 -1.42 135.00 134.97 2nr2 n PRO 19 Ca -0.17 0.34 0.12 0.00 -2.02 0.00 0.00 63.50 61.77 2nr2 n PRO 19 Cb 0.52 -1.50 0.46 0.00 -0.02 0.00 0.00 33.50 32.97 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 -1.38 0.72 -4.78 2.55 3.41 -1.26 -3.70 113.62 109.18 2nr2 n SER 20 Ca 0.01 0.64 -0.37 0.00 -0.26 0.00 0.00 58.87 58.89 2nr2 n SER 20 Cb 0.03 -0.80 -0.04 0.00 -0.26 0.00 0.00 64.21 63.13 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 -4.35 6.83 0.79 4.04 1.01 -0.51 -4.94 116.67 119.55 2nr2 s ASP 21 Ca 0.06 2.05 -0.04 0.00 0.71 0.00 0.00 52.55 55.34 2nr2 s ASP 21 Cb 0.10 -2.59 0.16 0.00 1.01 0.00 0.00 42.92 41.60 2nr2 s ASP 21 CO 0.46 -0.44 1.08 0.42 0.21 0.00 0.00 175.17 176.90 2nr2 s THR 22 N -1.61 2.04 -0.28 -1.27 -4.23 -1.26 -2.64 115.64 106.39 2nr2 s THR 22 Ca 0.56 -0.49 0.19 0.00 -1.18 0.00 0.00 61.69 60.77 2nr2 s THR 22 Cb -0.23 -2.55 0.20 0.00 1.34 0.00 0.00 72.50 71.26 2nr2 s THR 22 CO 0.29 0.00 1.54 0.40 -0.54 0.00 0.00 174.62 176.30 2nr2 h ILE 23 N -0.81 0.44 -0.05 2.99 1.08 -1.06 -1.63 117.51 118.48 2nr2 h ILE 23 Ca -0.37 -1.60 -0.12 0.00 -0.39 0.00 0.00 64.86 62.38 2nr2 h ILE 23 Cb 1.25 2.20 -0.01 0.00 -3.07 0.00 0.00 36.82 37.19 2nr2 h ILE 23 CO 0.37 0.25 -0.54 -0.08 -0.69 0.00 0.00 178.15 177.47 2nr2 h GLU 24 N 0.00 0.13 0.04 2.37 4.81 -1.46 -2.65 114.58 117.82 2nr2 h GLU 24 Ca -0.00 -0.08 -0.24 0.00 -0.13 0.00 0.00 59.36 58.91 2nr2 h GLU 24 Cb 1.18 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2nr2 h GLU 24 CO 0.03 0.63 -1.04 -0.91 -0.73 0.00 0.00 179.01 177.00 2nr2 h ASN 25 N 0.10 0.49 0.17 1.04 -0.26 -1.78 -1.95 115.58 113.39 2nr2 h ASN 25 Ca -0.00 -0.43 0.01 0.00 -0.56 0.00 0.00 56.30 55.32 2nr2 h ASN 25 Cb 0.98 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 38.06 2nr2 h ASN 25 CO 0.08 1.26 -0.29 0.58 -1.06 0.00 0.00 177.43 178.00 2nr2 h VAL 26 N 0.17 0.38 -1.00 2.81 2.07 -1.31 0.13 116.25 119.50 2nr2 h VAL 26 Ca -0.10 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.63 2nr2 h VAL 26 Cb 1.70 0.38 -0.11 0.00 -1.52 0.00 0.00 31.29 31.74 2nr2 h VAL 26 CO 0.18 0.00 0.61 0.11 0.02 0.00 0.00 177.57 178.49 2nr2 h LYS 27 N -0.54 0.64 -0.34 1.57 1.57 -1.53 0.81 116.57 118.75 2nr2 h LYS 27 Ca 0.02 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2nr2 h LYS 27 Cb 0.54 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2nr2 h LYS 27 CO -0.13 0.42 -0.18 0.00 -0.57 0.00 0.00 179.45 178.99 2nr2 h ALA 28 N 1.66 1.06 0.00 3.86 0.00 -1.04 0.87 119.26 125.67 2nr2 h ALA 28 Ca 0.59 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2nr2 h ALA 28 Cb 1.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2nr2 h ALA 28 CO -0.38 0.57 -0.20 0.87 0.00 0.00 0.00 179.25 180.11 2nr2 h LYS 29 N 0.56 0.00 -0.02 0.00 1.57 0.11 -1.97 116.57 116.82 2nr2 h LYS 29 Ca 0.09 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.75 2nr2 h LYS 29 Cb 0.62 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 2nr2 h LYS 29 CO 0.04 0.20 -0.55 0.82 -0.57 0.00 0.00 179.45 179.40 2nr2 h ILE 30 N 0.00 1.39 -0.54 1.86 2.04 -0.25 0.10 117.51 122.11 2nr2 h ILE 30 Ca -0.00 -1.87 -0.08 0.00 1.00 0.00 0.00 64.86 63.91 2nr2 h ILE 30 Cb 0.88 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 2nr2 h ILE 30 CO 0.03 0.54 0.02 -0.61 0.00 0.00 0.00 178.15 178.12 2nr2 h GLN 31 N 0.03 0.91 0.58 2.37 4.15 -0.45 0.18 115.11 122.88 2nr2 h GLN 31 Ca -0.00 -0.25 -0.03 0.00 0.77 0.00 0.00 58.65 59.14 2nr2 h GLN 31 Cb 0.98 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 28.57 2nr2 h GLN 31 CO 0.07 0.89 -0.28 0.22 -1.93 0.00 0.00 178.83 177.80 2nr2 h ASP 32 N 0.84 -0.66 0.82 -0.69 3.58 -1.17 -3.16 116.42 116.00 2nr2 h ASP 32 Ca 0.16 0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.59 2nr2 h ASP 32 Cb 0.47 0.17 0.01 0.00 1.72 0.00 0.00 39.33 41.70 2nr2 h ASP 32 CO 0.02 -0.25 -0.40 0.50 -2.88 0.00 0.00 179.24 176.23 2nr2 h LYS 33 N -1.20 -1.07 0.00 0.28 1.63 -0.68 -3.40 116.57 112.13 2nr2 h LYS 33 Ca -0.08 0.07 -0.14 0.00 -0.85 0.00 0.00 60.65 59.66 2nr2 h LYS 33 Cb 0.60 0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 32.45 2nr2 h LYS 33 CO 0.13 -0.71 -1.22 0.39 -3.45 0.00 0.00 179.45 174.59 2nr2 n GLU 34 N -5.55 0.53 0.00 1.90 -0.58 0.59 -5.01 120.64 112.51 2nr2 n GLU 34 Ca -0.15 0.38 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 2nr2 n GLU 34 Cb 0.44 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.74 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 1.46 0.68 3.71 0.62 0.00 -0.89 -5.03 105.19 105.73 2nr2 n GLY 35 Ca -0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.51 4.04 0.63 -0.61 1.01 -1.25 -4.92 121.20 118.59 2nr2 s ILE 36 Ca 0.00 1.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.95 2nr2 s ILE 36 Cb 0.00 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 2nr2 s ILE 36 CO 0.00 0.10 1.10 -2.84 0.00 0.00 0.00 174.94 173.30 2nr2 s PRO 37 N 1.18 2.98 0.00 2.79 0.02 -1.26 -3.89 135.00 136.81 2nr2 s PRO 37 Ca 0.59 1.39 0.30 0.00 0.02 0.00 0.00 61.00 63.29 2nr2 s PRO 37 Cb -0.29 -1.97 1.55 0.00 0.02 0.00 0.00 34.50 33.81 2nr2 s PRO 37 CO 0.29 -1.11 2.06 -0.35 -0.33 0.00 0.00 177.00 177.55 2nr2 n PRO 38 N -2.18 0.50 0.08 5.54 -0.04 -1.26 -2.42 135.00 135.22 2nr2 n PRO 38 Ca 0.10 0.01 -0.22 0.00 -0.04 0.00 0.00 63.50 63.35 2nr2 n PRO 38 Cb 0.52 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.35 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2nr2 h ASP 39 N 0.00 0.89 0.00 3.54 3.58 -1.97 -3.35 116.42 119.11 2nr2 h ASP 39 Ca 0.00 -0.81 -0.00 0.00 0.42 0.00 0.00 57.03 56.64 2nr2 h ASP 39 Cb 0.24 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2nr2 h ASP 39 CO 0.00 1.60 -0.00 -0.61 -2.88 0.00 0.00 179.24 177.35 2nr2 h GLN 40 N 0.30 0.00 -6.57 0.28 4.15 -1.86 -3.45 115.11 107.96 2nr2 h GLN 40 Ca -0.18 0.00 -0.52 0.00 0.77 0.00 0.00 58.65 58.72 2nr2 h GLN 40 Cb 1.87 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 29.54 2nr2 h GLN 40 CO 0.23 0.00 -0.04 -0.65 -1.93 0.00 0.00 178.83 176.44 2nr2 s GLN 41 N -4.94 3.80 -0.00 1.69 -0.21 -1.21 -1.99 119.66 116.79 2nr2 s GLN 41 Ca -0.05 0.32 0.02 0.00 0.02 0.00 0.00 55.36 55.67 2nr2 s GLN 41 Cb 0.16 -2.57 -0.00 0.00 1.00 0.00 0.00 33.01 31.61 2nr2 s GLN 41 CO 0.63 0.21 -0.05 1.03 -2.12 0.00 0.00 175.29 174.99 2nr2 s ARG 42 N -3.17 0.45 -0.10 2.91 0.52 -0.75 -4.99 118.95 113.81 2nr2 s ARG 42 Ca 0.48 -0.19 0.03 0.00 -0.52 0.00 0.00 55.73 55.53 2nr2 s ARG 42 Cb -0.11 -0.43 0.01 0.00 0.52 0.00 0.00 34.95 34.93 2nr2 s ARG 42 CO 0.24 0.11 -0.21 -0.51 0.02 0.00 0.00 175.30 174.96 2nr2 s LEU 43 N -0.11 1.97 -0.03 2.53 1.43 -1.26 -1.97 118.68 121.24 2nr2 s LEU 43 Ca 0.02 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 2nr2 s LEU 43 Cb -0.02 -1.28 -0.02 0.00 0.03 0.00 0.00 46.19 44.90 2nr2 s LEU 43 CO -0.00 0.11 -0.24 -0.63 0.23 0.00 0.00 176.35 175.82 2nr2 s ILE 44 N 0.55 2.21 -0.07 -0.59 -1.09 -0.21 -1.62 121.20 120.39 2nr2 s ILE 44 Ca -0.15 -1.04 0.01 0.00 -2.23 0.00 0.00 60.65 57.24 2nr2 s ILE 44 Cb -0.17 -1.79 0.02 0.00 -1.58 0.00 0.00 42.46 38.94 2nr2 s ILE 44 CO 0.05 0.58 -0.07 0.12 -1.23 0.00 0.00 174.94 174.39 2nr2 s PHE 45 N -0.53 1.14 0.00 3.97 5.36 -0.94 -0.68 117.98 126.29 2nr2 s PHE 45 Ca 0.08 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.61 2nr2 s PHE 45 Cb -0.11 -0.94 0.00 0.00 -0.34 0.00 0.00 43.02 41.63 2nr2 s PHE 45 CO 0.00 -0.31 0.00 0.00 -1.46 0.00 0.00 175.22 173.45 2nr2 n ALA 46 N 4.29 0.00 0.00 11.12 0.00 -1.26 -2.83 120.51 131.83 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 0.00 3.90 0.00 0.00 -1.26 -5.14 105.19 102.68 2nr2 n GLY 47 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2nr2 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 48 N -0.32 3.51 0.01 1.61 -2.85 -1.13 -5.06 119.74 115.51 2nr2 s LYS 48 Ca 0.00 0.31 -0.18 0.00 -1.00 0.00 0.00 55.97 55.10 2nr2 s LYS 48 Cb 0.00 -2.30 -0.06 0.00 -2.06 0.00 0.00 37.83 33.41 2nr2 s LYS 48 CO 0.00 -0.33 0.51 -1.14 0.10 0.00 0.00 175.35 174.50 2nr2 s GLN 49 N -4.86 4.16 -0.17 1.78 0.74 -1.26 -2.22 119.66 117.83 2nr2 s GLN 49 Ca 0.50 0.60 -0.16 0.00 0.05 0.00 0.00 55.36 56.35 2nr2 s GLN 49 Cb -0.10 -3.28 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2nr2 s GLN 49 CO 0.47 0.53 0.38 -0.51 -0.55 0.00 0.00 175.29 175.61 2nr2 s LEU 50 N -0.65 4.21 0.66 3.68 1.43 -0.64 -4.99 118.68 122.38 2nr2 s LEU 50 Ca 0.27 0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 53.82 2nr2 s LEU 50 Cb -0.18 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 2nr2 s LEU 50 CO 0.16 -0.01 1.05 -1.61 0.23 0.00 0.00 176.35 176.17 2nr2 s GLU 51 N 0.91 3.16 0.03 1.70 2.02 -1.26 -4.69 118.70 120.57 2nr2 s GLU 51 Ca 0.20 0.97 -0.31 0.00 0.02 0.00 0.00 54.97 55.84 2nr2 s GLU 51 Cb -0.14 -2.02 -0.17 0.00 0.10 0.00 0.00 34.13 31.90 2nr2 s GLU 51 CO 0.07 -0.93 1.30 -0.44 0.02 0.00 0.00 175.26 175.29 2nr2 h ASP 52 N -0.38 -0.94 -0.20 -0.19 3.32 -1.97 -3.28 116.42 112.78 2nr2 h ASP 52 Ca -0.44 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 2nr2 h ASP 52 Cb 1.21 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.97 2nr2 h ASP 52 CO 0.58 -0.59 0.06 0.61 -1.72 0.00 0.00 179.24 178.18 2nr2 n GLY 53 N -1.08 2.18 3.93 2.75 0.00 -1.26 -1.32 105.19 110.40 2nr2 n GLY 53 Ca -0.14 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.28 3.49 0.84 1.61 1.81 -1.24 -4.96 118.95 119.22 2nr2 s ARG 54 Ca 0.15 -0.44 -0.08 0.00 -1.72 0.00 0.00 55.73 53.64 2nr2 s ARG 54 Cb 0.12 -2.90 0.16 0.00 -0.45 0.00 0.00 34.95 31.87 2nr2 s ARG 54 CO 0.04 0.46 1.15 0.95 -0.68 0.00 0.00 175.30 177.23 2nr2 s THR 55 N -1.79 2.08 0.17 0.02 -4.23 -1.26 -1.38 115.64 109.25 2nr2 s THR 55 Ca 0.37 -0.29 -0.11 0.00 -1.18 0.00 0.00 61.69 60.49 2nr2 s THR 55 Cb -0.11 -2.79 0.04 0.00 1.34 0.00 0.00 72.50 70.98 2nr2 s THR 55 CO 0.29 0.00 1.62 -0.07 -0.54 0.00 0.00 174.62 175.92 2nr2 h LEU 56 N -1.07 0.97 -1.10 4.79 3.38 -1.62 -3.14 115.31 117.52 2nr2 h LEU 56 Ca -0.41 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.19 2nr2 h LEU 56 Cb 1.26 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 2nr2 h LEU 56 CO 0.41 1.04 -0.32 0.28 0.09 0.00 0.00 178.44 179.95 2nr2 h SER 57 N 0.87 0.00 0.38 -0.43 0.02 -1.82 -0.99 113.55 111.58 2nr2 h SER 57 Ca 0.16 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2nr2 h SER 57 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2nr2 h SER 57 CO 0.03 0.32 -0.18 0.44 -1.14 0.00 0.00 176.83 176.29 2nr2 h ASP 58 N 0.00 -0.43 0.00 3.07 3.32 -1.88 -3.25 116.42 117.25 2nr2 h ASP 58 Ca -0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2nr2 h ASP 58 Cb 0.79 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.45 2nr2 h ASP 58 CO 0.04 -0.07 0.00 -1.22 -1.72 0.00 0.00 179.24 176.27 2nr2 n TYR 59 N -5.18 0.00 -3.74 4.55 4.01 -1.20 -4.94 117.16 110.66 2nr2 n TYR 59 Ca -0.10 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.41 2nr2 n TYR 59 Cb 0.28 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.35 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 -0.82 -2.47 -4.40 7.72 3.02 -0.57 -4.95 115.26 112.80 2nr2 n ASN 60 Ca 0.12 -0.78 -0.44 0.00 -0.03 0.00 0.00 54.58 53.44 2nr2 n ASN 60 Cb 0.05 -4.12 -0.06 0.00 -0.61 0.00 0.00 39.78 35.04 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2nr2 s ILE 61 N -3.54 5.04 0.16 2.41 1.01 -0.48 -5.03 121.20 120.77 2nr2 s ILE 61 Ca 0.21 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.99 2nr2 s ILE 61 Cb -0.10 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.12 2nr2 s ILE 61 CO 0.81 -0.78 0.18 0.00 0.00 0.00 0.00 174.94 175.15 2nr2 n GLN 62 N 5.74 1.06 -1.66 2.79 6.02 -1.26 -4.63 117.38 125.45 2nr2 n GLN 62 Ca -0.10 -0.94 -0.43 0.00 -0.01 0.00 0.00 57.00 55.51 2nr2 n GLN 62 Cb 0.44 0.01 -0.01 0.00 1.02 0.00 0.00 30.24 31.70 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2nr2 n LYS 63 N -1.13 1.83 -1.75 -1.09 2.85 -1.26 -2.77 118.16 114.83 2nr2 n LYS 63 Ca 0.02 0.64 -0.21 0.00 -1.05 0.00 0.00 58.31 57.72 2nr2 n LYS 63 Cb 0.18 -2.15 -0.07 0.00 -0.65 0.00 0.00 35.03 32.34 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2nr2 n GLU 64 N 0.66 -1.50 -3.23 -1.58 1.02 0.73 -4.98 120.64 111.77 2nr2 n GLU 64 Ca 0.07 1.18 -0.37 0.00 -0.02 0.00 0.00 57.16 58.03 2nr2 n GLU 64 Cb 0.34 -5.62 -0.06 0.00 -0.02 0.00 0.00 31.44 26.08 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 -2.62 6.99 -0.24 1.62 0.15 -1.11 -4.77 113.70 113.72 2nr2 s SER 65 Ca 0.00 1.27 -0.07 0.00 0.70 0.00 0.00 55.95 57.85 2nr2 s SER 65 Cb 0.00 -2.36 -0.03 0.00 -1.71 0.00 0.00 66.02 61.92 2nr2 s SER 65 CO 0.00 0.13 0.05 -0.89 1.20 0.00 0.00 173.24 173.73 2nr2 s THR 66 N -1.38 4.23 0.41 6.45 2.01 -1.26 -1.06 115.64 125.04 2nr2 s THR 66 Ca 0.37 -0.20 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2nr2 s THR 66 Cb -0.17 -2.97 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 2nr2 s THR 66 CO 0.20 0.36 0.60 -0.76 -0.69 0.00 0.00 174.62 174.34 2nr2 s LEU 67 N 1.47 3.76 -0.23 4.42 1.43 -0.16 -4.85 118.68 124.51 2nr2 s LEU 67 Ca 0.06 0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.28 2nr2 s LEU 67 Cb -0.15 -3.03 0.02 0.00 0.03 0.00 0.00 46.19 43.06 2nr2 s LEU 67 CO 0.03 -0.61 -0.08 -1.00 0.23 0.00 0.00 176.35 174.92 2nr2 s HIS 68 N -2.43 3.01 -0.19 0.29 3.76 0.14 -0.05 115.29 119.83 2nr2 s HIS 68 Ca 0.47 -1.48 -0.17 0.00 -0.15 0.00 0.00 55.06 53.73 2nr2 s HIS 68 Cb -0.10 -2.04 -0.04 0.00 1.11 0.00 0.00 32.58 31.51 2nr2 s HIS 68 CO 0.36 -0.71 0.46 -1.17 -0.85 0.00 0.00 174.74 172.83 2nr2 s LEU 69 N 1.34 4.17 -0.13 0.89 2.96 0.11 -1.04 118.68 126.98 2nr2 s LEU 69 Ca 0.02 0.64 0.03 0.00 -0.22 0.00 0.00 54.13 54.59 2nr2 s LEU 69 Cb -0.16 -2.63 0.01 0.00 0.50 0.00 0.00 46.19 43.91 2nr2 s LEU 69 CO -0.06 -0.11 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.95 2nr2 s VAL 70 N 1.34 2.05 0.13 1.68 1.01 -0.83 -3.88 120.40 121.91 2nr2 s VAL 70 Ca 0.22 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.25 2nr2 s VAL 70 Cb -0.15 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2nr2 s VAL 70 CO 0.09 0.55 0.22 -0.76 0.00 0.00 0.00 175.10 175.20 2nr2 s LEU 71 N 0.72 4.17 -0.19 3.92 1.43 -1.26 -1.82 118.68 125.64 2nr2 s LEU 71 Ca -0.10 0.10 -0.18 0.00 -1.03 0.00 0.00 54.13 52.92 2nr2 s LEU 71 Cb -0.16 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 2nr2 s LEU 71 CO 0.00 0.08 0.51 -0.60 0.23 0.00 0.00 176.35 176.58 2nr2 s ARG 72 N -3.03 4.21 0.00 1.70 3.52 -0.84 -4.85 118.95 119.65 2nr2 s ARG 72 Ca 0.33 0.42 0.00 0.00 -0.13 0.00 0.00 55.73 56.35 2nr2 s ARG 72 Cb -0.11 -3.54 0.00 0.00 -1.56 0.00 0.00 34.95 29.74 2nr2 s ARG 72 CO 0.27 -0.10 0.00 -0.11 -0.81 0.00 0.00 175.30 174.54 2nr2 n LEU 73 N 4.62 2.38 0.00 -0.88 7.94 -1.26 -5.00 117.00 124.79 2nr2 n LEU 73 Ca -0.05 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.85 2nr2 n LEU 73 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2nr2 n LEU 73 CO 0.42 0.40 0.00 0.54 -1.11 0.00 0.00 177.39 177.64 2nr2 n ARG 74 N -2.40 0.00 0.00 1.96 1.74 -1.26 -5.14 116.66 111.57 2nr2 n ARG 74 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2nr2 n ARG 74 Cb 0.50 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.94 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 4.24 1.03 0.00 -0.13 0.00 -1.26 -5.26 105.19 103.81 2nr2 n GLY 75 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93