#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 4.11 0.41 3.17 0.74 -1.26 -0.93 119.66 125.89 2nr2 s GLN 2 Ca 0.00 -0.27 0.04 0.00 0.05 0.00 0.00 55.36 55.18 2nr2 s GLN 2 Cb 0.00 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 2nr2 s GLN 2 CO 0.00 0.27 0.06 0.96 -0.55 0.00 0.00 175.29 176.03 2nr2 s ILE 3 N 0.44 1.13 -0.01 -2.34 -4.36 -1.00 -0.50 121.20 114.56 2nr2 s ILE 3 Ca 0.06 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.53 2nr2 s ILE 3 Cb -0.12 -2.54 -0.02 0.00 1.25 0.00 0.00 42.46 41.03 2nr2 s ILE 3 CO -0.01 0.00 -0.26 -0.36 0.24 0.00 0.00 174.94 174.56 2nr2 s PHE 4 N -3.08 2.34 -0.15 1.37 0.08 0.21 -2.21 117.98 116.55 2nr2 s PHE 4 Ca 0.25 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.88 2nr2 s PHE 4 Cb 0.05 -1.48 0.02 0.00 -0.57 0.00 0.00 43.02 41.04 2nr2 s PHE 4 CO 0.13 0.00 -0.13 0.08 -0.10 0.00 0.00 175.22 175.20 2nr2 s VAL 5 N -0.66 1.53 -0.18 -0.44 1.01 -0.42 -0.43 120.40 120.80 2nr2 s VAL 5 Ca 0.10 -0.63 -0.15 0.00 0.00 0.00 0.00 61.98 61.31 2nr2 s VAL 5 Cb -0.10 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2nr2 s VAL 5 CO -0.00 0.43 0.34 -0.75 0.00 0.00 0.00 175.10 175.12 2nr2 s LYS 6 N 1.50 4.21 0.00 2.72 2.20 0.72 0.26 119.74 131.36 2nr2 s LYS 6 Ca 0.05 0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.79 2nr2 s LYS 6 Cb -0.13 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2nr2 s LYS 6 CO -0.10 0.09 0.00 0.25 -0.36 0.00 0.00 175.35 175.22 2nr2 n THR 7 N 4.01 0.00 0.05 3.43 -2.24 -0.08 0.06 114.28 119.50 2nr2 n THR 7 Ca -0.10 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.47 2nr2 n THR 7 Cb 0.51 -1.34 -0.14 0.00 -2.10 0.00 0.00 70.33 67.26 2nr2 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 8 N 0.00 0.48 -1.65 3.22 3.38 -1.88 -3.37 115.31 115.50 2nr2 h LEU 8 Ca 0.00 -0.82 -0.04 0.00 0.09 0.00 0.00 57.88 57.11 2nr2 h LEU 8 Cb 0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2nr2 h LEU 8 CO 0.00 1.70 -0.20 0.71 0.09 0.00 0.00 178.44 180.74 2nr2 h THR 9 N 0.08 0.88 0.00 0.22 1.35 -1.94 -3.46 112.91 110.04 2nr2 h THR 9 Ca -0.35 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 2nr2 h THR 9 Cb 2.06 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.92 2nr2 h THR 9 CO 0.14 0.20 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 2nr2 n GLY 10 N -0.68 1.77 3.63 5.82 0.00 -1.26 -5.12 105.19 109.35 2nr2 n GLY 10 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.10 3.03 -0.42 1.61 2.20 -1.26 -4.93 119.74 119.87 2nr2 s LYS 11 Ca 0.00 -0.46 -0.20 0.00 -0.36 0.00 0.00 55.97 54.96 2nr2 s LYS 11 Cb 0.00 -2.76 0.02 0.00 -1.51 0.00 0.00 37.83 33.57 2nr2 s LYS 11 CO 0.00 0.63 0.59 0.99 -0.36 0.00 0.00 175.35 177.19 2nr2 s THR 12 N -0.68 4.91 0.02 3.43 2.01 -1.26 -0.90 115.64 123.15 2nr2 s THR 12 Ca 0.11 0.10 -0.19 0.00 0.31 0.00 0.00 61.69 62.01 2nr2 s THR 12 Cb -0.12 -4.13 -0.06 0.00 0.01 0.00 0.00 72.50 68.20 2nr2 s THR 12 CO 0.02 -0.49 0.55 -0.63 -0.69 0.00 0.00 174.62 173.38 2nr2 s ILE 13 N 2.63 4.88 -0.20 1.82 1.01 0.14 -4.90 121.20 126.58 2nr2 s ILE 13 Ca 0.20 1.16 -0.10 0.00 0.00 0.00 0.00 60.65 61.91 2nr2 s ILE 13 Cb -0.15 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.39 2nr2 s ILE 13 CO 0.17 0.48 0.13 -0.89 0.00 0.00 0.00 174.94 174.83 2nr2 s THR 14 N -0.60 5.35 0.13 2.92 2.01 -1.26 -1.31 115.64 122.88 2nr2 s THR 14 Ca 0.29 0.17 0.06 0.00 0.31 0.00 0.00 61.69 62.52 2nr2 s THR 14 Cb -0.18 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2nr2 s THR 14 CO 0.17 0.43 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.63 2nr2 s LEU 15 N 0.43 2.42 -0.27 4.42 1.43 -0.94 -5.01 118.68 121.16 2nr2 s LEU 15 Ca 0.08 -0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 52.33 2nr2 s LEU 15 Cb -0.11 -0.54 0.04 0.00 0.03 0.00 0.00 46.19 45.61 2nr2 s LEU 15 CO -0.01 -0.16 -0.05 -1.61 0.23 0.00 0.00 176.35 174.74 2nr2 s GLU 16 N -2.81 2.56 0.16 1.70 2.02 -1.26 -2.36 118.70 118.69 2nr2 s GLU 16 Ca 0.10 -1.16 0.08 0.00 0.02 0.00 0.00 54.97 54.01 2nr2 s GLU 16 Cb -0.04 -3.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.12 2nr2 s GLU 16 CO 0.03 -0.51 -0.17 0.14 0.02 0.00 0.00 175.26 174.77 2nr2 s VAL 17 N 1.25 1.68 0.24 2.63 -7.23 -0.11 -4.94 120.40 113.91 2nr2 s VAL 17 Ca -0.04 -1.89 0.06 0.00 -1.81 0.00 0.00 61.98 58.30 2nr2 s VAL 17 Cb -0.18 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 34.94 2nr2 s VAL 17 CO -0.04 -0.37 0.26 -1.61 -0.31 0.00 0.00 175.10 173.04 2nr2 s GLU 18 N -2.84 3.15 0.57 4.82 0.41 -1.26 -0.04 118.70 123.50 2nr2 s GLU 18 Ca 0.14 -0.91 0.35 0.00 -0.41 0.00 0.00 54.97 54.14 2nr2 s GLU 18 Cb -0.05 -2.71 1.57 0.00 -1.78 0.00 0.00 34.13 31.15 2nr2 s GLU 18 CO 0.06 0.42 2.06 -1.00 -0.49 0.00 0.00 175.26 176.31 2nr2 h PRO 19 N 1.44 0.00 -0.08 0.39 0.13 -1.95 -0.70 132.00 131.23 2nr2 h PRO 19 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2nr2 h PRO 19 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2nr2 h PRO 19 CO 0.61 0.03 0.00 -1.13 -0.23 0.00 0.00 178.00 177.28 2nr2 n SER 20 N -3.17 0.82 -4.75 1.44 3.41 -1.26 -1.60 113.62 108.52 2nr2 n SER 20 Ca -0.00 -1.58 -0.41 0.00 -0.26 0.00 0.00 58.87 56.62 2nr2 n SER 20 Cb 0.26 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 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 -1.55 7.32 0.48 4.04 1.01 -0.27 -4.92 116.67 122.78 2nr2 s ASP 21 Ca 0.29 2.15 -0.06 0.00 0.71 0.00 0.00 52.55 55.65 2nr2 s ASP 21 Cb 0.15 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.42 2nr2 s ASP 21 CO 0.23 -0.14 0.79 0.42 0.21 0.00 0.00 175.17 176.69 2nr2 s THR 22 N -0.77 4.90 0.33 -1.27 -4.23 -1.26 -2.29 115.64 111.05 2nr2 s THR 22 Ca 0.46 0.24 0.00 0.00 -1.18 0.00 0.00 61.69 61.21 2nr2 s THR 22 Cb -0.30 -3.86 0.26 0.00 1.34 0.00 0.00 72.50 69.93 2nr2 s THR 22 CO 0.37 -0.85 1.98 0.40 -0.54 0.00 0.00 174.62 175.99 2nr2 h ILE 23 N 0.24 1.19 -0.62 2.99 1.08 -0.51 0.24 117.51 122.11 2nr2 h ILE 23 Ca -0.47 -0.36 0.12 0.00 -0.39 0.00 0.00 64.86 63.76 2nr2 h ILE 23 Cb 1.20 0.17 -0.12 0.00 -3.07 0.00 0.00 36.82 35.00 2nr2 h ILE 23 CO 0.62 0.18 -0.18 -0.08 -0.69 0.00 0.00 178.15 178.00 2nr2 h GLU 24 N 0.95 -0.03 -0.12 2.37 4.81 -1.29 0.21 114.58 121.48 2nr2 h GLU 24 Ca 0.25 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.38 2nr2 h GLU 24 Cb -0.09 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2nr2 h GLU 24 CO -0.05 -0.02 -0.40 -0.91 -0.73 0.00 0.00 179.01 176.90 2nr2 h ASN 25 N -0.03 0.28 -0.43 1.04 2.35 -0.95 -0.70 115.58 117.14 2nr2 h ASN 25 Ca 0.29 -0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.81 2nr2 h ASN 25 Cb 0.48 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 2nr2 h ASN 25 CO -0.66 0.66 -0.17 0.58 -1.65 0.00 0.00 177.43 176.19 2nr2 h VAL 26 N 0.23 1.27 -0.79 2.81 2.07 0.40 0.50 116.25 122.74 2nr2 h VAL 26 Ca 0.02 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 2nr2 h VAL 26 Cb 0.81 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 2nr2 h VAL 26 CO 0.06 0.45 0.42 0.11 0.02 0.00 0.00 177.57 178.64 2nr2 h LYS 27 N 0.81 1.10 0.00 1.57 1.57 -0.19 0.26 116.57 121.70 2nr2 h LYS 27 Ca 0.12 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2nr2 h LYS 27 Cb 0.72 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2nr2 h LYS 27 CO 0.06 0.81 -0.46 0.00 -0.57 0.00 0.00 179.45 179.29 2nr2 h ALA 28 N 1.36 0.83 -0.08 3.86 0.00 -0.59 -1.29 119.26 123.35 2nr2 h ALA 28 Ca 0.28 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 2nr2 h ALA 28 Cb 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2nr2 h ALA 28 CO -0.04 0.57 -0.66 0.87 0.00 0.00 0.00 179.25 179.99 2nr2 h LYS 29 N 0.00 0.34 -0.10 0.00 1.79 -0.41 -0.68 116.57 117.51 2nr2 h LYS 29 Ca -0.00 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 2nr2 h LYS 29 Cb 1.14 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.83 2nr2 h LYS 29 CO 0.06 0.88 0.02 0.82 -1.08 0.00 0.00 179.45 180.15 2nr2 h ILE 30 N 0.24 1.20 -0.77 1.86 2.04 -0.79 -0.91 117.51 120.38 2nr2 h ILE 30 Ca -0.01 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.29 2nr2 h ILE 30 Cb 1.20 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 38.64 2nr2 h ILE 30 CO 0.11 0.18 0.45 -0.61 0.00 0.00 0.00 178.15 178.28 2nr2 h GLN 31 N -0.05 0.79 -0.50 2.37 4.15 -1.13 0.46 115.11 121.21 2nr2 h GLN 31 Ca 0.03 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.48 2nr2 h GLN 31 Cb 0.26 -0.18 -0.07 0.00 0.21 0.00 0.00 27.48 27.70 2nr2 h GLN 31 CO 0.00 0.52 0.12 0.22 -1.93 0.00 0.00 178.83 177.76 2nr2 h ASP 32 N 0.82 0.04 0.12 -0.69 3.58 -0.99 -1.92 116.42 117.38 2nr2 h ASP 32 Ca 0.35 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.87 2nr2 h ASP 32 Cb 0.21 0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.37 2nr2 h ASP 32 CO -0.19 0.05 -0.06 0.50 -2.88 0.00 0.00 179.24 176.66 2nr2 h LYS 33 N 0.26 -0.16 0.00 0.28 1.63 -0.00 -3.40 116.57 115.18 2nr2 h LYS 33 Ca 0.25 0.01 -0.16 0.00 -0.85 0.00 0.00 60.65 59.90 2nr2 h LYS 33 Cb 0.32 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.95 2nr2 h LYS 33 CO -0.31 0.33 -1.60 0.39 -3.45 0.00 0.00 179.45 174.82 2nr2 n GLU 34 N -4.88 2.56 -0.45 1.90 -0.58 0.15 -5.02 120.64 114.32 2nr2 n GLU 34 Ca -0.08 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2nr2 n GLU 34 Cb 0.28 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 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 2.47 1.11 3.73 0.62 0.00 -0.72 -5.01 105.19 107.38 2nr2 n GLY 35 Ca -0.14 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.16 5.35 0.68 -0.61 1.01 -1.26 -4.94 121.20 119.28 2nr2 s ILE 36 Ca 0.00 0.40 -0.15 0.00 0.00 0.00 0.00 60.65 60.89 2nr2 s ILE 36 Cb 0.00 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.92 2nr2 s ILE 36 CO 0.00 0.42 1.16 -2.84 0.00 0.00 0.00 174.94 173.68 2nr2 s PRO 37 N 0.38 2.54 0.54 2.79 0.02 -1.26 -3.81 135.00 136.20 2nr2 s PRO 37 Ca 0.13 1.60 0.30 0.00 0.02 0.00 0.00 61.00 63.05 2nr2 s PRO 37 Cb -0.12 -1.90 1.52 0.00 0.02 0.00 0.00 34.50 34.02 2nr2 s PRO 37 CO 0.02 -1.49 2.08 -1.35 -0.33 0.00 0.00 177.00 175.92 2nr2 h PRO 38 N 0.01 0.00 -0.20 5.54 0.11 -1.96 -3.08 132.00 132.41 2nr2 h PRO 38 Ca -0.48 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 2nr2 h PRO 38 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2nr2 h PRO 38 CO 0.52 0.09 -0.38 0.38 -0.21 0.00 0.00 178.00 178.40 2nr2 h ASP 39 N 0.00 0.47 0.88 -2.05 3.04 -1.98 -3.15 116.42 113.63 2nr2 h ASP 39 Ca -0.00 -0.20 0.00 0.00 -3.24 0.00 0.00 57.03 53.59 2nr2 h ASP 39 Cb 0.35 -0.13 0.00 0.00 -1.04 0.00 0.00 39.33 38.51 2nr2 h ASP 39 CO 0.01 0.81 0.00 0.00 -2.04 0.00 0.00 179.24 178.03 2nr2 n GLN 40 N -4.04 0.13 -3.50 4.15 6.02 -1.16 -4.78 117.38 114.20 2nr2 n GLN 40 Ca -0.01 0.27 -0.39 0.00 -0.01 0.00 0.00 57.00 56.85 2nr2 n GLN 40 Cb 0.49 -1.71 -0.10 0.00 1.02 0.00 0.00 30.24 29.94 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nr2 s GLN 41 N -3.14 3.79 -0.31 -1.09 -0.21 -1.19 -0.66 119.66 116.84 2nr2 s GLN 41 Ca 0.08 -0.34 -0.08 0.00 0.02 0.00 0.00 55.36 55.03 2nr2 s GLN 41 Cb 0.12 -3.72 0.01 0.00 1.00 0.00 0.00 33.01 30.41 2nr2 s GLN 41 CO 0.43 -0.32 0.12 1.03 -2.12 0.00 0.00 175.29 174.42 2nr2 s ARG 42 N 1.86 3.15 -0.43 2.91 0.52 -0.33 -4.98 118.95 121.65 2nr2 s ARG 42 Ca 0.09 -0.83 -0.16 0.00 -0.52 0.00 0.00 55.73 54.31 2nr2 s ARG 42 Cb -0.16 -3.48 0.03 0.00 0.52 0.00 0.00 34.95 31.86 2nr2 s ARG 42 CO 0.11 -0.46 0.39 -0.51 0.02 0.00 0.00 175.30 174.85 2nr2 s LEU 43 N 1.54 5.02 -0.38 2.53 1.43 -1.26 -0.78 118.68 126.79 2nr2 s LEU 43 Ca 0.03 -0.82 -0.14 0.00 -1.03 0.00 0.00 54.13 52.18 2nr2 s LEU 43 Cb -0.17 -2.29 0.01 0.00 0.03 0.00 0.00 46.19 43.76 2nr2 s LEU 43 CO 0.04 -0.55 0.27 -0.63 0.23 0.00 0.00 176.35 175.70 2nr2 s ILE 44 N 1.96 5.20 -0.22 -0.59 1.01 -0.66 -0.80 121.20 127.09 2nr2 s ILE 44 Ca 0.09 -0.50 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 2nr2 s ILE 44 Cb -0.18 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 2nr2 s ILE 44 CO 0.12 -0.18 0.06 0.12 0.00 0.00 0.00 174.94 175.06 2nr2 s PHE 45 N 1.68 3.12 0.00 3.97 5.36 -0.02 -1.13 117.98 130.96 2nr2 s PHE 45 Ca 0.05 -0.26 0.00 0.00 -0.96 0.00 0.00 56.93 55.76 2nr2 s PHE 45 Cb -0.18 -2.17 0.00 0.00 -0.34 0.00 0.00 43.02 40.33 2nr2 s PHE 45 CO 0.10 -0.18 0.00 0.00 -1.46 0.00 0.00 175.22 173.68 2nr2 n ALA 46 N 4.40 0.00 -0.21 11.12 0.00 -1.26 -1.23 120.51 133.33 2nr2 n ALA 46 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2nr2 n ALA 46 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 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 0.21 3.68 0.00 0.00 -1.26 -5.12 105.19 102.71 2nr2 n GLY 47 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 4.35 -0.34 1.61 2.20 -0.36 -4.99 119.74 122.20 2nr2 s LYS 48 Ca 0.00 1.09 -0.26 0.00 -0.36 0.00 0.00 55.97 56.44 2nr2 s LYS 48 Cb 0.00 -3.55 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2nr2 s LYS 48 CO 0.00 -0.26 0.92 -1.14 -0.36 0.00 0.00 175.35 174.51 2nr2 s GLN 49 N 1.90 3.92 0.13 4.03 0.74 -1.26 -0.85 119.66 128.27 2nr2 s GLN 49 Ca 0.41 0.68 -0.30 0.00 0.05 0.00 0.00 55.36 56.19 2nr2 s GLN 49 Cb -0.17 -3.77 -0.07 0.00 1.10 0.00 0.00 33.01 30.10 2nr2 s GLN 49 CO 0.15 -0.87 1.11 -0.51 -0.55 0.00 0.00 175.29 174.63 2nr2 s LEU 50 N 3.37 4.45 0.32 3.68 1.43 0.02 -5.00 118.68 126.94 2nr2 s LEU 50 Ca 0.38 2.03 -0.12 0.00 -1.03 0.00 0.00 54.13 55.39 2nr2 s LEU 50 Cb -0.13 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.42 2nr2 s LEU 50 CO 0.16 -0.29 0.70 -1.61 0.23 0.00 0.00 176.35 175.55 2nr2 s GLU 51 N 0.11 3.89 0.11 1.70 2.02 -1.26 -4.69 118.70 120.58 2nr2 s GLU 51 Ca 0.52 0.51 -0.16 0.00 0.02 0.00 0.00 54.97 55.86 2nr2 s GLU 51 Cb -0.29 -2.47 -0.05 0.00 0.10 0.00 0.00 34.13 31.42 2nr2 s GLU 51 CO 0.33 0.14 1.55 -0.44 0.02 0.00 0.00 175.26 176.85 2nr2 h ASP 52 N 2.03 0.57 -1.84 -0.19 3.32 -1.97 -2.98 116.42 115.35 2nr2 h ASP 52 Ca -0.47 -0.31 -0.73 0.00 0.02 0.00 0.00 57.03 55.54 2nr2 h ASP 52 Cb 1.18 -0.15 -0.25 0.00 0.22 0.00 0.00 39.33 40.32 2nr2 h ASP 52 CO 0.66 0.74 0.98 0.61 -1.72 0.00 0.00 179.24 180.51 2nr2 n GLY 53 N -0.34 5.37 3.43 2.75 0.00 -1.26 -0.96 105.19 114.19 2nr2 n GLY 53 Ca -0.02 -2.38 -0.22 0.00 0.00 0.00 0.00 46.02 43.40 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 -3.63 1.55 0.46 1.61 1.81 -1.13 -4.98 118.95 114.64 2nr2 s ARG 54 Ca 0.52 -1.74 0.07 0.00 -1.72 0.00 0.00 55.73 52.86 2nr2 s ARG 54 Cb 0.40 -1.40 -0.00 0.00 -0.45 0.00 0.00 34.95 33.50 2nr2 s ARG 54 CO -0.35 0.18 0.39 0.95 -0.68 0.00 0.00 175.30 175.79 2nr2 s THR 55 N -2.80 2.34 0.27 0.02 -4.23 -1.26 -0.15 115.64 109.83 2nr2 s THR 55 Ca 0.28 -1.39 -0.04 0.00 -1.18 0.00 0.00 61.69 59.36 2nr2 s THR 55 Cb -0.00 -2.74 0.20 0.00 1.34 0.00 0.00 72.50 71.29 2nr2 s THR 55 CO 0.12 0.00 1.87 -0.07 -0.54 0.00 0.00 174.62 175.99 2nr2 h LEU 56 N 0.95 0.95 -1.29 4.79 3.38 -1.41 -2.77 115.31 119.91 2nr2 h LEU 56 Ca -0.40 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 2nr2 h LEU 56 Cb 1.28 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2nr2 h LEU 56 CO 0.58 0.80 -0.30 -1.28 0.09 0.00 0.00 178.44 178.33 2nr2 h SER 57 N 1.04 0.08 -0.17 -0.43 0.87 -1.53 0.14 113.55 113.55 2nr2 h SER 57 Ca 0.25 -0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.67 2nr2 h SER 57 Cb 0.11 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2nr2 h SER 57 CO -0.03 0.39 -0.35 0.44 -0.53 0.00 0.00 176.83 176.75 2nr2 h ASP 58 N 0.08 0.60 -0.36 6.23 3.32 -1.81 -3.27 116.42 121.21 2nr2 h ASP 58 Ca 0.01 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2nr2 h ASP 58 Cb 0.58 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2nr2 h ASP 58 CO 0.04 1.04 0.00 -1.22 -1.72 0.00 0.00 179.24 177.39 2nr2 n TYR 59 N -4.32 0.48 -4.01 4.55 4.01 -1.06 -4.95 117.16 111.85 2nr2 n TYR 59 Ca -0.06 -0.24 -0.27 0.00 -0.16 0.00 0.00 57.90 57.17 2nr2 n TYR 59 Cb 0.50 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.50 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 0.69 -0.38 -4.58 7.72 3.02 0.18 -4.98 115.26 116.94 2nr2 n ASN 60 Ca 0.15 -1.04 -0.42 0.00 -0.03 0.00 0.00 54.58 53.25 2nr2 n ASN 60 Cb 0.37 -2.87 -0.06 0.00 -0.61 0.00 0.00 39.78 36.61 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 -3.96 4.86 0.00 2.41 1.01 0.26 -5.00 121.20 120.77 2nr2 s ILE 61 Ca 0.06 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.42 2nr2 s ILE 61 Cb -0.03 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.34 2nr2 s ILE 61 CO 0.90 -0.32 0.00 0.00 0.00 0.00 0.00 174.94 175.53 2nr2 n GLN 62 N 6.12 2.03 -1.92 2.79 6.02 -1.26 -4.54 117.38 126.61 2nr2 n GLN 62 Ca -0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 2nr2 n GLN 62 Cb 0.48 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.76 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 -0.57 3.53 -0.73 -1.09 -2.85 -1.26 -2.45 119.74 114.33 2nr2 s LYS 63 Ca 0.00 2.18 0.00 0.00 -1.00 0.00 0.00 55.97 57.15 2nr2 s LYS 63 Cb 0.00 -2.47 0.00 0.00 -2.06 0.00 0.00 37.83 33.30 2nr2 s LYS 63 CO 0.00 -0.86 0.00 0.39 0.10 0.00 0.00 175.35 174.98 2nr2 n GLU 64 N -0.52 -1.10 -3.29 1.78 1.02 0.34 -4.99 120.64 113.89 2nr2 n GLU 64 Ca 0.07 0.65 -0.38 0.00 -0.02 0.00 0.00 57.16 57.48 2nr2 n GLU 64 Cb 0.45 -4.66 -0.06 0.00 -0.02 0.00 0.00 31.44 27.14 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 -2.44 6.92 -0.36 1.62 0.15 -1.02 -4.70 113.70 113.86 2nr2 s SER 65 Ca 0.00 1.09 -0.17 0.00 0.70 0.00 0.00 55.95 57.58 2nr2 s SER 65 Cb 0.00 -2.33 -0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2nr2 s SER 65 CO 0.00 0.16 0.42 -0.89 1.20 0.00 0.00 173.24 174.13 2nr2 s THR 66 N -0.38 5.10 0.19 6.45 2.01 -1.26 -0.62 115.64 127.13 2nr2 s THR 66 Ca 0.29 0.03 -0.03 0.00 0.31 0.00 0.00 61.69 62.29 2nr2 s THR 66 Cb -0.18 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 2nr2 s THR 66 CO 0.16 -0.21 0.40 -0.76 -0.69 0.00 0.00 174.62 173.51 2nr2 s LEU 67 N 2.15 4.23 -0.23 4.42 1.43 0.42 -4.73 118.68 126.38 2nr2 s LEU 67 Ca 0.14 0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 53.69 2nr2 s LEU 67 Cb -0.16 -3.25 -0.00 0.00 0.03 0.00 0.00 46.19 42.80 2nr2 s LEU 67 CO 0.13 -0.02 -0.04 -1.00 0.23 0.00 0.00 176.35 175.64 2nr2 s HIS 68 N -1.81 2.97 -0.32 0.29 3.76 -0.29 -0.20 115.29 119.70 2nr2 s HIS 68 Ca 0.40 -1.00 -0.24 0.00 -0.15 0.00 0.00 55.06 54.07 2nr2 s HIS 68 Cb -0.11 -2.11 0.00 0.00 1.11 0.00 0.00 32.58 31.47 2nr2 s HIS 68 CO 0.28 -0.57 0.80 -1.17 -0.85 0.00 0.00 174.74 173.23 2nr2 s LEU 69 N 1.46 4.09 -0.22 0.89 2.96 0.11 -1.65 118.68 126.32 2nr2 s LEU 69 Ca 0.05 0.62 -0.04 0.00 -0.22 0.00 0.00 54.13 54.54 2nr2 s LEU 69 Cb -0.15 -3.09 -0.01 0.00 0.50 0.00 0.00 46.19 43.45 2nr2 s LEU 69 CO -0.03 -0.65 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.62 2nr2 s VAL 70 N 3.02 3.40 0.17 1.68 1.01 0.04 -3.72 120.40 126.02 2nr2 s VAL 70 Ca 0.33 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 2nr2 s VAL 70 Cb -0.14 -2.56 -0.07 0.00 0.00 0.00 0.00 36.38 33.61 2nr2 s VAL 70 CO 0.14 0.41 0.95 -0.76 0.00 0.00 0.00 175.10 175.84 2nr2 s LEU 71 N 1.48 4.57 -1.12 3.92 1.43 -1.26 -1.18 118.68 126.51 2nr2 s LEU 71 Ca 0.06 1.87 -0.09 0.00 -1.03 0.00 0.00 54.13 54.94 2nr2 s LEU 71 Cb -0.14 -3.60 0.28 0.00 0.03 0.00 0.00 46.19 42.75 2nr2 s LEU 71 CO -0.03 0.04 1.16 -1.14 0.23 0.00 0.00 176.35 176.61 2nr2 n ARG 72 N 2.18 3.60 0.00 1.70 0.63 0.16 -4.88 116.66 120.05 2nr2 n ARG 72 Ca 0.00 -4.43 0.00 0.00 -0.92 0.00 0.00 57.85 52.50 2nr2 n ARG 72 Cb 0.48 -2.57 0.00 0.00 0.45 0.00 0.00 32.46 30.82 2nr2 n ARG 72 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2nr2 n LEU 73 N 2.74 0.00 -4.20 6.15 4.77 -1.26 -4.77 117.00 120.43 2nr2 n LEU 73 Ca 0.25 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 56.00 2nr2 n LEU 73 Cb 0.39 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.34 2nr2 n LEU 73 CO 0.49 0.00 -0.49 -0.13 -1.33 0.00 0.00 177.39 175.93 2nr2 s ARG 74 N 0.61 1.17 0.00 3.23 0.52 -1.26 -4.90 118.95 118.32 2nr2 s ARG 74 Ca 0.00 -0.84 0.00 0.00 -0.52 0.00 0.00 55.73 54.37 2nr2 s ARG 74 Cb 0.00 -1.23 0.00 0.00 0.52 0.00 0.00 34.95 34.24 2nr2 s ARG 74 CO 0.00 0.31 0.00 0.41 0.02 0.00 0.00 175.30 176.04 2nr2 n GLY 75 N 1.91 0.29 0.00 -3.53 0.00 -1.26 -5.20 105.19 97.40 2nr2 n GLY 75 Ca -0.17 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93