#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 4.05 0.17 3.17 -0.21 -1.26 -0.49 119.66 125.09 2nr2 s GLN 2 Ca 0.00 0.37 0.04 0.00 0.02 0.00 0.00 55.36 55.79 2nr2 s GLN 2 Cb 0.00 -3.29 -0.05 0.00 1.00 0.00 0.00 33.01 30.67 2nr2 s GLN 2 CO 0.00 0.52 -0.07 0.96 -2.12 0.00 0.00 175.29 174.58 2nr2 s ILE 3 N -0.50 1.10 0.01 1.08 -4.36 -0.52 -0.24 121.20 117.76 2nr2 s ILE 3 Ca 0.23 -2.05 0.08 0.00 -0.26 0.00 0.00 60.65 58.65 2nr2 s ILE 3 Cb -0.16 -2.00 -0.02 0.00 1.25 0.00 0.00 42.46 41.53 2nr2 s ILE 3 CO 0.11 -0.62 -0.24 -0.36 0.24 0.00 0.00 174.94 174.08 2nr2 s PHE 4 N -3.37 2.09 -0.19 1.37 0.08 0.50 -1.60 117.98 116.86 2nr2 s PHE 4 Ca 0.20 -0.40 -0.00 0.00 0.12 0.00 0.00 56.93 56.85 2nr2 s PHE 4 Cb 0.04 -1.31 0.01 0.00 -0.57 0.00 0.00 43.02 41.19 2nr2 s PHE 4 CO 0.03 0.03 -0.15 0.08 -0.10 0.00 0.00 175.22 175.11 2nr2 s VAL 5 N -0.66 2.51 -0.15 -0.44 1.01 -0.14 -1.38 120.40 121.15 2nr2 s VAL 5 Ca 0.09 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 2nr2 s VAL 5 Cb -0.09 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 2nr2 s VAL 5 CO 0.00 0.50 0.31 -0.75 0.00 0.00 0.00 175.10 175.16 2nr2 s LYS 6 N 1.29 4.25 0.56 2.72 2.20 -0.81 -1.95 119.74 128.00 2nr2 s LYS 6 Ca 0.04 0.13 -0.07 0.00 -0.36 0.00 0.00 55.97 55.71 2nr2 s LYS 6 Cb -0.14 -3.42 0.12 0.00 -1.51 0.00 0.00 37.83 32.89 2nr2 s LYS 6 CO -0.09 0.25 0.76 0.25 -0.36 0.00 0.00 175.35 176.17 2nr2 n THR 7 N 3.53 0.00 -0.14 3.43 -2.24 -1.08 -2.51 114.28 115.27 2nr2 n THR 7 Ca -0.12 -0.74 -0.12 0.00 -2.27 0.00 0.00 64.05 60.80 2nr2 n THR 7 Cb 0.52 -1.48 -0.02 0.00 -2.10 0.00 0.00 70.33 67.25 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 0.91 -0.44 3.22 3.38 -1.94 -2.48 115.31 117.97 2nr2 h LEU 8 Ca -0.25 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.31 2nr2 h LEU 8 Cb 0.75 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2nr2 h LEU 8 CO 0.20 1.12 0.00 0.35 0.09 0.00 0.00 178.44 180.21 2nr2 n THR 9 N -4.19 0.76 -0.68 0.22 -2.24 -1.26 -4.89 114.28 101.99 2nr2 n THR 9 Ca -0.01 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2nr2 n THR 9 Cb 0.45 -0.99 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 2nr2 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nr2 n GLY 10 N 0.35 1.43 3.78 3.38 0.00 -0.93 -5.07 105.19 108.13 2nr2 n GLY 10 Ca 0.03 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.99 4.05 -0.94 1.61 2.20 -1.26 -4.74 119.74 118.67 2nr2 s LYS 11 Ca 0.00 0.17 -0.20 0.00 -0.36 0.00 0.00 55.97 55.58 2nr2 s LYS 11 Cb 0.00 -3.34 0.10 0.00 -1.51 0.00 0.00 37.83 33.09 2nr2 s LYS 11 CO 0.00 0.43 1.21 0.99 -0.36 0.00 0.00 175.35 177.62 2nr2 s THR 12 N -0.14 4.47 -0.43 3.43 2.01 -1.26 -2.64 115.64 121.08 2nr2 s THR 12 Ca 0.19 -1.28 -0.29 0.00 0.31 0.00 0.00 61.69 60.61 2nr2 s THR 12 Cb -0.14 -4.86 0.03 0.00 0.01 0.00 0.00 72.50 67.54 2nr2 s THR 12 CO 0.07 -1.63 1.13 -0.63 -0.69 0.00 0.00 174.62 172.87 2nr2 s ILE 13 N 3.42 4.28 -0.34 1.82 -1.09 -0.82 -4.93 121.20 123.54 2nr2 s ILE 13 Ca 0.36 1.37 -0.11 0.00 -2.23 0.00 0.00 60.65 60.04 2nr2 s ILE 13 Cb -0.04 -4.53 0.00 0.00 -1.58 0.00 0.00 42.46 36.31 2nr2 s ILE 13 CO -0.09 -0.84 0.18 -0.89 -1.23 0.00 0.00 174.94 172.08 2nr2 s THR 14 N 4.25 4.70 -0.03 2.92 2.01 -1.26 -0.97 115.64 127.26 2nr2 s THR 14 Ca 0.48 -0.53 -0.00 0.00 0.31 0.00 0.00 61.69 61.95 2nr2 s THR 14 Cb -0.09 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.91 2nr2 s THR 14 CO 0.27 -0.04 0.02 -0.76 -0.69 0.00 0.00 174.62 173.42 2nr2 s LEU 15 N 1.61 3.64 -0.21 4.42 1.43 -0.63 -4.95 118.68 123.99 2nr2 s LEU 15 Ca 0.04 0.08 -0.17 0.00 -1.03 0.00 0.00 54.13 53.05 2nr2 s LEU 15 Cb -0.18 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2nr2 s LEU 15 CO 0.07 0.31 0.45 -0.70 0.23 0.00 0.00 176.35 176.71 2nr2 s GLU 16 N -1.39 4.15 0.13 1.70 2.12 -1.26 -1.43 118.70 122.72 2nr2 s GLU 16 Ca 0.18 0.28 0.03 0.00 0.36 0.00 0.00 54.97 55.82 2nr2 s GLU 16 Cb -0.12 -3.57 -0.04 0.00 0.26 0.00 0.00 34.13 30.66 2nr2 s GLU 16 CO 0.09 -0.13 -0.08 0.14 -0.54 0.00 0.00 175.26 174.74 2nr2 s VAL 17 N 1.60 0.91 0.27 3.70 -7.23 0.36 -4.90 120.40 115.10 2nr2 s VAL 17 Ca 0.21 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.46 2nr2 s VAL 17 Cb -0.15 -1.80 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 2nr2 s VAL 17 CO 0.09 -0.78 0.11 -1.61 -0.31 0.00 0.00 175.10 172.60 2nr2 s GLU 18 N -3.80 2.61 0.22 4.82 0.41 -1.26 -0.30 118.70 121.40 2nr2 s GLU 18 Ca 0.15 -1.25 0.24 0.00 -0.41 0.00 0.00 54.97 53.70 2nr2 s GLU 18 Cb 0.04 -2.36 0.92 0.00 -1.78 0.00 0.00 34.13 30.94 2nr2 s GLU 18 CO -0.01 0.35 1.73 -0.35 -0.49 0.00 0.00 175.26 176.49 2nr2 n PRO 19 N -1.07 0.20 0.16 0.39 -0.04 -1.26 -2.61 135.00 130.78 2nr2 n PRO 19 Ca -0.07 0.33 0.04 0.00 -0.04 0.00 0.00 63.50 63.76 2nr2 n PRO 19 Cb 0.59 -1.82 0.20 0.00 -0.04 0.00 0.00 33.50 32.43 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 0.00 0.00 -4.23 3.54 4.64 -1.96 0.23 113.55 115.78 2nr2 h SER 20 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2nr2 h SER 20 Cb 0.49 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 62.76 2nr2 h SER 20 CO 0.00 0.45 0.24 -1.81 -0.87 0.00 0.00 176.83 174.83 2nr2 s ASP 21 N -6.44 3.18 0.48 4.97 1.01 -1.07 -4.63 116.67 114.16 2nr2 s ASP 21 Ca 0.02 2.07 0.01 0.00 0.71 0.00 0.00 52.55 55.36 2nr2 s ASP 21 Cb 0.10 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.50 2nr2 s ASP 21 CO 0.71 -2.92 0.70 0.42 0.21 0.00 0.00 175.17 174.29 2nr2 s THR 22 N -2.70 3.50 0.22 -1.27 -4.23 -1.26 -2.33 115.64 107.57 2nr2 s THR 22 Ca 0.66 -0.59 0.02 0.00 -1.18 0.00 0.00 61.69 60.59 2nr2 s THR 22 Cb -0.22 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 70.29 2nr2 s THR 22 CO 0.58 -0.20 1.55 0.40 -0.54 0.00 0.00 174.62 176.41 2nr2 h ILE 23 N 0.30 1.35 -0.48 2.99 1.08 -1.43 -2.01 117.51 119.32 2nr2 h ILE 23 Ca -0.44 -1.85 0.00 0.00 -0.39 0.00 0.00 64.86 62.18 2nr2 h ILE 23 Cb 1.27 1.87 -0.02 0.00 -3.07 0.00 0.00 36.82 36.87 2nr2 h ILE 23 CO 0.55 0.56 0.32 -0.08 -0.69 0.00 0.00 178.15 178.80 2nr2 h GLU 24 N 0.28 0.63 -0.26 2.37 4.81 -1.52 -1.53 114.58 119.36 2nr2 h GLU 24 Ca 0.00 -0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.01 2nr2 h GLU 24 Cb 1.07 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.31 2nr2 h GLU 24 CO 0.09 0.42 -0.57 -0.91 -0.73 0.00 0.00 179.01 177.32 2nr2 h ASN 25 N 0.65 0.94 -0.87 1.04 4.21 -1.74 -1.11 115.58 118.70 2nr2 h ASN 25 Ca 0.18 -0.55 0.00 0.00 1.21 0.00 0.00 56.30 57.14 2nr2 h ASN 25 Cb -0.07 -0.27 -0.04 0.00 -1.12 0.00 0.00 38.32 36.81 2nr2 h ASN 25 CO -0.04 1.32 0.56 0.58 -1.29 0.00 0.00 177.43 178.56 2nr2 h VAL 26 N 0.60 1.23 -0.91 2.81 2.07 -1.20 0.19 116.25 121.04 2nr2 h VAL 26 Ca 0.00 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2nr2 h VAL 26 Cb 1.18 -0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 2nr2 h VAL 26 CO 0.12 0.23 0.56 0.11 0.02 0.00 0.00 177.57 178.61 2nr2 h LYS 27 N 1.19 1.23 -0.23 1.57 1.57 -1.22 -2.91 116.57 117.77 2nr2 h LYS 27 Ca 0.32 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.92 2nr2 h LYS 27 Cb -0.11 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 31.93 2nr2 h LYS 27 CO -0.07 0.86 -0.17 0.00 -0.57 0.00 0.00 179.45 179.51 2nr2 h ALA 28 N 1.31 1.29 -0.43 3.86 0.00 0.11 -1.25 119.26 124.14 2nr2 h ALA 28 Ca 0.33 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2nr2 h ALA 28 Cb -0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2nr2 h ALA 28 CO -0.06 0.47 0.17 0.87 0.00 0.00 0.00 179.25 180.70 2nr2 h LYS 29 N 0.37 0.34 -0.46 0.00 1.57 -0.59 -0.74 116.57 117.06 2nr2 h LYS 29 Ca 0.07 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.70 2nr2 h LYS 29 Cb 0.51 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2nr2 h LYS 29 CO 0.03 0.23 -0.20 0.82 -0.57 0.00 0.00 179.45 179.76 2nr2 h ILE 30 N 0.35 1.27 -0.85 1.86 2.04 -1.42 -2.35 117.51 118.41 2nr2 h ILE 30 Ca 0.19 -1.35 0.06 0.00 1.00 0.00 0.00 64.86 64.77 2nr2 h ILE 30 Cb 0.16 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.30 2nr2 h ILE 30 CO -0.18 0.46 0.55 -0.61 0.00 0.00 0.00 178.15 178.38 2nr2 h GLN 31 N 0.81 0.93 -0.34 2.37 4.15 -0.94 0.53 115.11 122.62 2nr2 h GLN 31 Ca 0.11 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.38 2nr2 h GLN 31 Cb 0.75 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 2nr2 h GLN 31 CO 0.06 0.62 -0.20 0.22 -1.93 0.00 0.00 178.83 177.60 2nr2 h ASP 32 N 0.96 0.63 0.12 -0.69 3.58 -0.99 0.33 116.42 120.36 2nr2 h ASP 32 Ca 0.36 -0.21 -0.22 0.00 0.42 0.00 0.00 57.03 57.39 2nr2 h ASP 32 Cb 0.19 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 41.08 2nr2 h ASP 32 CO -0.13 0.83 -1.06 0.11 -2.88 0.00 0.00 179.24 176.11 2nr2 h LYS 33 N 0.56 0.26 0.00 0.28 1.79 -1.03 -3.42 116.57 115.01 2nr2 h LYS 33 Ca 0.09 -0.44 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 2nr2 h LYS 33 Cb 0.65 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 2nr2 h LYS 33 CO 0.05 1.21 -0.50 0.39 -1.08 0.00 0.00 179.45 179.52 2nr2 n GLU 34 N -4.06 2.68 0.00 3.15 -0.58 0.14 -5.05 120.64 116.92 2nr2 n GLU 34 Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 2nr2 n GLU 34 Cb 0.84 -0.71 0.00 0.00 -0.57 0.00 0.00 31.44 31.00 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 1.80 3.60 0.62 0.00 0.10 -5.02 105.19 107.74 2nr2 n GLY 35 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 5.31 0.30 -0.61 1.01 -1.25 -4.97 121.20 118.99 2nr2 s ILE 36 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.54 2nr2 s ILE 36 Cb 0.00 -3.54 -0.11 0.00 0.01 0.00 0.00 42.46 38.83 2nr2 s ILE 36 CO 0.00 0.25 1.53 -2.84 0.00 0.00 0.00 174.94 173.88 2nr2 s PRO 37 N 1.72 4.16 0.37 2.79 0.02 -1.26 -3.95 135.00 138.84 2nr2 s PRO 37 Ca 0.07 2.51 0.20 0.00 0.02 0.00 0.00 61.00 63.80 2nr2 s PRO 37 Cb -0.16 -3.03 1.07 0.00 0.02 0.00 0.00 34.50 32.40 2nr2 s PRO 37 CO 0.10 -0.55 1.56 -1.35 -0.33 0.00 0.00 177.00 176.43 2nr2 h PRO 38 N 4.47 0.00 0.00 5.54 0.11 -1.92 0.56 132.00 140.75 2nr2 h PRO 38 Ca -0.48 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2nr2 h PRO 38 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2nr2 h PRO 38 CO 0.76 0.00 -0.52 -0.44 -0.21 0.00 0.00 178.00 177.59 2nr2 h ASP 39 N 0.00 0.00 0.74 -2.05 3.32 -1.99 -3.25 116.42 113.19 2nr2 h ASP 39 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 2nr2 h ASP 39 Cb 0.31 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 2nr2 h ASP 39 CO 0.00 0.52 -1.36 1.56 -1.72 0.00 0.00 179.24 178.23 2nr2 h GLN 40 N 0.00 0.00 -6.22 3.56 4.20 -1.14 -3.44 115.11 112.08 2nr2 h GLN 40 Ca -0.01 -0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2nr2 h GLN 40 Cb 1.20 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.94 2nr2 h GLN 40 CO 0.07 0.74 0.95 -0.65 -0.67 0.00 0.00 178.83 179.26 2nr2 s GLN 41 N -2.65 4.11 -0.20 1.46 -0.21 -1.13 0.27 119.66 121.30 2nr2 s GLN 41 Ca -0.02 1.56 0.01 0.00 0.02 0.00 0.00 55.36 56.93 2nr2 s GLN 41 Cb 0.09 -3.83 0.04 0.00 1.00 0.00 0.00 33.01 30.31 2nr2 s GLN 41 CO 0.82 -0.87 -0.15 0.50 -2.12 0.00 0.00 175.29 173.47 2nr2 s ARG 42 N 3.80 2.48 -0.19 2.91 3.52 -0.27 -4.88 118.95 126.32 2nr2 s ARG 42 Ca 0.57 -0.92 -0.10 0.00 -0.13 0.00 0.00 55.73 55.15 2nr2 s ARG 42 Cb -0.21 -2.54 -0.05 0.00 -1.56 0.00 0.00 34.95 30.59 2nr2 s ARG 42 CO 0.19 -0.35 0.15 -0.51 -0.81 0.00 0.00 175.30 173.97 2nr2 s LEU 43 N 1.30 4.22 -0.22 -0.88 1.43 -1.26 -1.07 118.68 122.20 2nr2 s LEU 43 Ca 0.00 0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 53.35 2nr2 s LEU 43 Cb -0.15 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 43.94 2nr2 s LEU 43 CO -0.10 0.18 -0.07 -0.63 0.23 0.00 0.00 176.35 175.96 2nr2 s ILE 44 N 0.32 3.09 -0.11 -0.59 1.01 0.07 -1.30 121.20 123.69 2nr2 s ILE 44 Ca 0.09 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 60.13 2nr2 s ILE 44 Cb -0.11 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 2nr2 s ILE 44 CO -0.01 0.42 -0.14 0.12 0.00 0.00 0.00 174.94 175.33 2nr2 s PHE 45 N 1.43 2.76 0.00 3.97 5.36 0.62 -0.51 117.98 131.62 2nr2 s PHE 45 Ca 0.05 -0.58 0.00 0.00 -0.96 0.00 0.00 56.93 55.44 2nr2 s PHE 45 Cb -0.14 -1.78 0.00 0.00 -0.34 0.00 0.00 43.02 40.75 2nr2 s PHE 45 CO -0.05 -0.15 0.00 0.00 -1.46 0.00 0.00 175.22 173.56 2nr2 n ALA 46 N 3.27 0.00 -0.28 11.12 0.00 -1.26 0.08 120.51 133.43 2nr2 n ALA 46 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2nr2 n ALA 46 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 1.01 3.68 0.00 0.00 -1.26 -5.05 105.19 103.57 2nr2 n GLY 47 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.62 3.21 -0.34 1.61 1.02 0.11 -5.08 119.74 119.65 2nr2 s LYS 48 Ca 0.00 -0.38 -0.11 0.00 0.02 0.00 0.00 55.97 55.50 2nr2 s LYS 48 Cb 0.00 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 2nr2 s LYS 48 CO 0.00 0.62 0.19 -0.65 -0.92 0.00 0.00 175.35 174.59 2nr2 s GLN 49 N -0.64 3.21 0.05 1.68 -0.21 -1.26 -0.27 119.66 122.22 2nr2 s GLN 49 Ca 0.11 -0.82 -0.31 0.00 0.02 0.00 0.00 55.36 54.36 2nr2 s GLN 49 Cb -0.12 -3.67 -0.07 0.00 1.00 0.00 0.00 33.01 30.15 2nr2 s GLN 49 CO 0.02 -0.51 1.51 -0.51 -2.12 0.00 0.00 175.29 173.68 2nr2 s LEU 50 N 1.62 4.35 -0.05 2.90 1.43 -0.42 -5.00 118.68 123.51 2nr2 s LEU 50 Ca 0.04 2.32 -0.18 0.00 -1.03 0.00 0.00 54.13 55.28 2nr2 s LEU 50 Cb -0.18 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.43 2nr2 s LEU 50 CO 0.07 -0.78 0.50 -1.61 0.23 0.00 0.00 176.35 174.77 2nr2 s GLU 51 N 2.22 4.24 0.19 1.70 2.02 -1.26 -4.67 118.70 123.14 2nr2 s GLU 51 Ca 0.68 0.55 -0.18 0.00 0.02 0.00 0.00 54.97 56.04 2nr2 s GLU 51 Cb -0.36 -3.35 0.16 0.00 0.10 0.00 0.00 34.13 30.68 2nr2 s GLU 51 CO 0.30 0.37 1.61 -0.44 0.02 0.00 0.00 175.26 177.11 2nr2 h ASP 52 N 5.82 -0.89 -2.30 -0.19 5.19 -1.95 -3.01 116.42 119.09 2nr2 h ASP 52 Ca -0.45 0.20 -0.79 0.00 -0.62 0.00 0.00 57.03 55.37 2nr2 h ASP 52 Cb 1.20 0.48 -0.23 0.00 0.18 0.00 0.00 39.33 40.95 2nr2 h ASP 52 CO 0.70 -0.27 1.27 0.61 -3.12 0.00 0.00 179.24 178.44 2nr2 n GLY 53 N -1.43 5.14 3.15 2.75 0.00 -1.26 -1.40 105.19 112.13 2nr2 n GLY 53 Ca 0.05 -2.46 -0.10 0.00 0.00 0.00 0.00 46.02 43.52 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 -1.86 0.91 0.48 1.61 1.81 -1.14 -5.04 118.95 115.72 2nr2 s ARG 54 Ca 0.35 -1.43 0.01 0.00 -1.72 0.00 0.00 55.73 52.95 2nr2 s ARG 54 Cb 0.08 0.19 0.01 0.00 -0.45 0.00 0.00 34.95 34.79 2nr2 s ARG 54 CO 0.05 -0.23 0.70 0.95 -0.68 0.00 0.00 175.30 176.08 2nr2 s THR 55 N -4.00 3.56 0.25 0.02 -4.23 -1.26 -2.69 115.64 107.28 2nr2 s THR 55 Ca 0.22 -0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 60.10 2nr2 s THR 55 Cb 0.07 -3.32 0.25 0.00 1.34 0.00 0.00 72.50 70.84 2nr2 s THR 55 CO 0.01 -0.22 1.92 -0.07 -0.54 0.00 0.00 174.62 175.72 2nr2 h LEU 56 N 0.31 1.12 -0.36 4.79 3.38 -1.41 -3.08 115.31 120.06 2nr2 h LEU 56 Ca -0.45 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 57.56 2nr2 h LEU 56 Cb 1.27 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 2nr2 h LEU 56 CO 0.55 0.81 0.03 -1.28 0.09 0.00 0.00 178.44 178.64 2nr2 h SER 57 N 1.32 -0.07 -0.96 -0.43 0.87 -1.23 -2.18 113.55 110.87 2nr2 h SER 57 Ca 0.36 0.07 0.24 0.00 -1.23 0.00 0.00 61.79 61.23 2nr2 h SER 57 Cb -0.14 0.12 -0.07 0.00 -0.44 0.00 0.00 62.40 61.87 2nr2 h SER 57 CO -0.08 -0.00 0.64 0.44 -0.53 0.00 0.00 176.83 177.30 2nr2 h ASP 58 N 0.14 0.32 -0.06 6.23 3.32 -1.83 -0.79 116.42 123.75 2nr2 h ASP 58 Ca 0.17 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2nr2 h ASP 58 Cb 0.22 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2nr2 h ASP 58 CO -0.26 0.10 0.00 -1.22 -1.72 0.00 0.00 179.24 176.14 2nr2 n TYR 59 N -4.47 0.06 -3.91 4.55 4.01 -0.90 -4.96 117.16 111.54 2nr2 n TYR 59 Ca 0.21 -0.03 -0.28 0.00 -0.16 0.00 0.00 57.90 57.64 2nr2 n TYR 59 Cb 0.83 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.88 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 0.28 -3.26 -4.57 7.72 4.13 -0.30 -4.97 115.26 114.28 2nr2 n ASN 60 Ca 0.18 -0.84 -0.42 0.00 1.68 0.00 0.00 54.58 55.18 2nr2 n ASN 60 Cb 0.36 -3.70 -0.07 0.00 -1.54 0.00 0.00 39.78 34.84 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 -3.46 4.93 0.48 2.41 1.01 -0.87 -5.03 121.20 120.67 2nr2 s ILE 61 Ca 0.44 0.55 0.03 0.00 0.00 0.00 0.00 60.65 61.67 2nr2 s ILE 61 Cb -0.23 -4.04 0.09 0.00 0.01 0.00 0.00 42.46 38.29 2nr2 s ILE 61 CO 0.84 -0.27 0.67 0.00 0.00 0.00 0.00 174.94 176.18 2nr2 n GLN 62 N 5.95 0.34 -1.62 2.79 1.13 -1.26 -4.72 117.38 119.99 2nr2 n GLN 62 Ca -0.02 -2.09 -0.35 0.00 -1.94 0.00 0.00 57.00 52.60 2nr2 n GLN 62 Cb 0.49 -0.36 0.08 0.00 0.11 0.00 0.00 30.24 30.55 2nr2 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2nr2 s LYS 63 N -4.17 2.40 -1.26 -1.09 -2.85 -1.26 -3.67 119.74 107.83 2nr2 s LYS 63 Ca 0.46 1.83 0.00 0.00 -1.00 0.00 0.00 55.97 57.27 2nr2 s LYS 63 Cb -0.03 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.88 2nr2 s LYS 63 CO 0.30 -1.66 0.00 0.39 0.10 0.00 0.00 175.35 174.49 2nr2 n GLU 64 N -2.32 -1.05 -2.68 1.78 1.02 0.66 -4.96 120.64 113.10 2nr2 n GLU 64 Ca 0.14 0.89 -0.24 0.00 -0.02 0.00 0.00 57.16 57.93 2nr2 n GLU 64 Cb 0.50 -4.98 0.02 0.00 -0.02 0.00 0.00 31.44 26.96 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2nr2 s SER 65 N -2.71 5.66 -0.27 1.62 1.04 -1.24 -4.78 113.70 113.02 2nr2 s SER 65 Ca 0.00 0.46 0.03 0.00 0.48 0.00 0.00 55.95 56.92 2nr2 s SER 65 Cb 0.00 -1.55 0.07 0.00 0.10 0.00 0.00 66.02 64.63 2nr2 s SER 65 CO 0.00 -0.91 -0.08 -0.89 0.98 0.00 0.00 173.24 172.33 2nr2 s THR 66 N -2.78 2.08 0.15 2.02 2.01 -1.26 -0.37 115.64 117.49 2nr2 s THR 66 Ca 0.52 -1.66 -0.28 0.00 0.31 0.00 0.00 61.69 60.58 2nr2 s THR 66 Cb -0.10 -2.25 -0.07 0.00 0.01 0.00 0.00 72.50 70.08 2nr2 s THR 66 CO 0.41 -0.11 0.88 -0.76 -0.69 0.00 0.00 174.62 174.35 2nr2 s LEU 67 N 1.12 4.56 -0.34 4.42 1.43 -0.48 -4.77 118.68 124.62 2nr2 s LEU 67 Ca -0.06 1.75 -0.14 0.00 -1.03 0.00 0.00 54.13 54.65 2nr2 s LEU 67 Cb -0.20 -3.47 -0.01 0.00 0.03 0.00 0.00 46.19 42.54 2nr2 s LEU 67 CO -0.06 0.08 0.31 -1.00 0.23 0.00 0.00 176.35 175.92 2nr2 s HIS 68 N -0.64 3.22 -0.39 0.29 3.76 0.34 -1.92 115.29 119.94 2nr2 s HIS 68 Ca 0.41 -0.11 -0.19 0.00 -0.15 0.00 0.00 55.06 55.03 2nr2 s HIS 68 Cb -0.24 -2.59 0.01 0.00 1.11 0.00 0.00 32.58 30.87 2nr2 s HIS 68 CO 0.29 -0.41 0.54 -1.17 -0.85 0.00 0.00 174.74 173.14 2nr2 s LEU 69 N 1.90 4.50 -0.05 0.89 2.96 -1.05 -0.75 118.68 127.08 2nr2 s LEU 69 Ca 0.09 -0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 53.71 2nr2 s LEU 69 Cb -0.17 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.89 2nr2 s LEU 69 CO 0.11 -0.60 0.12 -0.69 -1.32 0.00 0.00 176.35 173.97 2nr2 s VAL 70 N 2.47 5.09 -0.34 1.68 1.01 -0.23 -4.00 120.40 126.07 2nr2 s VAL 70 Ca 0.19 -0.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 2nr2 s VAL 70 Cb -0.15 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 32.94 2nr2 s VAL 70 CO 0.15 0.45 0.20 -0.76 0.00 0.00 0.00 175.10 175.14 2nr2 s LEU 71 N -1.49 4.44 0.38 3.92 1.43 -1.26 -1.11 118.68 124.99 2nr2 s LEU 71 Ca 0.21 -0.67 -0.24 0.00 -1.03 0.00 0.00 54.13 52.40 2nr2 s LEU 71 Cb -0.12 -2.04 -0.10 0.00 0.03 0.00 0.00 46.19 43.96 2nr2 s LEU 71 CO 0.11 -0.28 0.98 -0.60 0.23 0.00 0.00 176.35 176.79 2nr2 s ARG 72 N 1.62 4.32 0.36 1.70 3.52 0.14 -4.99 118.95 125.63 2nr2 s ARG 72 Ca 0.04 1.31 0.07 0.00 -0.13 0.00 0.00 55.73 57.03 2nr2 s ARG 72 Cb -0.18 -2.50 -0.01 0.00 -1.56 0.00 0.00 34.95 30.70 2nr2 s ARG 72 CO 0.07 0.04 0.43 -0.51 -0.81 0.00 0.00 175.30 174.52 2nr2 s LEU 73 N -2.63 3.74 -0.80 -0.88 1.43 -1.26 -4.60 118.68 113.68 2nr2 s LEU 73 Ca 0.57 -0.39 -0.18 0.00 -1.03 0.00 0.00 54.13 53.10 2nr2 s LEU 73 Cb -0.16 -2.49 0.14 0.00 0.03 0.00 0.00 46.19 43.70 2nr2 s LEU 73 CO 0.21 -0.50 0.94 -0.60 0.23 0.00 0.00 176.35 176.63 2nr2 s ARG 74 N -4.15 3.42 0.00 1.70 3.52 -1.26 -4.57 118.95 117.61 2nr2 s ARG 74 Ca 0.46 -1.71 0.00 0.00 -0.13 0.00 0.00 55.73 54.35 2nr2 s ARG 74 Cb -0.08 -4.59 0.00 0.00 -1.56 0.00 0.00 34.95 28.72 2nr2 s ARG 74 CO 0.30 -1.62 0.00 0.41 -0.81 0.00 0.00 175.30 173.57 2nr2 n GLY 75 N 5.11 -1.87 0.00 8.12 0.00 -1.26 -5.30 105.19 110.00 2nr2 n GLY 75 Ca 0.11 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.91 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93