#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 3.36 0.15 3.17 -2.07 -1.26 -0.80 119.66 122.21 2nr2 s GLN 2 Ca 0.00 -0.70 0.11 0.00 -1.82 0.00 0.00 55.36 52.95 2nr2 s GLN 2 Cb 0.00 -2.60 -0.04 0.00 -1.09 0.00 0.00 33.01 29.28 2nr2 s GLN 2 CO 0.00 0.21 -0.25 0.96 -1.32 0.00 0.00 175.29 174.89 2nr2 s ILE 3 N 0.34 2.25 -0.24 3.63 -4.36 -0.23 -0.35 121.20 122.24 2nr2 s ILE 3 Ca -0.12 -1.85 -0.05 0.00 -0.26 0.00 0.00 60.65 58.38 2nr2 s ILE 3 Cb -0.16 -2.01 -0.01 0.00 1.25 0.00 0.00 42.46 41.53 2nr2 s ILE 3 CO 0.06 -0.01 -0.01 -0.36 0.24 0.00 0.00 174.94 174.87 2nr2 s PHE 4 N -1.32 3.02 -0.32 1.37 0.08 0.04 -1.41 117.98 119.43 2nr2 s PHE 4 Ca 0.16 -0.90 -0.12 0.00 0.12 0.00 0.00 56.93 56.19 2nr2 s PHE 4 Cb -0.09 -2.15 -0.02 0.00 -0.57 0.00 0.00 43.02 40.19 2nr2 s PHE 4 CO 0.07 -0.53 0.21 0.08 -0.10 0.00 0.00 175.22 174.95 2nr2 s VAL 5 N 1.49 5.07 -0.13 -0.44 1.01 -0.25 -0.21 120.40 126.96 2nr2 s VAL 5 Ca 0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 61.98 61.75 2nr2 s VAL 5 Cb -0.15 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2nr2 s VAL 5 CO -0.01 0.05 0.05 -0.54 0.00 0.00 0.00 175.10 174.65 2nr2 s LYS 6 N 1.69 3.45 0.36 2.72 1.02 -0.39 -2.27 119.74 126.32 2nr2 s LYS 6 Ca 0.06 -0.32 -0.06 0.00 0.02 0.00 0.00 55.97 55.66 2nr2 s LYS 6 Cb -0.17 -3.03 -0.05 0.00 -0.52 0.00 0.00 37.83 34.06 2nr2 s LYS 6 CO 0.09 0.56 0.66 0.95 -0.92 0.00 0.00 175.35 176.69 2nr2 s THR 7 N -0.46 4.94 0.14 2.17 -4.23 0.36 0.02 115.64 118.58 2nr2 s THR 7 Ca 0.10 0.19 -0.15 0.00 -1.18 0.00 0.00 61.69 60.65 2nr2 s THR 7 Cb -0.12 -3.77 0.01 0.00 1.34 0.00 0.00 72.50 69.96 2nr2 s THR 7 CO 0.02 -0.50 1.67 -0.07 -0.54 0.00 0.00 174.62 175.21 2nr2 h LEU 8 N 1.21 0.61 -0.80 4.79 3.38 -1.86 -3.34 115.31 119.30 2nr2 h LEU 8 Ca -0.48 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.23 2nr2 h LEU 8 Cb 1.19 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 2nr2 h LEU 8 CO 0.64 0.63 0.05 0.71 0.09 0.00 0.00 178.44 180.56 2nr2 h THR 9 N 0.55 1.25 0.00 0.22 1.35 -1.94 -3.45 112.91 110.89 2nr2 h THR 9 Ca 0.14 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 2nr2 h THR 9 Cb 0.22 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2nr2 h THR 9 CO -0.01 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.25 2nr2 n GLY 10 N -0.60 0.00 3.89 5.82 0.00 -1.25 -5.16 105.19 107.88 2nr2 n GLY 10 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 3.51 -0.01 1.61 2.47 -1.26 -4.97 119.74 121.09 2nr2 s LYS 11 Ca 0.00 -0.17 0.04 0.00 -1.56 0.00 0.00 55.97 54.27 2nr2 s LYS 11 Cb 0.00 -3.09 -0.01 0.00 -1.46 0.00 0.00 37.83 33.27 2nr2 s LYS 11 CO 0.00 0.67 -0.12 0.99 0.16 0.00 0.00 175.35 177.05 2nr2 s THR 12 N -1.29 0.91 0.08 3.43 2.01 -1.26 -0.48 115.64 119.04 2nr2 s THR 12 Ca 0.26 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.83 2nr2 s THR 12 Cb -0.13 -0.77 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 2nr2 s THR 12 CO 0.16 0.26 -0.14 0.27 -0.69 0.00 0.00 174.62 174.48 2nr2 s ILE 13 N -0.24 1.16 -0.19 1.82 -4.36 -0.96 -5.03 121.20 113.40 2nr2 s ILE 13 Ca 0.04 -1.40 -0.06 0.00 -0.26 0.00 0.00 60.65 58.98 2nr2 s ILE 13 Cb -0.05 -1.17 -0.03 0.00 1.25 0.00 0.00 42.46 42.46 2nr2 s ILE 13 CO -0.00 -0.27 0.01 -0.89 0.24 0.00 0.00 174.94 174.04 2nr2 s THR 14 N -1.46 4.21 -0.11 8.37 2.01 -1.26 -1.09 115.64 126.31 2nr2 s THR 14 Ca 0.00 -0.23 -0.03 0.00 0.31 0.00 0.00 61.69 61.74 2nr2 s THR 14 Cb -0.09 -2.89 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 2nr2 s THR 14 CO 0.02 0.45 0.00 -0.76 -0.69 0.00 0.00 174.62 173.64 2nr2 s LEU 15 N 0.71 3.56 -0.15 4.42 1.43 -0.50 -4.97 118.68 123.18 2nr2 s LEU 15 Ca 0.01 0.09 -0.20 0.00 -1.03 0.00 0.00 54.13 53.00 2nr2 s LEU 15 Cb -0.14 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 2nr2 s LEU 15 CO 0.02 0.32 0.58 -1.61 0.23 0.00 0.00 176.35 175.88 2nr2 s GLU 16 N -0.52 4.28 0.08 1.70 2.02 -1.26 -1.07 118.70 123.94 2nr2 s GLU 16 Ca 0.09 0.57 0.04 0.00 0.02 0.00 0.00 54.97 55.70 2nr2 s GLU 16 Cb -0.12 -3.51 -0.03 0.00 0.10 0.00 0.00 34.13 30.56 2nr2 s GLU 16 CO 0.02 -0.06 -0.12 0.14 0.02 0.00 0.00 175.26 175.26 2nr2 s VAL 17 N 1.32 1.00 -0.01 2.63 -7.23 0.02 -4.96 120.40 113.17 2nr2 s VAL 17 Ca 0.28 -1.43 -0.03 0.00 -1.81 0.00 0.00 61.98 59.00 2nr2 s VAL 17 Cb -0.16 -1.15 -0.04 0.00 0.56 0.00 0.00 36.38 35.59 2nr2 s VAL 17 CO 0.11 -0.38 0.18 -0.70 -0.31 0.00 0.00 175.10 174.01 2nr2 s GLU 18 N -2.18 3.44 0.00 4.82 2.56 -1.26 -0.85 118.70 125.23 2nr2 s GLU 18 Ca 0.01 -0.32 0.30 0.00 0.00 0.00 0.00 54.97 54.96 2nr2 s GLU 18 Cb -0.07 -3.10 1.55 0.00 2.00 0.00 0.00 34.13 34.52 2nr2 s GLU 18 CO 0.01 0.67 2.06 -0.35 -0.56 0.00 0.00 175.26 177.10 2nr2 n PRO 19 N 0.93 0.53 0.12 4.30 -0.04 -1.26 -1.43 135.00 138.16 2nr2 n PRO 19 Ca -0.11 -0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.45 2nr2 n PRO 19 Cb 0.53 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.64 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2nr2 h SER 20 N 0.05 0.00 -3.48 3.54 4.64 -1.97 -2.49 113.55 113.84 2nr2 h SER 20 Ca 0.00 -0.07 -0.53 0.00 -0.47 0.00 0.00 61.79 60.72 2nr2 h SER 20 Cb 0.25 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.42 2nr2 h SER 20 CO 0.00 0.03 0.84 -1.81 -0.87 0.00 0.00 176.83 175.02 2nr2 s ASP 21 N -5.09 6.42 0.69 4.97 1.01 -0.51 -4.74 116.67 119.42 2nr2 s ASP 21 Ca 0.05 2.92 -0.11 0.00 0.71 0.00 0.00 52.55 56.12 2nr2 s ASP 21 Cb 0.10 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.39 2nr2 s ASP 21 CO 0.71 -0.86 1.07 0.42 0.21 0.00 0.00 175.17 176.72 2nr2 s THR 22 N -0.27 3.92 0.13 -1.27 -4.23 -1.26 -3.14 115.64 109.53 2nr2 s THR 22 Ca 0.60 0.62 -0.15 0.00 -1.18 0.00 0.00 61.69 61.59 2nr2 s THR 22 Cb -0.46 -3.53 -0.00 0.00 1.34 0.00 0.00 72.50 69.84 2nr2 s THR 22 CO 0.50 -0.82 1.64 0.40 -0.54 0.00 0.00 174.62 175.81 2nr2 h ILE 23 N -0.63 1.23 -0.76 2.99 1.08 -0.79 -0.71 117.51 119.92 2nr2 h ILE 23 Ca -0.45 -0.77 0.08 0.00 -0.39 0.00 0.00 64.86 63.33 2nr2 h ILE 23 Cb 1.23 0.92 -0.10 0.00 -3.07 0.00 0.00 36.82 35.80 2nr2 h ILE 23 CO 0.61 0.27 -0.42 1.21 -0.69 0.00 0.00 178.15 179.14 2nr2 n GLU 24 N -4.55 -0.30 0.04 2.37 2.13 0.46 -1.50 120.64 119.28 2nr2 n GLU 24 Ca 0.00 1.16 -0.04 0.00 0.66 0.00 0.00 57.16 58.93 2nr2 n GLU 24 Cb 0.20 -1.70 0.17 0.00 0.27 0.00 0.00 31.44 30.38 2nr2 n GLU 24 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 2nr2 h ASN 25 N 0.00 0.44 -0.65 4.31 2.35 -1.58 -2.92 115.58 117.53 2nr2 h ASN 25 Ca 0.15 -0.18 0.08 0.00 -0.55 0.00 0.00 56.30 55.80 2nr2 h ASN 25 Cb 0.35 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.53 2nr2 h ASN 25 CO -0.73 0.77 0.32 0.58 -1.65 0.00 0.00 177.43 176.73 2nr2 h VAL 26 N 0.36 0.87 -0.30 2.81 2.07 -0.98 -3.06 116.25 118.02 2nr2 h VAL 26 Ca 0.04 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.42 2nr2 h VAL 26 Cb 0.81 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 2nr2 h VAL 26 CO 0.07 0.10 -0.06 0.11 0.02 0.00 0.00 177.57 177.81 2nr2 h LYS 27 N 0.57 0.02 0.00 1.57 1.57 -1.08 -1.92 116.57 117.30 2nr2 h LYS 27 Ca 0.31 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.09 2nr2 h LYS 27 Cb 0.30 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 2nr2 h LYS 27 CO -0.24 0.01 -0.03 0.00 -0.57 0.00 0.00 179.45 178.62 2nr2 h ALA 28 N 1.30 1.61 -0.27 3.86 0.00 -1.54 -1.31 119.26 122.91 2nr2 h ALA 28 Ca 0.15 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2nr2 h ALA 28 Cb 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2nr2 h ALA 28 CO -0.30 0.04 -0.28 0.87 0.00 0.00 0.00 179.25 179.58 2nr2 h LYS 29 N 0.00 0.55 0.00 0.00 1.57 -1.24 -2.00 116.57 115.45 2nr2 h LYS 29 Ca -0.00 -0.22 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 2nr2 h LYS 29 Cb 0.07 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2nr2 h LYS 29 CO 0.00 0.77 -0.38 0.82 -0.57 0.00 0.00 179.45 180.10 2nr2 h ILE 30 N 0.48 0.94 -0.39 1.86 2.04 -1.22 -2.98 117.51 118.24 2nr2 h ILE 30 Ca 0.06 -1.49 -0.12 0.00 1.00 0.00 0.00 64.86 64.31 2nr2 h ILE 30 Cb 0.73 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 2nr2 h ILE 30 CO 0.06 0.37 -0.25 -0.61 0.00 0.00 0.00 178.15 177.72 2nr2 h GLN 31 N 0.00 0.81 -0.58 2.37 4.15 -1.04 0.51 115.11 121.32 2nr2 h GLN 31 Ca -0.00 -0.34 0.03 0.00 0.77 0.00 0.00 58.65 59.11 2nr2 h GLN 31 Cb 0.86 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.48 2nr2 h GLN 31 CO 0.05 0.97 0.34 -0.44 -1.93 0.00 0.00 178.83 177.82 2nr2 h ASP 32 N 0.69 0.55 0.00 -0.69 3.32 -1.23 -3.07 116.42 115.99 2nr2 h ASP 32 Ca 0.09 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2nr2 h ASP 32 Cb 0.78 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.22 2nr2 h ASP 32 CO 0.06 0.38 0.00 1.17 -1.72 0.00 0.00 179.24 179.13 2nr2 n LYS 33 N -4.77 0.00 0.12 3.56 4.81 -1.09 -4.64 118.16 116.14 2nr2 n LYS 33 Ca 0.05 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.49 2nr2 n LYS 33 Cb 0.10 -0.37 0.03 0.00 0.02 0.00 0.00 35.03 34.81 2nr2 n LYS 33 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2nr2 h GLU 34 N 0.00 0.00 0.00 1.64 4.39 -0.21 -3.48 114.58 116.93 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 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2nr2 h GLU 34 CO 0.00 0.66 0.00 0.41 -1.16 0.00 0.00 179.01 178.92 2nr2 n GLY 35 N 1.06 1.13 3.65 -3.84 0.00 -0.84 -5.02 105.19 101.34 2nr2 n GLY 35 Ca 0.01 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 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 5.19 0.51 -0.61 1.01 -1.25 -4.96 121.20 119.09 2nr2 s ILE 36 Ca 0.00 0.68 -0.23 0.00 0.00 0.00 0.00 60.65 61.10 2nr2 s ILE 36 Cb 0.00 -3.72 -0.06 0.00 0.01 0.00 0.00 42.46 38.69 2nr2 s ILE 36 CO 0.00 0.23 1.34 -2.84 0.00 0.00 0.00 174.94 173.67 2nr2 s PRO 37 N 1.50 3.35 0.55 2.79 0.02 -1.26 -3.86 135.00 138.10 2nr2 s PRO 37 Ca 0.18 2.20 0.32 0.00 0.02 0.00 0.00 61.00 63.72 2nr2 s PRO 37 Cb -0.15 -2.36 1.55 0.00 0.02 0.00 0.00 34.50 33.56 2nr2 s PRO 37 CO 0.08 -1.01 2.08 -1.35 -0.33 0.00 0.00 177.00 176.47 2nr2 h PRO 38 N 1.73 0.00 -0.20 5.54 0.11 -1.94 0.12 132.00 137.36 2nr2 h PRO 38 Ca -0.51 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2nr2 h PRO 38 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2nr2 h PRO 38 CO 0.58 0.07 0.11 -0.44 -0.21 0.00 0.00 178.00 178.12 2nr2 h ASP 39 N 0.00 0.23 -0.14 -2.05 3.32 -1.97 -2.19 116.42 113.61 2nr2 h ASP 39 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2nr2 h ASP 39 Cb 0.37 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2nr2 h ASP 39 CO 0.01 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.71 2nr2 n GLN 40 N -4.49 2.21 -3.33 3.56 6.02 0.40 -4.80 117.38 116.95 2nr2 n GLN 40 Ca -0.00 -1.79 -0.46 0.00 -0.01 0.00 0.00 57.00 54.74 2nr2 n GLN 40 Cb 0.09 -1.47 -0.05 0.00 1.02 0.00 0.00 30.24 29.82 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 -1.84 2.95 -0.72 -1.09 -0.21 -0.83 -0.17 119.66 117.75 2nr2 s GLN 41 Ca 0.33 -1.71 -0.17 0.00 0.02 0.00 0.00 55.36 53.84 2nr2 s GLN 41 Cb 0.21 -4.26 0.15 0.00 1.00 0.00 0.00 33.01 30.10 2nr2 s GLN 41 CO 0.31 -1.31 0.77 1.03 -2.12 0.00 0.00 175.29 173.96 2nr2 s ARG 42 N 1.58 3.31 0.02 2.91 0.52 -0.25 -4.97 118.95 122.07 2nr2 s ARG 42 Ca 0.03 -1.81 -0.30 0.00 -0.52 0.00 0.00 55.73 53.13 2nr2 s ARG 42 Cb -0.30 -4.44 -0.05 0.00 0.52 0.00 0.00 34.95 30.69 2nr2 s ARG 42 CO 0.03 -1.48 1.29 -0.51 0.02 0.00 0.00 175.30 174.65 2nr2 s LEU 43 N 1.75 4.33 -0.06 2.53 1.43 -1.26 -1.04 118.68 126.36 2nr2 s LEU 43 Ca 0.16 2.04 0.05 0.00 -1.03 0.00 0.00 54.13 55.35 2nr2 s LEU 43 Cb -0.17 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 2nr2 s LEU 43 CO -0.02 -0.60 -0.22 -0.63 0.23 0.00 0.00 176.35 175.12 2nr2 s ILE 44 N 1.76 2.33 -0.32 -0.59 -1.09 -0.45 -2.79 121.20 120.04 2nr2 s ILE 44 Ca 0.60 -0.97 0.03 0.00 -2.23 0.00 0.00 60.65 58.09 2nr2 s ILE 44 Cb -0.30 -1.87 0.10 0.00 -1.58 0.00 0.00 42.46 38.80 2nr2 s ILE 44 CO 0.27 0.57 0.04 0.12 -1.23 0.00 0.00 174.94 174.71 2nr2 s PHE 45 N -0.20 3.30 0.00 3.97 5.36 0.07 -0.70 117.98 129.77 2nr2 s PHE 45 Ca -0.02 -2.67 0.00 0.00 -0.96 0.00 0.00 56.93 53.28 2nr2 s PHE 45 Cb -0.13 -2.57 0.00 0.00 -0.34 0.00 0.00 43.02 39.97 2nr2 s PHE 45 CO 0.03 -0.92 0.00 0.00 -1.46 0.00 0.00 175.22 172.87 2nr2 n ALA 46 N 4.39 0.00 -2.05 11.12 0.00 -1.26 -0.64 120.51 132.07 2nr2 n ALA 46 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2nr2 n ALA 46 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.00 0.58 3.31 0.00 0.00 -1.26 -5.04 105.19 102.78 2nr2 n GLY 47 Ca 0.00 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 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 3.38 -0.34 1.61 1.02 0.19 -5.07 119.74 120.53 2nr2 s LYS 48 Ca 0.03 -0.63 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 2nr2 s LYS 48 Cb 0.04 -2.98 0.01 0.00 -0.52 0.00 0.00 37.83 34.37 2nr2 s LYS 48 CO -0.02 -0.17 1.30 -0.65 -0.92 0.00 0.00 175.35 174.89 2nr2 s GLN 49 N 1.39 3.84 0.16 1.68 1.11 -1.26 -0.75 119.66 125.83 2nr2 s GLN 49 Ca 0.05 1.12 -0.13 0.00 0.01 0.00 0.00 55.36 56.41 2nr2 s GLN 49 Cb -0.14 -3.90 -0.07 0.00 -1.01 0.00 0.00 33.01 27.89 2nr2 s GLN 49 CO -0.03 -1.22 0.53 -0.51 0.01 0.00 0.00 175.29 174.07 2nr2 s LEU 50 N 4.56 4.30 0.63 2.90 1.43 -1.12 -5.02 118.68 126.36 2nr2 s LEU 50 Ca 0.56 1.01 -0.08 0.00 -1.03 0.00 0.00 54.13 54.59 2nr2 s LEU 50 Cb -0.15 -3.33 0.01 0.00 0.03 0.00 0.00 46.19 42.75 2nr2 s LEU 50 CO 0.25 0.07 0.97 -1.61 0.23 0.00 0.00 176.35 176.27 2nr2 s GLU 51 N -2.14 2.90 -0.18 1.70 2.02 -1.26 -4.86 118.70 116.87 2nr2 s GLU 51 Ca 0.39 0.16 -0.18 0.00 0.02 0.00 0.00 54.97 55.37 2nr2 s GLU 51 Cb -0.14 -2.18 -0.14 0.00 0.10 0.00 0.00 34.13 31.77 2nr2 s GLU 51 CO 0.19 -0.82 0.12 -0.44 0.02 0.00 0.00 175.26 174.33 2nr2 h ASP 52 N -0.35 0.00 0.00 -0.19 3.32 -1.98 -3.36 116.42 113.86 2nr2 h ASP 52 Ca -0.45 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.23 2nr2 h ASP 52 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2nr2 h ASP 52 CO 0.62 1.25 0.00 0.61 -1.72 0.00 0.00 179.24 179.99 2nr2 n GLY 53 N 1.50 1.02 3.83 2.75 0.00 -1.26 -0.41 105.19 112.62 2nr2 n GLY 53 Ca -0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.14 4.03 0.64 1.61 3.00 -1.26 -4.88 118.95 120.95 2nr2 s ARG 54 Ca 0.00 1.06 -0.03 0.00 0.00 0.00 0.00 55.73 56.76 2nr2 s ARG 54 Cb 0.00 -2.15 0.05 0.00 0.00 0.00 0.00 34.95 32.86 2nr2 s ARG 54 CO 0.00 -0.20 0.90 0.95 0.00 0.00 0.00 175.30 176.95 2nr2 s THR 55 N -2.39 2.45 0.18 0.02 -4.23 -1.26 -0.53 115.64 109.88 2nr2 s THR 55 Ca 0.61 -0.47 0.04 0.00 -1.18 0.00 0.00 61.69 60.69 2nr2 s THR 55 Cb -0.10 -2.98 -0.13 0.00 1.34 0.00 0.00 72.50 70.63 2nr2 s THR 55 CO 0.23 0.00 1.42 -0.07 -0.54 0.00 0.00 174.62 175.66 2nr2 h LEU 56 N -0.29 0.19 -0.05 4.79 3.38 -1.48 -3.11 115.31 118.74 2nr2 h LEU 56 Ca -0.43 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.39 2nr2 h LEU 56 Cb 1.30 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2nr2 h LEU 56 CO 0.55 0.94 0.02 -1.28 0.09 0.00 0.00 178.44 178.76 2nr2 h SER 57 N 0.09 0.07 -0.62 -0.43 0.87 -1.70 -0.77 113.55 111.06 2nr2 h SER 57 Ca -0.03 -0.15 0.12 0.00 -1.23 0.00 0.00 61.79 60.51 2nr2 h SER 57 Cb 1.44 -0.02 -0.12 0.00 -0.44 0.00 0.00 62.40 63.26 2nr2 h SER 57 CO 0.12 0.19 -0.18 -0.78 -0.53 0.00 0.00 176.83 175.65 2nr2 h ASP 58 N -0.06 -0.67 0.55 6.23 3.58 -1.86 -1.46 116.42 122.73 2nr2 h ASP 58 Ca 0.02 0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.66 2nr2 h ASP 58 Cb 0.15 0.42 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2nr2 h ASP 58 CO -0.00 -0.23 0.00 -1.22 -2.88 0.00 0.00 179.24 174.91 2nr2 n TYR 59 N -5.43 0.00 -3.27 0.28 4.01 -0.92 -4.94 117.16 106.89 2nr2 n TYR 59 Ca 0.07 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.64 2nr2 n TYR 59 Cb 0.33 -0.33 0.06 0.00 -0.31 0.00 0.00 39.34 39.10 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 -1.33 -4.85 -4.55 7.72 3.02 -0.35 -4.99 115.26 109.94 2nr2 n ASN 60 Ca 0.11 -0.40 -0.41 0.00 -0.03 0.00 0.00 54.58 53.85 2nr2 n ASN 60 Cb 0.22 -3.82 -0.08 0.00 -0.61 0.00 0.00 39.78 35.48 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 -3.24 5.07 0.33 2.41 1.01 -0.87 -5.05 121.20 120.88 2nr2 s ILE 61 Ca 0.38 0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.29 2nr2 s ILE 61 Cb -0.17 -3.91 0.05 0.00 0.01 0.00 0.00 42.46 38.44 2nr2 s ILE 61 CO 0.53 -0.18 0.41 0.00 0.00 0.00 0.00 174.94 175.71 2nr2 n GLN 62 N 5.60 0.83 -1.82 2.79 10.64 -1.26 -4.61 117.38 129.56 2nr2 n GLN 62 Ca -0.06 -1.85 -0.40 0.00 -1.83 0.00 0.00 57.00 52.86 2nr2 n GLN 62 Cb 0.49 -0.06 0.02 0.00 -0.86 0.00 0.00 30.24 29.83 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 -3.47 3.69 -0.52 2.61 -2.85 -1.26 -3.52 119.74 114.42 2nr2 s LYS 63 Ca 0.31 2.39 0.00 0.00 -1.00 0.00 0.00 55.97 57.68 2nr2 s LYS 63 Cb -0.02 -2.65 0.00 0.00 -2.06 0.00 0.00 37.83 33.09 2nr2 s LYS 63 CO 0.20 -0.81 0.00 0.39 0.10 0.00 0.00 175.35 175.23 2nr2 n GLU 64 N -0.20 -0.36 -3.41 1.78 1.02 0.52 -5.01 120.64 114.99 2nr2 n GLU 64 Ca 0.05 0.66 -0.29 0.00 -0.02 0.00 0.00 57.16 57.56 2nr2 n GLU 64 Cb 0.42 -4.37 -0.04 0.00 -0.02 0.00 0.00 31.44 27.44 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 -2.92 6.47 -0.44 1.62 0.01 -1.23 -4.88 113.70 112.33 2nr2 s SER 65 Ca 0.00 0.71 -0.10 0.00 1.31 0.00 0.00 55.95 57.87 2nr2 s SER 65 Cb 0.00 -2.14 0.09 0.00 0.21 0.00 0.00 66.02 64.18 2nr2 s SER 65 CO 0.00 -0.14 0.30 -0.89 0.41 0.00 0.00 173.24 172.92 2nr2 s THR 66 N -1.99 4.32 0.50 1.44 2.01 -1.26 -0.78 115.64 119.88 2nr2 s THR 66 Ca 0.44 -1.48 0.02 0.00 0.31 0.00 0.00 61.69 60.98 2nr2 s THR 66 Cb -0.11 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.73 2nr2 s THR 66 CO 0.28 -0.59 0.71 -0.76 -0.69 0.00 0.00 174.62 173.57 2nr2 s LEU 67 N 1.43 3.44 0.13 4.42 1.02 0.71 -4.64 118.68 125.19 2nr2 s LEU 67 Ca 0.04 -0.01 0.01 0.00 0.02 0.00 0.00 54.13 54.19 2nr2 s LEU 67 Cb -0.24 -2.90 -0.04 0.00 0.02 0.00 0.00 46.19 43.03 2nr2 s LEU 67 CO 0.02 -0.96 -0.01 -1.00 0.02 0.00 0.00 176.35 174.42 2nr2 s HIS 68 N -2.63 0.95 -0.10 0.29 3.76 0.12 -1.26 115.29 116.42 2nr2 s HIS 68 Ca 0.54 -1.05 -0.04 0.00 -0.15 0.00 0.00 55.06 54.37 2nr2 s HIS 68 Cb -0.10 -0.56 0.05 0.00 1.11 0.00 0.00 32.58 33.08 2nr2 s HIS 68 CO 0.37 -0.29 0.20 -1.17 -0.85 0.00 0.00 174.74 173.00 2nr2 s LEU 69 N -3.08 -0.02 -0.16 0.89 2.96 0.10 -1.35 118.68 118.03 2nr2 s LEU 69 Ca 0.18 0.43 -0.00 0.00 -0.22 0.00 0.00 54.13 54.52 2nr2 s LEU 69 Cb 0.06 0.46 -0.00 0.00 0.50 0.00 0.00 46.19 47.21 2nr2 s LEU 69 CO -0.01 -0.23 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.96 2nr2 s VAL 70 N 2.13 2.77 -0.12 1.68 1.01 -0.21 -3.58 120.40 124.09 2nr2 s VAL 70 Ca 0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 60.96 2nr2 s VAL 70 Cb -0.12 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 2nr2 s VAL 70 CO -0.07 0.51 0.99 -0.76 0.00 0.00 0.00 175.10 175.77 2nr2 s LEU 71 N 0.80 4.23 -1.13 3.92 1.43 -1.26 -1.09 118.68 125.59 2nr2 s LEU 71 Ca -0.05 1.49 -0.11 0.00 -1.03 0.00 0.00 54.13 54.43 2nr2 s LEU 71 Cb -0.15 -3.52 0.23 0.00 0.03 0.00 0.00 46.19 42.78 2nr2 s LEU 71 CO 0.00 -0.45 1.21 -0.60 0.23 0.00 0.00 176.35 176.75 2nr2 s ARG 72 N 2.06 4.13 0.00 1.70 3.52 0.77 -4.95 118.95 126.17 2nr2 s ARG 72 Ca 0.47 -2.93 0.00 0.00 -0.13 0.00 0.00 55.73 53.14 2nr2 s ARG 72 Cb -0.18 -4.74 0.00 0.00 -1.56 0.00 0.00 34.95 28.47 2nr2 s ARG 72 CO 0.17 -1.44 0.00 1.28 -0.81 0.00 0.00 175.30 174.50 2nr2 n LEU 73 N 3.88 0.00 -0.03 -0.88 4.77 -1.26 -4.47 117.00 119.00 2nr2 n LEU 73 Ca 0.28 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.22 2nr2 n LEU 73 Cb 0.41 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2nr2 n LEU 73 CO 0.52 0.00 -0.32 0.54 -1.33 0.00 0.00 177.39 176.80 2nr2 n ARG 74 N 0.00 0.25 -3.19 3.23 1.74 -1.26 -4.85 116.66 112.58 2nr2 n ARG 74 Ca 0.00 0.10 -0.45 0.00 -0.77 0.00 0.00 57.85 56.73 2nr2 n ARG 74 Cb 0.00 -0.89 -0.00 0.00 -1.02 0.00 0.00 32.46 30.54 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2nr2 s GLY 75 N -4.16 2.86 0.00 -0.13 0.00 -1.26 -5.27 107.32 99.36 2nr2 s GLY 75 Ca -0.14 -3.60 0.00 0.00 0.00 0.00 0.00 44.72 40.99 2nr2 s GLY 75 CO 0.20 1.59 0.00 0.61 0.00 0.00 0.00 173.10 175.50