#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 4.17 0.14 3.17 -0.21 -1.25 -1.88 119.66 123.81 2nr2 s GLN 2 Ca 0.00 0.73 0.06 0.00 0.02 0.00 0.00 55.36 56.17 2nr2 s GLN 2 Cb 0.00 -3.62 -0.04 0.00 1.00 0.00 0.00 33.01 30.35 2nr2 s GLN 2 CO 0.00 -0.39 0.04 0.96 -2.12 0.00 0.00 175.29 173.78 2nr2 s ILE 3 N 2.43 4.08 -0.17 1.08 -4.36 -0.62 -4.29 121.20 119.35 2nr2 s ILE 3 Ca 0.31 -1.16 -0.07 0.00 -0.26 0.00 0.00 60.65 59.47 2nr2 s ILE 3 Cb -0.16 -3.02 -0.04 0.00 1.25 0.00 0.00 42.46 40.49 2nr2 s ILE 3 CO 0.09 -0.03 0.05 -0.36 0.24 0.00 0.00 174.94 174.93 2nr2 s PHE 4 N -1.59 3.24 -0.16 1.37 0.08 -0.38 -1.41 117.98 119.13 2nr2 s PHE 4 Ca 0.28 0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.42 2nr2 s PHE 4 Cb -0.10 -2.04 0.02 0.00 -0.57 0.00 0.00 43.02 40.32 2nr2 s PHE 4 CO 0.20 0.19 -0.19 0.08 -0.10 0.00 0.00 175.22 175.40 2nr2 s VAL 5 N 0.22 1.95 -0.21 -0.44 1.01 -0.21 -1.02 120.40 121.70 2nr2 s VAL 5 Ca 0.04 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 2nr2 s VAL 5 Cb -0.12 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 2nr2 s VAL 5 CO 0.01 0.52 0.14 -0.54 0.00 0.00 0.00 175.10 175.23 2nr2 s LYS 6 N 1.19 4.13 0.00 2.72 1.02 -0.69 -0.98 119.74 127.14 2nr2 s LYS 6 Ca 0.02 -0.25 0.00 0.00 0.02 0.00 0.00 55.97 55.76 2nr2 s LYS 6 Cb -0.14 -3.45 0.00 0.00 -0.52 0.00 0.00 37.83 33.72 2nr2 s LYS 6 CO -0.09 0.21 0.00 0.25 -0.92 0.00 0.00 175.35 174.80 2nr2 n THR 7 N 3.80 0.00 -0.01 2.17 -2.24 -0.58 -0.65 114.28 116.77 2nr2 n THR 7 Ca -0.16 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.41 2nr2 n THR 7 Cb 0.52 -1.74 -0.14 0.00 -2.10 0.00 0.00 70.33 66.87 2nr2 n THR 7 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2nr2 n LEU 8 N 0.00 2.62 -0.12 3.22 4.77 -1.26 -4.43 117.00 121.81 2nr2 n LEU 8 Ca 0.00 0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 56.14 2nr2 n LEU 8 Cb 0.00 -1.10 0.17 0.00 -2.33 0.00 0.00 43.42 40.16 2nr2 n LEU 8 CO 0.00 0.83 0.91 0.71 -1.33 0.00 0.00 177.39 178.51 2nr2 h THR 9 N 0.00 1.24 0.00 -5.08 1.35 -1.96 -3.46 112.91 105.00 2nr2 h THR 9 Ca -0.43 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.48 2nr2 h THR 9 Cb 1.99 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 2nr2 h THR 9 CO 0.06 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.28 2nr2 n GLY 10 N -0.71 0.85 3.37 5.82 0.00 -1.26 -5.15 105.19 108.12 2nr2 n GLY 10 Ca 0.03 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 0.03 3.36 -0.47 1.61 2.20 -1.26 -4.93 119.74 120.29 2nr2 s LYS 11 Ca 0.00 -0.69 -0.13 0.00 -0.36 0.00 0.00 55.97 54.79 2nr2 s LYS 11 Cb 0.00 -2.62 0.09 0.00 -1.51 0.00 0.00 37.83 33.78 2nr2 s LYS 11 CO 0.00 0.23 0.37 0.99 -0.36 0.00 0.00 175.35 176.57 2nr2 s THR 12 N 0.32 4.83 0.01 3.43 2.01 -1.26 -1.53 115.64 123.45 2nr2 s THR 12 Ca -0.10 -1.30 -0.19 0.00 0.31 0.00 0.00 61.69 60.40 2nr2 s THR 12 Cb -0.16 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.33 2nr2 s THR 12 CO 0.06 -0.62 0.55 0.27 -0.69 0.00 0.00 174.62 174.19 2nr2 s ILE 13 N 1.54 4.90 -0.36 1.82 -4.36 -0.15 -4.90 121.20 119.69 2nr2 s ILE 13 Ca 0.04 1.16 -0.11 0.00 -0.26 0.00 0.00 60.65 61.47 2nr2 s ILE 13 Cb -0.25 -3.88 0.01 0.00 1.25 0.00 0.00 42.46 39.59 2nr2 s ILE 13 CO 0.04 0.47 0.21 -0.89 0.24 0.00 0.00 174.94 175.01 2nr2 s THR 14 N -0.48 4.76 0.00 8.37 2.01 -1.26 -1.04 115.64 128.00 2nr2 s THR 14 Ca 0.29 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.52 2nr2 s THR 14 Cb -0.18 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 2nr2 s THR 14 CO 0.17 -0.16 0.34 -0.76 -0.69 0.00 0.00 174.62 173.52 2nr2 s LEU 15 N 1.60 4.41 -0.29 4.42 1.02 -0.50 -4.96 118.68 124.38 2nr2 s LEU 15 Ca 0.03 0.76 -0.08 0.00 0.02 0.00 0.00 54.13 54.87 2nr2 s LEU 15 Cb -0.18 -2.63 -0.01 0.00 0.02 0.00 0.00 46.19 43.39 2nr2 s LEU 15 CO 0.07 0.28 0.12 -1.61 0.02 0.00 0.00 176.35 175.23 2nr2 s GLU 16 N -1.42 3.33 0.46 1.70 2.02 -1.26 -1.59 118.70 121.94 2nr2 s GLU 16 Ca 0.26 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.56 2nr2 s GLU 16 Cb -0.15 -3.46 -0.01 0.00 0.10 0.00 0.00 34.13 30.61 2nr2 s GLU 16 CO 0.14 -0.38 0.10 0.14 0.02 0.00 0.00 175.26 175.27 2nr2 s VAL 17 N 1.58 0.70 0.32 2.63 -7.23 -0.79 -4.90 120.40 112.71 2nr2 s VAL 17 Ca 0.04 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 2nr2 s VAL 17 Cb -0.17 -2.21 -0.05 0.00 0.56 0.00 0.00 36.38 34.52 2nr2 s VAL 17 CO 0.05 0.00 -0.01 -1.61 -0.31 0.00 0.00 175.10 173.21 2nr2 s GLU 18 N -3.74 2.07 0.24 4.82 2.02 -1.26 0.79 118.70 123.65 2nr2 s GLU 18 Ca 0.15 -1.69 0.23 0.00 0.02 0.00 0.00 54.97 53.69 2nr2 s GLU 18 Cb 0.01 -1.96 0.96 0.00 0.10 0.00 0.00 34.13 33.24 2nr2 s GLU 18 CO 0.10 0.20 1.71 -2.30 0.02 0.00 0.00 175.26 174.99 2nr2 n PRO 19 N -0.91 0.19 0.00 0.39 -0.02 -1.26 -2.30 135.00 131.10 2nr2 n PRO 19 Ca -0.05 0.40 0.14 0.00 -2.02 0.00 0.00 63.50 61.97 2nr2 n PRO 19 Cb 0.61 -1.85 0.47 0.00 -0.02 0.00 0.00 33.50 32.71 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 -2.21 1.48 -4.75 2.55 3.41 -1.26 -2.69 113.62 110.16 2nr2 n SER 20 Ca 0.02 -1.41 -0.41 0.00 -0.26 0.00 0.00 58.87 56.82 2nr2 n SER 20 Cb 0.24 0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 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 -2.10 7.32 0.85 4.04 1.01 -0.97 -4.91 116.67 121.91 2nr2 s ASP 21 Ca 0.35 2.11 -0.13 0.00 0.71 0.00 0.00 52.55 55.60 2nr2 s ASP 21 Cb 0.21 -2.61 0.11 0.00 1.01 0.00 0.00 42.92 41.63 2nr2 s ASP 21 CO 0.37 -0.15 1.18 0.42 0.21 0.00 0.00 175.17 177.21 2nr2 s THR 22 N -0.62 2.00 0.18 -1.27 -4.23 -1.26 -2.04 115.64 108.40 2nr2 s THR 22 Ca 0.47 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.88 2nr2 s THR 22 Cb -0.29 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.69 2nr2 s THR 22 CO 0.36 0.00 1.70 0.40 -0.54 0.00 0.00 174.62 176.54 2nr2 h ILE 23 N -1.22 1.26 -0.81 2.99 5.03 -1.05 -2.06 117.51 121.65 2nr2 h ILE 23 Ca -0.47 -0.92 0.16 0.00 -0.12 0.00 0.00 64.86 63.51 2nr2 h ILE 23 Cb 1.32 0.61 -0.15 0.00 -3.03 0.00 0.00 36.82 35.57 2nr2 h ILE 23 CO 0.62 0.35 -0.24 -0.08 -0.68 0.00 0.00 178.15 178.12 2nr2 h GLU 24 N 0.96 -0.02 -0.26 2.37 4.81 -1.33 -0.99 114.58 120.12 2nr2 h GLU 24 Ca 0.21 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 2nr2 h GLU 24 Cb 0.34 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2nr2 h GLU 24 CO -0.00 -0.01 -0.23 -0.91 -0.73 0.00 0.00 179.01 177.12 2nr2 h ASN 25 N -0.02 0.48 -0.73 1.04 4.21 -1.78 -1.44 115.58 117.34 2nr2 h ASN 25 Ca 0.37 -0.16 -0.01 0.00 1.21 0.00 0.00 56.30 57.71 2nr2 h ASN 25 Cb 0.59 -0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 37.63 2nr2 h ASN 25 CO -0.84 0.72 0.42 0.58 -1.29 0.00 0.00 177.43 177.02 2nr2 h VAL 26 N 0.43 1.22 -0.13 2.81 2.07 -0.68 -2.64 116.25 119.33 2nr2 h VAL 26 Ca 0.07 -0.51 -0.16 0.00 0.82 0.00 0.00 66.70 66.91 2nr2 h VAL 26 Cb 0.64 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2nr2 h VAL 26 CO 0.05 0.23 -0.60 0.11 0.02 0.00 0.00 177.57 177.38 2nr2 h LYS 27 N 1.01 0.43 0.00 1.57 1.57 -0.86 -2.57 116.57 117.72 2nr2 h LYS 27 Ca 0.26 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2nr2 h LYS 27 Cb 0.00 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2nr2 h LYS 27 CO -0.05 0.90 -0.48 0.00 -0.57 0.00 0.00 179.45 179.26 2nr2 h ALA 28 N 1.03 1.05 -0.22 3.86 0.00 -1.30 0.24 119.26 123.92 2nr2 h ALA 28 Ca -0.00 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 2nr2 h ALA 28 Cb 1.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2nr2 h ALA 28 CO 0.11 0.60 -0.58 -0.22 0.00 0.00 0.00 179.25 179.16 2nr2 h LYS 29 N 0.00 0.69 -0.42 0.00 3.64 -1.53 -1.81 116.57 117.14 2nr2 h LYS 29 Ca -0.00 -0.45 -0.13 0.00 -1.27 0.00 0.00 60.65 58.79 2nr2 h LYS 29 Cb 0.94 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 2nr2 h LYS 29 CO 0.06 1.08 -0.25 0.82 -2.27 0.00 0.00 179.45 178.89 2nr2 h ILE 30 N 0.53 1.27 -0.86 2.00 2.04 -0.93 -2.09 117.51 119.47 2nr2 h ILE 30 Ca 0.00 -1.40 0.07 0.00 1.00 0.00 0.00 64.86 64.54 2nr2 h ILE 30 Cb 1.15 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 38.38 2nr2 h ILE 30 CO 0.12 0.47 0.52 -0.61 0.00 0.00 0.00 178.15 178.65 2nr2 h GLN 31 N 0.76 0.90 -0.81 2.37 4.15 -0.47 0.58 115.11 122.60 2nr2 h GLN 31 Ca 0.09 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2nr2 h GLN 31 Cb 0.80 -0.20 -0.04 0.00 0.21 0.00 0.00 27.48 28.25 2nr2 h GLN 31 CO 0.07 0.59 0.51 0.22 -1.93 0.00 0.00 178.83 178.29 2nr2 h ASP 32 N 0.92 0.95 0.05 -0.69 3.58 -1.16 -2.28 116.42 117.79 2nr2 h ASP 32 Ca 0.39 -0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.79 2nr2 h ASP 32 Cb 0.24 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2nr2 h ASP 32 CO -0.20 0.72 -0.02 0.11 -2.88 0.00 0.00 179.24 176.97 2nr2 h LYS 33 N 1.10 -0.06 0.00 0.28 1.57 -0.66 -3.39 116.57 115.41 2nr2 h LYS 33 Ca 0.29 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.83 2nr2 h LYS 33 Cb -0.08 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 2nr2 h LYS 33 CO -0.06 0.58 -2.24 0.39 -0.57 0.00 0.00 179.45 177.55 2nr2 n GLU 34 N -4.76 0.71 -0.36 3.15 -0.58 0.13 -5.02 120.64 113.91 2nr2 n GLU 34 Ca -0.08 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2nr2 n GLU 34 Cb 0.33 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 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 1.61 0.80 3.57 0.62 0.00 -0.86 -5.01 105.19 105.93 2nr2 n GLY 35 Ca -0.23 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 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 5.25 0.71 -0.61 1.01 -1.25 -4.96 121.20 119.34 2nr2 s ILE 36 Ca 0.00 0.11 -0.16 0.00 0.00 0.00 0.00 60.65 60.60 2nr2 s ILE 36 Cb 0.00 -3.66 0.02 0.00 0.01 0.00 0.00 42.46 38.83 2nr2 s ILE 36 CO 0.00 0.10 1.24 -2.84 0.00 0.00 0.00 174.94 173.44 2nr2 s PRO 37 N 1.86 2.24 0.00 2.79 0.02 -1.26 -3.93 135.00 136.72 2nr2 s PRO 37 Ca 0.09 1.88 0.06 0.00 0.02 0.00 0.00 61.00 63.05 2nr2 s PRO 37 Cb -0.16 -1.83 0.27 0.00 0.02 0.00 0.00 34.50 32.80 2nr2 s PRO 37 CO 0.11 -1.79 1.19 -0.35 -0.33 0.00 0.00 177.00 175.83 2nr2 n PRO 38 N -2.46 1.15 -0.03 5.54 -0.04 -1.26 -2.51 135.00 135.39 2nr2 n PRO 38 Ca 0.14 -0.23 -0.16 0.00 -0.04 0.00 0.00 63.50 63.21 2nr2 n PRO 38 Cb 0.49 -1.11 -0.09 0.00 -0.04 0.00 0.00 33.50 32.76 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2nr2 h ASP 39 N 0.40 0.56 0.86 3.54 3.32 -1.98 -3.34 116.42 119.78 2nr2 h ASP 39 Ca 0.00 -0.64 -0.08 0.00 0.02 0.00 0.00 57.03 56.32 2nr2 h ASP 39 Cb 0.09 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2nr2 h ASP 39 CO 0.00 1.11 -0.40 -0.61 -1.72 0.00 0.00 179.24 177.62 2nr2 h GLN 40 N 0.05 0.00 -6.11 3.56 4.15 -1.85 -3.46 115.11 111.45 2nr2 h GLN 40 Ca -0.03 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.83 2nr2 h GLN 40 Cb 1.10 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.74 2nr2 h GLN 40 CO 0.09 0.40 0.06 -0.65 -1.93 0.00 0.00 178.83 176.80 2nr2 s GLN 41 N -3.57 4.40 0.07 1.69 -0.21 -1.24 -1.67 119.66 119.13 2nr2 s GLN 41 Ca 0.00 0.85 0.08 0.00 0.02 0.00 0.00 55.36 56.31 2nr2 s GLN 41 Cb 0.11 -3.38 -0.03 0.00 1.00 0.00 0.00 33.01 30.71 2nr2 s GLN 41 CO 0.70 0.25 -0.21 1.03 -2.12 0.00 0.00 175.29 174.93 2nr2 s ARG 42 N 0.17 1.30 -0.07 2.91 0.52 -0.29 -4.99 118.95 118.50 2nr2 s ARG 42 Ca 0.35 -1.04 0.02 0.00 -0.52 0.00 0.00 55.73 54.54 2nr2 s ARG 42 Cb -0.19 -1.48 0.02 0.00 0.52 0.00 0.00 34.95 33.82 2nr2 s ARG 42 CO 0.19 0.36 -0.11 -0.51 0.02 0.00 0.00 175.30 175.25 2nr2 s LEU 43 N -1.47 1.53 -0.21 2.53 1.43 -1.26 -0.28 118.68 120.96 2nr2 s LEU 43 Ca 0.07 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 2nr2 s LEU 43 Cb -0.09 -0.80 0.04 0.00 0.03 0.00 0.00 46.19 45.37 2nr2 s LEU 43 CO 0.03 -0.00 -0.15 -0.63 0.23 0.00 0.00 176.35 175.83 2nr2 s ILE 44 N 0.88 2.00 -0.31 -0.59 1.01 0.63 -1.96 121.20 122.85 2nr2 s ILE 44 Ca -0.11 -1.17 -0.11 0.00 0.00 0.00 0.00 60.65 59.26 2nr2 s ILE 44 Cb -0.15 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 2nr2 s ILE 44 CO 0.01 0.28 0.19 0.12 0.00 0.00 0.00 174.94 175.54 2nr2 s PHE 45 N 1.26 3.20 0.00 3.97 5.36 0.04 -0.56 117.98 131.25 2nr2 s PHE 45 Ca -0.01 -0.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.77 2nr2 s PHE 45 Cb -0.16 -2.40 0.00 0.00 -0.34 0.00 0.00 43.02 40.12 2nr2 s PHE 45 CO -0.09 -0.31 0.00 0.00 -1.46 0.00 0.00 175.22 173.35 2nr2 n ALA 46 N 5.05 0.00 0.00 11.12 0.00 -1.26 -2.25 120.51 133.16 2nr2 n ALA 46 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2nr2 n ALA 46 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 0.14 3.69 0.00 0.00 -1.26 -5.13 105.19 102.63 2nr2 n GLY 47 Ca 0.00 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 4.33 0.11 1.61 1.02 -0.96 -4.97 119.74 120.88 2nr2 s LYS 48 Ca 0.00 1.81 -0.27 0.00 0.02 0.00 0.00 55.97 57.53 2nr2 s LYS 48 Cb 0.00 -3.53 -0.06 0.00 -0.52 0.00 0.00 37.83 33.72 2nr2 s LYS 48 CO 0.00 -0.47 0.84 -1.14 -0.92 0.00 0.00 175.35 173.66 2nr2 s GLN 49 N 2.10 4.61 -0.18 1.68 0.74 -1.26 -0.78 119.66 126.57 2nr2 s GLN 49 Ca 0.59 1.24 -0.09 0.00 0.05 0.00 0.00 55.36 57.15 2nr2 s GLN 49 Cb -0.28 -3.34 -0.05 0.00 1.10 0.00 0.00 33.01 30.45 2nr2 s GLN 49 CO 0.25 0.35 0.14 -0.51 -0.55 0.00 0.00 175.29 174.97 2nr2 s LEU 50 N -0.40 4.26 0.27 3.68 1.43 -0.83 -4.99 118.68 122.10 2nr2 s LEU 50 Ca 0.40 0.30 -0.29 0.00 -1.03 0.00 0.00 54.13 53.52 2nr2 s LEU 50 Cb -0.22 -2.09 -0.09 0.00 0.03 0.00 0.00 46.19 43.81 2nr2 s LEU 50 CO 0.27 0.24 0.96 -1.61 0.23 0.00 0.00 176.35 176.43 2nr2 s GLU 51 N 0.01 4.74 0.12 1.70 0.41 -1.26 -4.75 118.70 119.67 2nr2 s GLU 51 Ca 0.10 1.49 -0.31 0.00 -0.41 0.00 0.00 54.97 55.84 2nr2 s GLU 51 Cb -0.11 -3.13 -0.10 0.00 -1.78 0.00 0.00 34.13 29.02 2nr2 s GLU 51 CO -0.00 0.40 1.58 -0.44 -0.49 0.00 0.00 175.26 176.31 2nr2 h ASP 52 N 3.81 -1.30 -0.01 -0.19 5.19 -1.97 -2.91 116.42 119.04 2nr2 h ASP 52 Ca -0.46 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.10 2nr2 h ASP 52 Cb 1.20 0.50 0.00 0.00 0.18 0.00 0.00 39.33 41.21 2nr2 h ASP 52 CO 0.67 -0.48 0.00 0.61 -3.12 0.00 0.00 179.24 176.92 2nr2 n GLY 53 N -1.46 0.65 3.91 2.75 0.00 -1.26 -0.98 105.19 108.80 2nr2 n GLY 53 Ca -0.07 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.37 3.03 0.62 1.61 1.81 -1.10 -4.94 118.95 118.61 2nr2 s ARG 54 Ca 0.01 0.11 -0.02 0.00 -1.72 0.00 0.00 55.73 54.11 2nr2 s ARG 54 Cb 0.01 -2.25 0.04 0.00 -0.45 0.00 0.00 34.95 32.30 2nr2 s ARG 54 CO 0.00 -0.66 0.88 0.95 -0.68 0.00 0.00 175.30 175.79 2nr2 s THR 55 N -3.01 2.57 0.07 0.02 -4.23 -1.26 -1.47 115.64 108.34 2nr2 s THR 55 Ca 0.53 -0.47 -0.21 0.00 -1.18 0.00 0.00 61.69 60.37 2nr2 s THR 55 Cb -0.11 -3.03 -0.11 0.00 1.34 0.00 0.00 72.50 70.59 2nr2 s THR 55 CO 0.46 -0.03 1.56 -0.07 -0.54 0.00 0.00 174.62 176.01 2nr2 h LEU 56 N -0.22 0.24 -1.30 4.79 3.38 -1.54 -3.14 115.31 117.52 2nr2 h LEU 56 Ca -0.43 -0.23 0.06 0.00 0.09 0.00 0.00 57.88 57.37 2nr2 h LEU 56 Cb 1.30 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 2nr2 h LEU 56 CO 0.56 0.41 0.51 0.28 0.09 0.00 0.00 178.44 180.29 2nr2 h SER 57 N 0.06 0.75 0.38 -0.43 0.02 -1.78 -2.25 113.55 110.30 2nr2 h SER 57 Ca 0.05 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2nr2 h SER 57 Cb 0.26 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2nr2 h SER 57 CO 0.00 0.49 -0.18 0.44 -1.14 0.00 0.00 176.83 176.43 2nr2 h ASP 58 N 0.85 -0.44 0.27 3.07 3.32 -1.87 -2.71 116.42 118.93 2nr2 h ASP 58 Ca 0.33 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2nr2 h ASP 58 Cb 0.22 0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2nr2 h ASP 58 CO -0.11 -0.20 0.00 -1.22 -1.72 0.00 0.00 179.24 175.98 2nr2 n TYR 59 N -5.26 0.39 -2.53 4.55 4.01 -1.19 -4.93 117.16 112.21 2nr2 n TYR 59 Ca -0.11 0.18 -0.08 0.00 -0.16 0.00 0.00 57.90 57.73 2nr2 n TYR 59 Cb 0.26 -0.79 0.04 0.00 -0.31 0.00 0.00 39.34 38.54 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 -1.88 -3.51 -4.71 7.72 4.13 -0.92 -5.03 115.26 111.06 2nr2 n ASN 60 Ca 0.01 -0.35 -0.37 0.00 1.68 0.00 0.00 54.58 55.55 2nr2 n ASN 60 Cb 0.10 -2.92 -0.07 0.00 -1.54 0.00 0.00 39.78 35.34 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 -3.20 5.27 0.67 2.41 1.01 -0.89 -5.04 121.20 121.43 2nr2 s ILE 61 Ca 0.15 0.59 -0.11 0.00 0.00 0.00 0.00 60.65 61.28 2nr2 s ILE 61 Cb -0.02 -3.66 -0.00 0.00 0.01 0.00 0.00 42.46 38.78 2nr2 s ILE 61 CO 0.38 0.34 1.05 -1.10 0.00 0.00 0.00 174.94 175.62 2nr2 s GLN 62 N 0.75 3.09 0.41 2.79 -0.21 -1.26 -4.75 119.66 120.48 2nr2 s GLN 62 Ca 0.17 0.95 0.16 0.00 0.02 0.00 0.00 55.36 56.66 2nr2 s GLN 62 Cb -0.14 -2.01 1.05 0.00 1.00 0.00 0.00 33.01 32.91 2nr2 s GLN 62 CO 0.05 -0.98 1.86 0.87 -2.12 0.00 0.00 175.29 174.97 2nr2 h LYS 63 N -0.53 0.43 -2.95 2.91 1.57 -1.97 -3.30 116.57 112.73 2nr2 h LYS 63 Ca -0.44 -0.03 -0.61 0.00 -1.87 0.00 0.00 60.65 57.70 2nr2 h LYS 63 Cb 1.21 -0.10 -0.40 0.00 0.08 0.00 0.00 32.23 33.02 2nr2 h LYS 63 CO 0.58 0.28 -0.73 -2.00 -0.57 0.00 0.00 179.45 177.01 2nr2 s GLU 64 N -5.46 1.53 0.35 3.15 2.12 -1.26 -3.83 118.70 115.30 2nr2 s GLU 64 Ca -0.08 -2.35 0.03 0.00 0.36 0.00 0.00 54.97 52.93 2nr2 s GLU 64 Cb 0.23 -2.51 -0.05 0.00 0.26 0.00 0.00 34.13 32.06 2nr2 s GLU 64 CO 0.78 -1.22 0.09 0.45 -0.54 0.00 0.00 175.26 174.82 2nr2 s SER 65 N -0.12 2.38 -0.08 -1.70 0.15 -1.25 -5.03 113.70 108.06 2nr2 s SER 65 Ca 0.21 -1.48 0.01 0.00 0.70 0.00 0.00 55.95 55.39 2nr2 s SER 65 Cb -0.16 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.32 2nr2 s SER 65 CO -0.06 -0.74 -0.08 -0.89 1.20 0.00 0.00 173.24 172.67 2nr2 s THR 66 N -3.32 0.94 -0.00 6.45 2.01 -1.26 -1.25 115.64 119.20 2nr2 s THR 66 Ca 0.32 -0.31 -0.00 0.00 0.31 0.00 0.00 61.69 62.01 2nr2 s THR 66 Cb 0.06 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 2nr2 s THR 66 CO 0.15 0.33 0.09 -0.76 -0.69 0.00 0.00 174.62 173.74 2nr2 s LEU 67 N 1.16 3.93 -0.23 4.42 1.43 -0.19 -4.67 118.68 124.53 2nr2 s LEU 67 Ca -0.06 0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.13 2nr2 s LEU 67 Cb -0.14 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 2nr2 s LEU 67 CO -0.02 0.27 0.06 -1.00 0.23 0.00 0.00 176.35 175.89 2nr2 s HIS 68 N -1.21 3.10 -0.28 0.29 3.76 0.28 -1.70 115.29 119.53 2nr2 s HIS 68 Ca 0.23 -0.35 -0.20 0.00 -0.15 0.00 0.00 55.06 54.59 2nr2 s HIS 68 Cb -0.12 -2.19 -0.01 0.00 1.11 0.00 0.00 32.58 31.36 2nr2 s HIS 68 CO 0.15 -0.27 0.62 -1.17 -0.85 0.00 0.00 174.74 173.22 2nr2 s LEU 69 N 1.35 4.10 0.11 0.89 2.96 0.17 -0.27 118.68 127.99 2nr2 s LEU 69 Ca 0.05 0.55 0.10 0.00 -0.22 0.00 0.00 54.13 54.61 2nr2 s LEU 69 Cb -0.15 -2.82 -0.04 0.00 0.50 0.00 0.00 46.19 43.69 2nr2 s LEU 69 CO 0.03 -0.42 -0.25 -0.69 -1.32 0.00 0.00 176.35 173.70 2nr2 s VAL 70 N 2.54 2.35 0.14 1.68 1.01 0.61 -4.11 120.40 124.61 2nr2 s VAL 70 Ca 0.25 -1.64 0.10 0.00 0.00 0.00 0.00 61.98 60.69 2nr2 s VAL 70 Cb -0.15 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 2nr2 s VAL 70 CO 0.10 0.15 -0.23 -0.76 0.00 0.00 0.00 175.10 174.36 2nr2 s LEU 71 N -1.92 2.35 0.98 3.92 1.43 -1.26 -1.13 118.68 123.05 2nr2 s LEU 71 Ca 0.14 -0.77 -0.16 0.00 -1.03 0.00 0.00 54.13 52.32 2nr2 s LEU 71 Cb -0.10 -1.04 0.22 0.00 0.03 0.00 0.00 46.19 45.30 2nr2 s LEU 71 CO 0.06 0.10 1.34 -0.13 0.23 0.00 0.00 176.35 177.94 2nr2 s ARG 72 N -2.23 0.41 0.66 1.70 0.52 -0.67 -4.98 118.95 114.36 2nr2 s ARG 72 Ca 0.13 -0.58 -0.15 0.00 -0.52 0.00 0.00 55.73 54.61 2nr2 s ARG 72 Cb -0.09 -1.85 -0.00 0.00 0.52 0.00 0.00 34.95 33.52 2nr2 s ARG 72 CO 0.06 -2.54 1.11 -0.51 0.02 0.00 0.00 175.30 173.44 2nr2 s LEU 73 N -5.91 3.40 -0.14 2.53 1.43 -1.26 -4.99 118.68 113.73 2nr2 s LEU 73 Ca 0.76 2.01 -0.29 0.00 -1.03 0.00 0.00 54.13 55.57 2nr2 s LEU 73 Cb -0.02 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.64 2nr2 s LEU 73 CO 0.53 -1.62 1.09 -0.60 0.23 0.00 0.00 176.35 175.98 2nr2 s ARG 74 N -4.07 4.34 -0.92 1.70 3.52 -1.26 -2.49 118.95 119.77 2nr2 s ARG 74 Ca 0.67 1.48 -0.01 0.00 -0.13 0.00 0.00 55.73 57.74 2nr2 s ARG 74 Cb -0.21 -3.60 -0.01 0.00 -1.56 0.00 0.00 34.95 29.57 2nr2 s ARG 74 CO 0.41 -0.48 0.77 0.41 -0.81 0.00 0.00 175.30 175.60 2nr2 n GLY 75 N 3.28 -0.27 0.00 8.12 0.00 -1.26 -5.25 105.19 109.80 2nr2 n GLY 75 Ca 0.11 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93