#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 4.39 0.28 2.12 0.74 -1.26 0.25 119.66 126.18 2nr2 s GLN 2 Ca 0.00 0.87 0.02 0.00 0.05 0.00 0.00 55.36 56.30 2nr2 s GLN 2 Cb 0.00 -3.35 -0.06 0.00 1.10 0.00 0.00 33.01 30.70 2nr2 s GLN 2 CO 0.00 0.33 0.07 0.96 -0.55 0.00 0.00 175.29 176.10 2nr2 s ILE 3 N -0.13 0.83 0.23 -2.34 -4.36 0.27 -0.46 121.20 115.25 2nr2 s ILE 3 Ca 0.34 -2.00 0.11 0.00 -0.26 0.00 0.00 60.65 58.84 2nr2 s ILE 3 Cb -0.19 -2.67 -0.05 0.00 1.25 0.00 0.00 42.46 40.80 2nr2 s ILE 3 CO 0.20 -0.03 -0.20 -0.36 0.24 0.00 0.00 174.94 174.78 2nr2 s PHE 4 N -3.56 2.15 -0.07 1.37 0.08 0.91 -0.59 117.98 118.27 2nr2 s PHE 4 Ca 0.37 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 57.07 2nr2 s PHE 4 Cb 0.08 -1.00 -0.00 0.00 -0.57 0.00 0.00 43.02 41.53 2nr2 s PHE 4 CO 0.14 0.55 -0.20 0.08 -0.10 0.00 0.00 175.22 175.69 2nr2 s VAL 5 N -2.25 1.72 -0.15 -0.44 1.01 0.13 -0.97 120.40 119.46 2nr2 s VAL 5 Ca 0.24 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 2nr2 s VAL 5 Cb -0.05 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 2nr2 s VAL 5 CO 0.11 0.49 0.18 -0.75 0.00 0.00 0.00 175.10 175.13 2nr2 s LYS 6 N 0.19 3.88 0.00 2.72 2.47 0.56 -0.04 119.74 129.51 2nr2 s LYS 6 Ca -0.10 -0.09 0.00 0.00 -1.56 0.00 0.00 55.97 54.21 2nr2 s LYS 6 Cb -0.15 -3.31 0.00 0.00 -1.46 0.00 0.00 37.83 32.91 2nr2 s LYS 6 CO 0.05 0.51 0.00 0.25 0.16 0.00 0.00 175.35 176.32 2nr2 n THR 7 N 2.78 0.00 -0.03 3.43 -2.24 -0.66 -0.73 114.28 116.83 2nr2 n THR 7 Ca -0.17 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.46 2nr2 n THR 7 Cb 0.53 -1.70 -0.11 0.00 -2.10 0.00 0.00 70.33 66.95 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 0.24 -0.24 3.22 3.38 -1.91 -3.36 115.31 116.64 2nr2 h LEU 8 Ca 0.00 -0.70 -0.18 0.00 0.09 0.00 0.00 57.88 57.09 2nr2 h LEU 8 Cb 0.00 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2nr2 h LEU 8 CO 0.00 0.90 -0.87 0.71 0.09 0.00 0.00 178.44 179.27 2nr2 h THR 9 N -0.41 1.61 0.00 0.22 1.35 -1.97 -3.46 112.91 110.25 2nr2 h THR 9 Ca -0.02 -3.00 0.00 0.00 -0.55 0.00 0.00 66.41 62.85 2nr2 h THR 9 Cb 0.91 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.95 2nr2 h THR 9 CO 0.04 0.85 0.00 0.61 -0.25 0.00 0.00 175.52 176.78 2nr2 n GLY 10 N 1.00 -0.85 3.76 5.82 0.00 -1.26 -5.14 105.19 108.53 2nr2 n GLY 10 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 4.71 -0.45 1.61 2.20 -1.26 -4.74 119.74 121.81 2nr2 s LYS 11 Ca 0.00 1.34 -0.17 0.00 -0.36 0.00 0.00 55.97 56.79 2nr2 s LYS 11 Cb 0.00 -3.19 0.04 0.00 -1.51 0.00 0.00 37.83 33.17 2nr2 s LYS 11 CO 0.00 0.50 0.43 0.99 -0.36 0.00 0.00 175.35 176.90 2nr2 s THR 12 N -1.25 5.13 -0.19 3.43 2.01 -1.26 -1.66 115.64 121.86 2nr2 s THR 12 Ca 0.41 -0.64 -0.27 0.00 0.31 0.00 0.00 61.69 61.50 2nr2 s THR 12 Cb -0.24 -4.08 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 2nr2 s THR 12 CO 0.29 -0.50 0.91 -0.63 -0.69 0.00 0.00 174.62 173.99 2nr2 s ILE 13 N 1.98 4.81 -0.36 1.82 1.01 0.94 -4.92 121.20 126.47 2nr2 s ILE 13 Ca 0.09 1.79 -0.17 0.00 0.00 0.00 0.00 60.65 62.35 2nr2 s ILE 13 Cb -0.20 -4.20 -0.00 0.00 0.01 0.00 0.00 42.46 38.06 2nr2 s ILE 13 CO 0.11 -0.05 0.46 -0.89 0.00 0.00 0.00 174.94 174.57 2nr2 s THR 14 N 2.51 5.06 0.28 2.92 2.01 -1.26 -0.69 115.64 126.47 2nr2 s THR 14 Ca 0.41 0.16 0.11 0.00 0.31 0.00 0.00 61.69 62.67 2nr2 s THR 14 Cb -0.16 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.36 2nr2 s THR 14 CO 0.11 -0.22 -0.09 -0.76 -0.69 0.00 0.00 174.62 172.97 2nr2 s LEU 15 N 2.27 2.91 -0.09 4.42 1.02 0.24 -5.00 118.68 124.45 2nr2 s LEU 15 Ca 0.16 -0.84 0.01 0.00 0.02 0.00 0.00 54.13 53.47 2nr2 s LEU 15 Cb -0.16 -1.41 0.02 0.00 0.02 0.00 0.00 46.19 44.66 2nr2 s LEU 15 CO 0.13 -0.00 -0.10 -1.83 0.02 0.00 0.00 176.35 174.56 2nr2 s GLU 16 N -3.61 1.67 0.00 1.70 -1.05 -1.26 -0.56 118.70 115.59 2nr2 s GLU 16 Ca 0.31 -0.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.78 2nr2 s GLU 16 Cb -0.05 -1.54 0.00 0.00 -0.44 0.00 0.00 34.13 32.10 2nr2 s GLU 16 CO 0.18 -0.12 0.00 1.33 0.95 0.00 0.00 175.26 177.60 2nr2 n VAL 17 N 4.38 0.00 -4.31 1.83 0.24 0.14 -4.92 118.33 115.69 2nr2 n VAL 17 Ca -0.18 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 61.94 2nr2 n VAL 17 Cb 0.51 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.79 2nr2 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2nr2 s GLU 18 N -1.23 1.54 0.00 7.34 0.41 -1.26 0.11 118.70 125.61 2nr2 s GLU 18 Ca 0.00 -1.87 0.29 0.00 -0.41 0.00 0.00 54.97 52.99 2nr2 s GLU 18 Cb 0.00 -0.01 1.31 0.00 -1.78 0.00 0.00 34.13 33.65 2nr2 s GLU 18 CO 0.00 -0.45 1.95 -2.30 -0.49 0.00 0.00 175.26 173.97 2nr2 n PRO 19 N -0.53 0.17 0.13 0.39 -0.02 -1.26 -3.27 135.00 130.61 2nr2 n PRO 19 Ca 0.02 -0.01 0.12 0.00 -2.02 0.00 0.00 63.50 61.60 2nr2 n PRO 19 Cb 0.65 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.67 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2nr2 h SER 20 N 0.02 0.00 -4.15 2.55 0.02 -1.98 -2.63 113.55 107.38 2nr2 h SER 20 Ca 0.00 -0.01 -0.54 0.00 -0.84 0.00 0.00 61.79 60.40 2nr2 h SER 20 Cb 0.42 0.00 0.15 0.00 0.14 0.00 0.00 62.40 63.12 2nr2 h SER 20 CO 0.00 0.00 0.44 -1.81 -1.14 0.00 0.00 176.83 174.32 2nr2 s ASP 21 N -5.50 4.41 0.59 3.07 1.01 -1.20 -4.75 116.67 114.29 2nr2 s ASP 21 Ca 0.01 2.44 -0.02 0.00 0.71 0.00 0.00 52.55 55.69 2nr2 s ASP 21 Cb 0.09 -2.60 0.04 0.00 1.01 0.00 0.00 42.92 41.45 2nr2 s ASP 21 CO 0.76 -2.13 0.85 0.42 0.21 0.00 0.00 175.17 175.29 2nr2 s THR 22 N -1.77 2.76 0.28 -1.27 -4.23 -1.26 -1.83 115.64 108.32 2nr2 s THR 22 Ca 0.77 -0.46 -0.00 0.00 -1.18 0.00 0.00 61.69 60.82 2nr2 s THR 22 Cb -0.32 -3.09 0.12 0.00 1.34 0.00 0.00 72.50 70.56 2nr2 s THR 22 CO 0.42 -0.07 1.79 0.40 -0.54 0.00 0.00 174.62 176.62 2nr2 h ILE 23 N -0.14 1.23 -0.30 2.99 1.08 -0.91 -0.99 117.51 120.48 2nr2 h ILE 23 Ca -0.43 -0.95 0.07 0.00 -0.39 0.00 0.00 64.86 63.16 2nr2 h ILE 23 Cb 1.30 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 2nr2 h ILE 23 CO 0.56 0.33 0.21 -0.08 -0.69 0.00 0.00 178.15 178.48 2nr2 h GLU 24 N 0.67 0.06 -0.04 2.37 4.81 -1.48 -1.84 114.58 119.13 2nr2 h GLU 24 Ca 0.13 -0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.19 2nr2 h GLU 24 Cb 0.42 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2nr2 h GLU 24 CO 0.02 0.04 -0.72 -0.97 -0.73 0.00 0.00 179.01 176.65 2nr2 h ASN 25 N 0.06 0.26 -0.03 1.04 -0.73 -1.49 -1.63 115.58 113.07 2nr2 h ASN 25 Ca 0.14 -0.17 -0.00 0.00 1.87 0.00 0.00 56.30 58.13 2nr2 h ASN 25 Cb 0.48 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 38.99 2nr2 h ASN 25 CO -0.01 0.89 0.01 0.58 -0.37 0.00 0.00 177.43 178.53 2nr2 h VAL 26 N 0.15 1.13 -0.97 2.57 2.07 -1.37 -2.49 116.25 117.33 2nr2 h VAL 26 Ca -0.02 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.16 2nr2 h VAL 26 Cb 1.27 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 2nr2 h VAL 26 CO 0.11 0.10 0.64 0.11 0.02 0.00 0.00 177.57 178.55 2nr2 h LYS 27 N -0.11 1.18 -0.27 1.57 1.57 -1.32 -0.64 116.57 118.55 2nr2 h LYS 27 Ca 0.01 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 2nr2 h LYS 27 Cb 0.16 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2nr2 h LYS 27 CO -0.00 0.78 -0.03 0.00 -0.57 0.00 0.00 179.45 179.63 2nr2 h ALA 28 N 1.44 1.46 -0.03 3.86 0.00 -1.05 0.23 119.26 125.17 2nr2 h ALA 28 Ca 0.39 -0.19 -0.21 0.00 0.00 0.00 0.00 54.91 54.90 2nr2 h ALA 28 Cb 0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2nr2 h ALA 28 CO -0.12 0.39 -0.86 0.87 0.00 0.00 0.00 179.25 179.52 2nr2 h LYS 29 N 0.40 0.42 -0.98 0.00 1.57 -1.01 0.01 116.57 116.98 2nr2 h LYS 29 Ca 0.09 -0.40 0.08 0.00 -1.87 0.00 0.00 60.65 58.54 2nr2 h LYS 29 Cb 0.31 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.66 2nr2 h LYS 29 CO 0.01 1.06 0.63 0.82 -0.57 0.00 0.00 179.45 181.40 2nr2 h ILE 30 N 0.25 1.04 -0.65 1.86 2.04 -0.15 -1.60 117.51 120.31 2nr2 h ILE 30 Ca -0.06 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.38 2nr2 h ILE 30 Cb 1.48 -0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2nr2 h ILE 30 CO 0.15 0.20 0.22 -0.61 0.00 0.00 0.00 178.15 178.11 2nr2 h GLN 31 N 1.09 1.01 0.04 2.37 4.15 -0.46 -1.30 115.11 122.01 2nr2 h GLN 31 Ca 0.44 -0.21 -0.00 0.00 0.77 0.00 0.00 58.65 59.65 2nr2 h GLN 31 Cb 0.26 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 27.80 2nr2 h GLN 31 CO -0.19 0.87 -0.04 0.22 -1.93 0.00 0.00 178.83 177.77 2nr2 h ASP 32 N 0.94 -0.10 0.58 -0.69 3.58 -0.60 -3.20 116.42 116.92 2nr2 h ASP 32 Ca 0.21 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.64 2nr2 h ASP 32 Cb 0.27 0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.36 2nr2 h ASP 32 CO -0.01 -0.05 -0.28 0.11 -2.88 0.00 0.00 179.24 176.13 2nr2 h LYS 33 N -0.08 -0.75 0.14 0.28 1.57 -1.39 -3.40 116.57 112.95 2nr2 h LYS 33 Ca -0.01 0.05 -0.26 0.00 -1.87 0.00 0.00 60.65 58.56 2nr2 h LYS 33 Cb 0.07 0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.56 2nr2 h LYS 33 CO -0.00 -0.49 -1.27 0.93 -0.57 0.00 0.00 179.45 178.04 2nr2 h GLU 34 N -1.20 0.31 0.00 3.15 4.39 -1.46 -3.48 114.58 116.28 2nr2 h GLU 34 Ca -0.08 -0.52 0.00 0.00 0.34 0.00 0.00 59.36 59.10 2nr2 h GLU 34 Cb 0.60 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2nr2 h GLU 34 CO 0.13 1.25 0.00 0.41 -1.16 0.00 0.00 179.01 179.64 2nr2 n GLY 35 N 1.73 1.97 3.64 -3.84 0.00 -0.85 -5.04 105.19 102.80 2nr2 n GLY 35 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 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 4.45 0.70 -0.61 1.01 -1.25 -4.99 121.20 118.50 2nr2 s ILE 36 Ca 0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 60.65 60.36 2nr2 s ILE 36 Cb 0.00 -2.93 0.01 0.00 0.01 0.00 0.00 42.46 39.55 2nr2 s ILE 36 CO 0.00 0.54 1.07 -2.16 0.00 0.00 0.00 174.94 174.39 2nr2 s PRO 37 N -0.25 2.80 0.50 2.79 0.04 -1.26 -3.62 135.00 136.01 2nr2 s PRO 37 Ca 0.06 1.09 0.30 0.00 0.04 0.00 0.00 61.00 62.50 2nr2 s PRO 37 Cb -0.12 -1.97 1.03 0.00 0.04 0.00 0.00 34.50 33.47 2nr2 s PRO 37 CO 0.02 -1.21 1.86 -1.35 0.04 0.00 0.00 177.00 176.35 2nr2 h PRO 38 N -0.57 0.00 0.00 0.56 0.11 -1.94 -2.46 132.00 127.70 2nr2 h PRO 38 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2nr2 h PRO 38 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2nr2 h PRO 38 CO 0.55 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.09 2nr2 n ASP 39 N -3.05 0.31 -0.01 -2.05 8.00 -1.26 -2.70 116.55 115.80 2nr2 n ASP 39 Ca 0.02 0.57 0.10 0.00 0.71 0.00 0.00 54.79 56.19 2nr2 n ASP 39 Cb 0.37 -0.64 -0.15 0.00 -0.02 0.00 0.00 41.12 40.69 2nr2 n ASP 39 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2nr2 n GLN 40 N -1.83 0.42 -3.22 -1.24 7.27 -0.93 -4.94 117.38 112.91 2nr2 n GLN 40 Ca 0.04 -0.11 -0.39 0.00 0.07 0.00 0.00 57.00 56.60 2nr2 n GLN 40 Cb 0.24 -1.50 -0.06 0.00 2.41 0.00 0.00 30.24 31.33 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2nr2 s GLN 41 N -3.28 4.27 -0.15 3.69 -0.21 -1.10 -1.60 119.66 121.28 2nr2 s GLN 41 Ca -0.01 0.81 0.01 0.00 0.02 0.00 0.00 55.36 56.18 2nr2 s GLN 41 Cb 0.15 -3.25 0.02 0.00 1.00 0.00 0.00 33.01 30.92 2nr2 s GLN 41 CO 0.88 0.60 -0.16 1.03 -2.12 0.00 0.00 175.29 175.52 2nr2 s ARG 42 N -1.02 2.50 -0.18 2.91 0.52 0.05 -4.91 118.95 118.81 2nr2 s ARG 42 Ca 0.30 -0.64 -0.08 0.00 -0.52 0.00 0.00 55.73 54.80 2nr2 s ARG 42 Cb -0.20 -2.22 -0.04 0.00 0.52 0.00 0.00 34.95 33.01 2nr2 s ARG 42 CO 0.20 -0.20 0.07 -0.51 0.02 0.00 0.00 175.30 174.88 2nr2 s LEU 43 N 1.36 3.90 -0.04 2.53 1.43 -1.26 -0.68 118.68 125.93 2nr2 s LEU 43 Ca 0.03 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.32 2nr2 s LEU 43 Cb -0.13 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.08 2nr2 s LEU 43 CO -0.10 0.19 -0.20 -0.63 0.23 0.00 0.00 176.35 175.84 2nr2 s ILE 44 N 0.27 2.55 -0.01 -0.59 -1.09 0.25 -1.04 121.20 121.53 2nr2 s ILE 44 Ca 0.05 -0.92 -0.10 0.00 -2.23 0.00 0.00 60.65 57.45 2nr2 s ILE 44 Cb -0.12 -1.95 0.01 0.00 -1.58 0.00 0.00 42.46 38.82 2nr2 s ILE 44 CO -0.00 0.58 0.21 0.12 -1.23 0.00 0.00 174.94 174.62 2nr2 s PHE 45 N -0.65 -0.07 -1.15 3.97 5.36 0.49 -0.57 117.98 125.36 2nr2 s PHE 45 Ca 0.10 0.09 -0.00 0.00 -0.96 0.00 0.00 56.93 56.16 2nr2 s PHE 45 Cb -0.10 0.02 0.00 0.00 -0.34 0.00 0.00 43.02 42.60 2nr2 s PHE 45 CO -0.00 -0.30 0.03 0.00 -1.46 0.00 0.00 175.22 173.48 2nr2 n ALA 46 N 1.56 -0.78 0.00 11.12 0.00 -1.26 -0.86 120.51 130.29 2nr2 n ALA 46 Ca -0.21 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2nr2 n ALA 46 Cb 0.56 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 -0.85 2.73 3.78 0.00 0.00 -1.26 -5.02 105.19 104.57 2nr2 n GLY 47 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.01 4.54 -0.07 1.61 1.02 -0.04 -5.06 119.74 121.74 2nr2 s LYS 48 Ca 0.00 1.21 -0.19 0.00 0.02 0.00 0.00 55.97 57.01 2nr2 s LYS 48 Cb 0.00 -2.97 -0.05 0.00 -0.52 0.00 0.00 37.83 34.29 2nr2 s LYS 48 CO 0.00 0.40 0.53 -1.14 -0.92 0.00 0.00 175.35 174.21 2nr2 s GLN 49 N -1.74 4.30 0.25 1.68 0.74 -1.26 -0.38 119.66 123.25 2nr2 s GLN 49 Ca 0.44 0.57 -0.17 0.00 0.05 0.00 0.00 55.36 56.26 2nr2 s GLN 49 Cb -0.20 -3.39 -0.08 0.00 1.10 0.00 0.00 33.01 30.44 2nr2 s GLN 49 CO 0.25 0.26 0.69 -0.51 -0.55 0.00 0.00 175.29 175.43 2nr2 s LEU 50 N 0.23 4.23 0.29 3.68 1.43 -0.20 -4.96 118.68 123.38 2nr2 s LEU 50 Ca 0.28 1.29 -0.05 0.00 -1.03 0.00 0.00 54.13 54.62 2nr2 s LEU 50 Cb -0.16 -3.72 -0.05 0.00 0.03 0.00 0.00 46.19 42.28 2nr2 s LEU 50 CO 0.13 -0.05 0.55 -0.70 0.23 0.00 0.00 176.35 176.51 2nr2 s GLU 51 N -2.39 3.63 -0.01 1.70 2.56 -1.26 -4.68 118.70 118.25 2nr2 s GLU 51 Ca 0.46 -0.01 -0.07 0.00 0.00 0.00 0.00 54.97 55.36 2nr2 s GLU 51 Cb -0.14 -2.65 -0.04 0.00 2.00 0.00 0.00 34.13 33.30 2nr2 s GLU 51 CO 0.19 0.22 0.63 -0.44 -0.56 0.00 0.00 175.26 175.30 2nr2 h ASP 52 N 1.68 -0.22 0.00 -1.70 5.19 -1.98 -3.22 116.42 116.17 2nr2 h ASP 52 Ca -0.48 0.01 -0.38 0.00 -0.62 0.00 0.00 57.03 55.56 2nr2 h ASP 52 Cb 1.19 0.06 0.05 0.00 0.18 0.00 0.00 39.33 40.81 2nr2 h ASP 52 CO 0.66 -0.07 1.80 0.61 -3.12 0.00 0.00 179.24 179.12 2nr2 n GLY 53 N 0.28 1.99 3.02 2.75 0.00 -1.26 -1.39 105.19 110.57 2nr2 n GLY 53 Ca -0.03 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.18 2nr2 n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nr2 s ARG 54 N 5.03 0.38 0.71 1.61 6.06 -1.22 -5.01 118.95 126.50 2nr2 s ARG 54 Ca 0.39 -0.63 -0.07 0.00 -2.50 0.00 0.00 55.73 52.91 2nr2 s ARG 54 Cb 0.09 0.14 0.06 0.00 0.06 0.00 0.00 34.95 35.30 2nr2 s ARG 54 CO 0.10 -0.07 1.02 0.95 -2.50 0.00 0.00 175.30 174.80 2nr2 s THR 55 N -1.70 2.30 0.08 4.11 -4.23 -1.26 -0.82 115.64 114.11 2nr2 s THR 55 Ca -0.13 -0.25 -0.17 0.00 -1.18 0.00 0.00 61.69 59.96 2nr2 s THR 55 Cb -0.08 -3.01 -0.11 0.00 1.34 0.00 0.00 72.50 70.64 2nr2 s THR 55 CO -0.01 -0.02 1.39 -0.07 -0.54 0.00 0.00 174.62 175.37 2nr2 h LEU 56 N -0.61 0.61 -1.14 4.79 3.38 -1.48 -3.32 115.31 117.53 2nr2 h LEU 56 Ca -0.44 -0.48 0.05 0.00 0.09 0.00 0.00 57.88 57.10 2nr2 h LEU 56 Cb 1.32 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 2nr2 h LEU 56 CO 0.61 0.96 0.59 -1.28 0.09 0.00 0.00 178.44 179.40 2nr2 h SER 57 N 0.27 0.92 -0.67 -0.43 0.87 -1.73 -2.01 113.55 110.77 2nr2 h SER 57 Ca 0.04 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.65 2nr2 h SER 57 Cb 0.79 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 62.50 2nr2 h SER 57 CO 0.06 0.61 0.39 -0.78 -0.53 0.00 0.00 176.83 176.58 2nr2 h ASP 58 N 1.06 0.60 -0.08 6.23 3.58 -1.86 0.08 116.42 126.03 2nr2 h ASP 58 Ca 0.38 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.85 2nr2 h ASP 58 Cb 0.14 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.09 2nr2 h ASP 58 CO -0.13 0.40 0.00 -1.22 -2.88 0.00 0.00 179.24 175.40 2nr2 n TYR 59 N -4.75 0.10 -3.35 0.28 4.01 -1.12 -4.91 117.16 107.41 2nr2 n TYR 59 Ca 0.08 -0.05 -0.23 0.00 -0.16 0.00 0.00 57.90 57.54 2nr2 n TYR 59 Cb 0.15 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.23 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 -0.19 -6.25 -4.64 7.72 4.13 0.01 -4.92 115.26 111.12 2nr2 n ASN 60 Ca 0.16 -0.43 -0.43 0.00 1.68 0.00 0.00 54.58 55.56 2nr2 n ASN 60 Cb 0.22 -4.98 -0.02 0.00 -1.54 0.00 0.00 39.78 33.46 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 -3.26 4.07 0.38 2.41 1.01 -0.80 -5.00 121.20 120.01 2nr2 s ILE 61 Ca 0.47 1.23 -0.02 0.00 0.00 0.00 0.00 60.65 62.32 2nr2 s ILE 61 Cb -0.21 -4.00 0.08 0.00 0.01 0.00 0.00 42.46 38.34 2nr2 s ILE 61 CO 0.58 -0.34 0.51 0.00 0.00 0.00 0.00 174.94 175.69 2nr2 n GLN 62 N 7.20 0.05 -1.75 2.79 1.13 -1.26 -4.65 117.38 120.90 2nr2 n GLN 62 Ca 0.15 -1.21 -0.42 0.00 -1.94 0.00 0.00 57.00 53.58 2nr2 n GLN 62 Cb 0.46 -0.40 -0.02 0.00 0.11 0.00 0.00 30.24 30.39 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2nr2 s LYS 63 N -3.85 4.12 -1.04 -1.09 2.20 -1.26 -3.72 119.74 115.08 2nr2 s LYS 63 Ca 0.33 2.60 -0.06 0.00 -0.36 0.00 0.00 55.97 58.48 2nr2 s LYS 63 Cb -0.02 -3.04 0.01 0.00 -1.51 0.00 0.00 37.83 33.27 2nr2 s LYS 63 CO 0.22 -0.69 0.90 0.39 -0.36 0.00 0.00 175.35 175.81 2nr2 n GLU 64 N 2.90 -6.06 -3.91 4.03 1.02 0.39 -5.00 120.64 114.02 2nr2 n GLU 64 Ca 0.11 0.65 -0.21 0.00 -0.02 0.00 0.00 57.16 57.69 2nr2 n GLU 64 Cb 0.36 -5.15 -0.04 0.00 -0.02 0.00 0.00 31.44 26.59 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 -3.41 5.29 -0.10 1.62 0.01 -1.24 -4.87 113.70 111.00 2nr2 s SER 65 Ca 0.37 -0.46 0.01 0.00 1.31 0.00 0.00 55.95 57.18 2nr2 s SER 65 Cb -0.16 -1.05 0.02 0.00 0.21 0.00 0.00 66.02 65.03 2nr2 s SER 65 CO 0.57 -0.27 -0.10 -0.89 0.41 0.00 0.00 173.24 172.96 2nr2 s THR 66 N -2.27 1.12 0.45 1.44 2.01 -1.26 -0.06 115.64 117.06 2nr2 s THR 66 Ca 0.39 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.98 2nr2 s THR 66 Cb -0.06 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.36 2nr2 s THR 66 CO 0.26 0.37 0.69 -0.76 -0.69 0.00 0.00 174.62 174.49 2nr2 s LEU 67 N 1.24 3.69 -0.13 4.42 1.43 -0.14 -4.89 118.68 124.29 2nr2 s LEU 67 Ca -0.03 0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 2nr2 s LEU 67 Cb -0.14 -3.39 0.02 0.00 0.03 0.00 0.00 46.19 42.71 2nr2 s LEU 67 CO -0.03 -0.62 -0.10 -1.00 0.23 0.00 0.00 176.35 174.83 2nr2 s HIS 68 N -2.58 1.76 -0.05 0.29 3.76 0.27 -0.32 115.29 118.40 2nr2 s HIS 68 Ca 0.47 -0.93 -0.30 0.00 -0.15 0.00 0.00 55.06 54.14 2nr2 s HIS 68 Cb -0.10 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 2nr2 s HIS 68 CO 0.40 -0.58 1.18 -1.17 -0.85 0.00 0.00 174.74 173.72 2nr2 s LEU 69 N 1.62 4.28 0.09 0.89 2.96 0.10 -0.58 118.68 128.03 2nr2 s LEU 69 Ca 0.05 1.80 0.09 0.00 -0.22 0.00 0.00 54.13 55.84 2nr2 s LEU 69 Cb -0.13 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 2nr2 s LEU 69 CO -0.09 -0.57 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.46 2nr2 s VAL 70 N 2.15 1.84 0.08 1.68 1.01 0.15 -4.40 120.40 122.91 2nr2 s VAL 70 Ca 0.55 -1.49 0.09 0.00 0.00 0.00 0.00 61.98 61.13 2nr2 s VAL 70 Cb -0.24 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 2nr2 s VAL 70 CO 0.22 0.06 -0.25 -0.76 0.00 0.00 0.00 175.10 174.38 2nr2 s LEU 71 N -1.71 2.23 -0.01 3.92 1.43 -1.26 -0.77 118.68 122.50 2nr2 s LEU 71 Ca 0.09 -0.64 -0.25 0.00 -1.03 0.00 0.00 54.13 52.29 2nr2 s LEU 71 Cb -0.10 -1.15 -0.19 0.00 0.03 0.00 0.00 46.19 44.78 2nr2 s LEU 71 CO 0.04 0.19 1.26 -0.09 0.23 0.00 0.00 176.35 177.98 2nr2 h ARG 72 N 4.42 -0.08 0.00 1.70 2.43 -1.65 -3.47 114.38 117.73 2nr2 h ARG 72 Ca -0.47 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2nr2 h ARG 72 Cb 1.16 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2nr2 h ARG 72 CO 0.42 0.34 0.00 1.28 -1.51 0.00 0.00 179.97 180.49 2nr2 n LEU 73 N -4.92 0.00 -4.85 3.80 4.77 -1.26 -5.09 117.00 109.44 2nr2 n LEU 73 Ca -0.08 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.56 2nr2 n LEU 73 Cb 0.24 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.27 2nr2 n LEU 73 CO 0.32 0.00 0.28 0.00 -1.33 0.00 0.00 177.39 176.66 2nr2 s ARG 74 N 2.52 3.95 -0.52 3.23 1.70 -1.26 -5.05 118.95 123.53 2nr2 s ARG 74 Ca 0.00 0.49 0.03 0.00 -0.47 0.00 0.00 55.73 55.78 2nr2 s ARG 74 Cb 0.00 -2.73 0.14 0.00 -0.57 0.00 0.00 34.95 31.79 2nr2 s ARG 74 CO 0.00 0.35 0.30 0.20 -1.08 0.00 0.00 175.30 175.07 2nr2 s GLY 75 N -2.03 2.17 0.00 3.88 0.00 -1.26 -5.16 107.32 104.92 2nr2 s GLY 75 Ca 0.45 -3.08 0.00 0.00 0.00 0.00 0.00 44.72 42.09 2nr2 s GLY 75 CO 0.20 1.29 0.00 0.61 0.00 0.00 0.00 173.10 175.19