#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 3.08 0.13 2.12 -0.21 -1.26 -0.64 119.66 122.88 2nr2 s GLN 2 Ca 0.00 -0.35 0.08 0.00 0.02 0.00 0.00 55.36 55.11 2nr2 s GLN 2 Cb 0.00 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 31.09 2nr2 s GLN 2 CO 0.00 0.72 -0.18 0.96 -2.12 0.00 0.00 175.29 174.67 2nr2 s ILE 3 N -0.92 1.68 -0.15 1.08 -4.36 -0.79 -0.50 121.20 117.24 2nr2 s ILE 3 Ca 0.14 -1.73 -0.08 0.00 -0.26 0.00 0.00 60.65 58.71 2nr2 s ILE 3 Cb -0.11 -1.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.89 2nr2 s ILE 3 CO 0.03 -0.23 0.14 -0.36 0.24 0.00 0.00 174.94 174.76 2nr2 s PHE 4 N -1.70 3.52 -0.35 1.37 0.08 -0.04 -1.26 117.98 119.59 2nr2 s PHE 4 Ca 0.11 0.45 -0.01 0.00 0.12 0.00 0.00 56.93 57.59 2nr2 s PHE 4 Cb -0.07 -2.04 0.08 0.00 -0.57 0.00 0.00 43.02 40.42 2nr2 s PHE 4 CO 0.05 0.54 0.10 0.08 -0.10 0.00 0.00 175.22 175.89 2nr2 s VAL 5 N -0.41 3.01 -0.11 -0.44 1.01 0.89 -0.87 120.40 123.49 2nr2 s VAL 5 Ca 0.12 -1.83 -0.28 0.00 0.00 0.00 0.00 61.98 60.00 2nr2 s VAL 5 Cb -0.12 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 2nr2 s VAL 5 CO 0.01 -0.44 0.91 -0.75 0.00 0.00 0.00 175.10 174.84 2nr2 s LYS 6 N 1.15 4.40 0.00 2.72 2.47 0.21 -1.58 119.74 129.12 2nr2 s LYS 6 Ca 0.03 1.22 0.00 0.00 -1.56 0.00 0.00 55.97 55.66 2nr2 s LYS 6 Cb -0.21 -3.53 0.00 0.00 -1.46 0.00 0.00 37.83 32.63 2nr2 s LYS 6 CO -0.04 -0.24 0.00 0.25 0.16 0.00 0.00 175.35 175.49 2nr2 n THR 7 N 4.43 0.00 0.11 3.43 -2.24 -0.51 -0.62 114.28 118.87 2nr2 n THR 7 Ca 0.06 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.76 2nr2 n THR 7 Cb 0.49 -1.80 -0.05 0.00 -2.10 0.00 0.00 70.33 66.87 2nr2 n THR 7 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2nr2 h LEU 8 N 0.00 -0.30 -1.65 3.22 5.85 -1.89 -3.38 115.31 117.17 2nr2 h LEU 8 Ca 0.00 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2nr2 h LEU 8 Cb 0.00 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2nr2 h LEU 8 CO 0.00 0.19 -0.11 0.71 -0.34 0.00 0.00 178.44 178.89 2nr2 h THR 9 N -1.03 0.37 0.00 1.05 1.35 -1.97 -3.45 112.91 109.24 2nr2 h THR 9 Ca -0.04 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 2nr2 h THR 9 Cb 0.41 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2nr2 h THR 9 CO 0.06 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.05 2nr2 n GLY 10 N -0.28 0.91 3.73 5.82 0.00 -1.26 -5.14 105.19 108.97 2nr2 n GLY 10 Ca -0.01 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 4.39 -0.20 1.61 2.20 -1.26 -4.93 119.74 121.55 2nr2 s LYS 11 Ca 0.00 0.75 -0.04 0.00 -0.36 0.00 0.00 55.97 56.31 2nr2 s LYS 11 Cb 0.00 -3.42 -0.02 0.00 -1.51 0.00 0.00 37.83 32.88 2nr2 s LYS 11 CO 0.00 0.15 -0.02 0.99 -0.36 0.00 0.00 175.35 176.11 2nr2 s THR 12 N 0.55 3.77 -0.16 3.43 2.01 -1.26 -1.43 115.64 122.56 2nr2 s THR 12 Ca 0.33 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.94 2nr2 s THR 12 Cb -0.17 -2.70 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 2nr2 s THR 12 CO 0.16 0.44 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.82 2nr2 s ILE 13 N 1.01 3.44 -0.32 1.82 1.01 -0.61 -4.94 121.20 122.61 2nr2 s ILE 13 Ca 0.01 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.04 2nr2 s ILE 13 Cb -0.14 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 2nr2 s ILE 13 CO 0.01 0.49 0.18 -0.89 0.00 0.00 0.00 174.94 174.74 2nr2 s THR 14 N 0.55 4.84 0.20 2.92 2.01 -1.26 -0.08 115.64 124.83 2nr2 s THR 14 Ca -0.05 -0.33 0.06 0.00 0.31 0.00 0.00 61.69 61.68 2nr2 s THR 14 Cb -0.15 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2nr2 s THR 14 CO 0.03 0.06 0.17 -0.76 -0.69 0.00 0.00 174.62 173.43 2nr2 s LEU 15 N 1.65 3.83 -0.32 4.42 1.43 -0.39 -4.97 118.68 124.35 2nr2 s LEU 15 Ca 0.05 -0.17 -0.05 0.00 -1.03 0.00 0.00 54.13 52.93 2nr2 s LEU 15 Cb -0.17 -2.41 0.04 0.00 0.03 0.00 0.00 46.19 43.68 2nr2 s LEU 15 CO 0.08 0.02 0.06 -0.70 0.23 0.00 0.00 176.35 176.03 2nr2 s GLU 16 N -3.45 2.62 0.26 1.70 2.12 -1.26 -1.89 118.70 118.80 2nr2 s GLU 16 Ca 0.32 -1.16 0.11 0.00 0.36 0.00 0.00 54.97 54.60 2nr2 s GLU 16 Cb -0.09 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.92 2nr2 s GLU 16 CO 0.24 -0.61 -0.17 0.14 -0.54 0.00 0.00 175.26 174.32 2nr2 s VAL 17 N 1.36 2.62 0.18 3.70 -7.23 0.18 -4.94 120.40 116.28 2nr2 s VAL 17 Ca -0.02 -2.26 -0.14 0.00 -1.81 0.00 0.00 61.98 57.75 2nr2 s VAL 17 Cb -0.19 -2.36 -0.07 0.00 0.56 0.00 0.00 36.38 34.32 2nr2 s VAL 17 CO 0.01 -0.35 0.57 -0.70 -0.31 0.00 0.00 175.10 174.33 2nr2 s GLU 18 N -3.39 3.96 0.00 4.82 2.56 -1.26 -1.35 118.70 124.04 2nr2 s GLU 18 Ca 0.29 0.48 0.20 0.00 0.00 0.00 0.00 54.97 55.94 2nr2 s GLU 18 Cb -0.06 -2.84 1.03 0.00 2.00 0.00 0.00 34.13 34.27 2nr2 s GLU 18 CO 0.15 0.42 1.64 -0.35 -0.56 0.00 0.00 175.26 176.56 2nr2 n PRO 19 N 0.52 0.30 -0.15 4.30 -0.04 -1.26 -1.42 135.00 137.26 2nr2 n PRO 19 Ca -0.03 0.09 0.08 0.00 -0.04 0.00 0.00 63.50 63.60 2nr2 n PRO 19 Cb 0.52 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.73 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2nr2 n SER 20 N -1.28 1.89 -4.81 3.54 7.64 -1.26 -1.62 113.62 117.72 2nr2 n SER 20 Ca 0.10 -1.88 -0.36 0.00 1.01 0.00 0.00 58.87 57.73 2nr2 n SER 20 Cb 0.16 -0.19 -0.06 0.00 -1.01 0.00 0.00 64.21 63.11 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2nr2 s ASP 21 N -1.24 7.10 0.57 6.43 1.01 -0.50 -4.94 116.67 125.10 2nr2 s ASP 21 Ca 0.28 1.46 -0.09 0.00 0.71 0.00 0.00 52.55 54.92 2nr2 s ASP 21 Cb 0.15 -2.44 -0.03 0.00 1.01 0.00 0.00 42.92 41.61 2nr2 s ASP 21 CO 0.21 0.04 0.94 0.42 0.21 0.00 0.00 175.17 176.99 2nr2 s THR 22 N -1.50 4.66 0.29 -1.27 -4.23 -1.26 -2.08 115.64 110.25 2nr2 s THR 22 Ca 0.43 0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 61.50 2nr2 s THR 22 Cb -0.17 -3.83 0.28 0.00 1.34 0.00 0.00 72.50 70.12 2nr2 s THR 22 CO 0.21 -0.98 1.91 0.40 -0.54 0.00 0.00 174.62 175.63 2nr2 h ILE 23 N -0.14 1.10 -0.81 2.99 1.08 -1.14 -1.22 117.51 119.36 2nr2 h ILE 23 Ca -0.45 -0.38 0.20 0.00 -0.39 0.00 0.00 64.86 63.84 2nr2 h ILE 23 Cb 1.20 -0.09 -0.13 0.00 -3.07 0.00 0.00 36.82 34.73 2nr2 h ILE 23 CO 0.62 0.20 0.21 -0.08 -0.69 0.00 0.00 178.15 178.41 2nr2 h GLU 24 N 1.10 0.25 0.00 2.37 4.81 -1.83 -2.49 114.58 118.79 2nr2 h GLU 24 Ca 0.39 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 2nr2 h GLU 24 Cb 0.14 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 2nr2 h GLU 24 CO -0.14 0.16 -0.05 -0.91 -0.73 0.00 0.00 179.01 177.34 2nr2 h ASN 25 N 0.25 0.00 0.07 1.04 2.35 -1.56 -2.03 115.58 115.71 2nr2 h ASN 25 Ca 0.48 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.97 2nr2 h ASN 25 Cb 0.90 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.29 2nr2 h ASN 25 CO -0.58 0.05 -1.07 0.58 -1.65 0.00 0.00 177.43 174.77 2nr2 h VAL 26 N 0.00 1.30 -0.52 2.81 2.07 -1.03 -2.74 116.25 118.13 2nr2 h VAL 26 Ca -0.00 -2.31 -0.08 0.00 0.82 0.00 0.00 66.70 65.13 2nr2 h VAL 26 Cb 0.67 2.44 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 2nr2 h VAL 26 CO 0.01 0.71 0.01 0.11 0.02 0.00 0.00 177.57 178.43 2nr2 h LYS 27 N 0.36 0.91 -0.76 1.57 1.57 -1.23 -2.32 116.57 116.67 2nr2 h LYS 27 Ca -0.13 -0.28 0.13 0.00 -1.87 0.00 0.00 60.65 58.49 2nr2 h LYS 27 Cb 1.72 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 33.86 2nr2 h LYS 27 CO 0.21 0.93 0.35 0.00 -0.57 0.00 0.00 179.45 180.36 2nr2 h ALA 28 N 0.95 1.09 -0.19 3.86 0.00 -1.38 -0.66 119.26 122.92 2nr2 h ALA 28 Ca 0.15 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2nr2 h ALA 28 Cb 0.51 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2nr2 h ALA 28 CO 0.02 -0.12 0.04 0.87 0.00 0.00 0.00 179.25 180.06 2nr2 h LYS 29 N 0.54 0.27 0.05 0.00 1.57 -1.23 -2.17 116.57 115.60 2nr2 h LYS 29 Ca 0.40 -0.03 -0.25 0.00 -1.87 0.00 0.00 60.65 58.90 2nr2 h LYS 29 Cb 0.54 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2nr2 h LYS 29 CO -0.35 0.27 -1.22 0.82 -0.57 0.00 0.00 179.45 178.40 2nr2 h ILE 30 N 0.27 1.48 -0.93 1.86 2.04 -0.66 -0.42 117.51 121.15 2nr2 h ILE 30 Ca 0.07 -3.16 0.09 0.00 1.00 0.00 0.00 64.86 62.86 2nr2 h ILE 30 Cb 0.13 2.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.95 2nr2 h ILE 30 CO -0.00 0.88 0.60 -0.61 0.00 0.00 0.00 178.15 179.01 2nr2 h GLN 31 N 0.03 0.94 0.03 2.37 4.15 -1.15 0.55 115.11 122.03 2nr2 h GLN 31 Ca -0.11 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.25 2nr2 h GLN 31 Cb 1.89 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 29.36 2nr2 h GLN 31 CO 0.15 0.62 -0.01 0.22 -1.93 0.00 0.00 178.83 177.87 2nr2 h ASP 32 N 0.97 -0.03 0.31 -0.69 3.58 -1.31 -2.90 116.42 116.33 2nr2 h ASP 32 Ca 0.42 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.64 2nr2 h ASP 32 Cb 0.35 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2nr2 h ASP 32 CO -0.18 0.20 -0.15 0.50 -2.88 0.00 0.00 179.24 176.73 2nr2 h LYS 33 N -0.27 -0.40 0.00 0.28 1.63 -0.60 -3.42 116.57 113.79 2nr2 h LYS 33 Ca -0.00 0.03 -0.36 0.00 -0.85 0.00 0.00 60.65 59.47 2nr2 h LYS 33 Cb 0.25 0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 31.91 2nr2 h LYS 33 CO 0.01 -0.27 -2.35 0.39 -3.45 0.00 0.00 179.45 173.78 2nr2 n GLU 34 N -4.27 0.74 0.00 1.90 -0.58 0.19 -5.00 120.64 113.62 2nr2 n GLU 34 Ca -0.05 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2nr2 n GLU 34 Cb 0.16 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.55 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 2.10 1.16 3.69 0.62 0.00 -0.85 -5.00 105.19 106.92 2nr2 n GLY 35 Ca -0.37 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 4.33 0.69 -0.61 -1.09 -1.25 -4.90 121.20 116.37 2nr2 s ILE 36 Ca 0.00 1.65 -0.15 0.00 -2.23 0.00 0.00 60.65 59.92 2nr2 s ILE 36 Cb 0.00 -4.06 0.02 0.00 -1.58 0.00 0.00 42.46 36.84 2nr2 s ILE 36 CO 0.00 0.02 1.16 -2.16 -1.23 0.00 0.00 174.94 172.73 2nr2 s PRO 37 N 2.01 2.48 0.00 2.79 0.04 -1.26 -3.67 135.00 137.40 2nr2 s PRO 37 Ca 0.55 1.59 0.21 0.00 0.04 0.00 0.00 61.00 63.38 2nr2 s PRO 37 Cb -0.24 -1.89 0.89 0.00 0.04 0.00 0.00 34.50 33.30 2nr2 s PRO 37 CO 0.22 -1.54 1.66 -2.30 0.04 0.00 0.00 177.00 175.09 2nr2 n PRO 38 N -2.53 0.03 -0.20 0.56 -0.02 -1.26 -2.96 135.00 128.63 2nr2 n PRO 38 Ca 0.12 0.14 -0.06 0.00 -2.02 0.00 0.00 63.50 61.68 2nr2 n PRO 38 Cb 0.51 -1.50 0.03 0.00 -0.02 0.00 0.00 33.50 32.52 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2nr2 h ASP 39 N 0.00 0.65 1.02 2.55 3.58 -2.00 -2.79 116.42 119.44 2nr2 h ASP 39 Ca 0.00 -0.02 -0.20 0.00 0.42 0.00 0.00 57.03 57.24 2nr2 h ASP 39 Cb 0.34 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.20 2nr2 h ASP 39 CO 0.00 0.47 -0.94 1.56 -2.88 0.00 0.00 179.24 177.46 2nr2 h GLN 40 N 0.77 0.00 -6.14 0.28 4.20 -1.82 -3.46 115.11 108.94 2nr2 h GLN 40 Ca 0.21 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.36 2nr2 h GLN 40 Cb -0.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 2nr2 h GLN 40 CO -0.05 0.94 1.34 -0.65 -0.67 0.00 0.00 178.83 179.74 2nr2 s GLN 41 N -2.78 3.11 -0.12 1.46 -0.21 -1.05 0.48 119.66 120.55 2nr2 s GLN 41 Ca 0.01 1.38 -0.06 0.00 0.02 0.00 0.00 55.36 56.71 2nr2 s GLN 41 Cb 0.10 -4.28 -0.04 0.00 1.00 0.00 0.00 33.01 29.79 2nr2 s GLN 41 CO 0.81 -2.12 0.11 1.03 -2.12 0.00 0.00 175.29 173.00 2nr2 s ARG 42 N 6.14 3.40 -0.03 2.91 0.52 0.14 -4.94 118.95 127.10 2nr2 s ARG 42 Ca 0.82 -0.19 0.04 0.00 -0.52 0.00 0.00 55.73 55.87 2nr2 s ARG 42 Cb -0.22 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.10 2nr2 s ARG 42 CO 0.31 0.73 -0.12 -0.51 0.02 0.00 0.00 175.30 175.73 2nr2 s LEU 43 N -0.91 2.86 -0.02 2.53 1.43 -1.26 -1.31 118.68 121.99 2nr2 s LEU 43 Ca 0.14 -0.19 0.04 0.00 -1.03 0.00 0.00 54.13 53.09 2nr2 s LEU 43 Cb -0.12 -1.61 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 2nr2 s LEU 43 CO 0.03 0.33 -0.14 -0.63 0.23 0.00 0.00 176.35 176.17 2nr2 s ILE 44 N -0.81 1.15 -0.01 -0.59 -1.09 -0.79 -2.17 121.20 116.89 2nr2 s ILE 44 Ca 0.13 -0.59 -0.03 0.00 -2.23 0.00 0.00 60.65 57.92 2nr2 s ILE 44 Cb -0.11 -0.98 -0.02 0.00 -1.58 0.00 0.00 42.46 39.77 2nr2 s ILE 44 CO 0.02 0.33 -0.08 0.33 -1.23 0.00 0.00 174.94 174.32 2nr2 n PHE 45 N 2.98 0.00 0.00 3.97 7.35 -1.26 -0.75 117.46 129.75 2nr2 n PHE 45 Ca -0.16 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.53 2nr2 n PHE 45 Cb 0.54 -0.17 0.00 0.00 0.35 0.00 0.00 39.48 40.20 2nr2 n PHE 45 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2nr2 n ALA 46 N -3.47 2.40 0.00 3.13 0.00 -1.26 -4.88 120.51 116.43 2nr2 n ALA 46 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2nr2 n ALA 46 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 3.61 0.00 3.89 0.00 0.00 -1.26 -5.07 105.19 106.36 2nr2 n GLY 47 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.85 3.72 -0.20 1.61 1.02 -1.26 -5.06 119.74 117.72 2nr2 s LYS 48 Ca 0.00 0.14 -0.26 0.00 0.02 0.00 0.00 55.97 55.87 2nr2 s LYS 48 Cb 0.00 -2.68 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 2nr2 s LYS 48 CO 0.00 0.31 0.88 -1.14 -0.92 0.00 0.00 175.35 174.47 2nr2 s GLN 49 N -3.01 4.26 0.07 1.68 0.74 -1.26 -4.32 119.66 117.81 2nr2 s GLN 49 Ca 0.45 1.07 -0.30 0.00 0.05 0.00 0.00 55.36 56.64 2nr2 s GLN 49 Cb -0.11 -3.61 -0.05 0.00 1.10 0.00 0.00 33.01 30.34 2nr2 s GLN 49 CO 0.24 -0.44 1.03 -0.51 -0.55 0.00 0.00 175.29 175.06 2nr2 s LEU 50 N 2.55 4.42 0.40 3.68 1.43 -0.92 -5.00 118.68 125.24 2nr2 s LEU 50 Ca 0.39 1.83 -0.08 0.00 -1.03 0.00 0.00 54.13 55.23 2nr2 s LEU 50 Cb -0.16 -3.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.42 2nr2 s LEU 50 CO 0.10 -0.24 0.73 -1.83 0.23 0.00 0.00 176.35 175.34 2nr2 s GLU 51 N 0.53 3.70 0.04 1.70 -1.05 -1.26 -4.59 118.70 117.77 2nr2 s GLU 51 Ca 0.51 0.32 -0.22 0.00 -0.15 0.00 0.00 54.97 55.43 2nr2 s GLU 51 Cb -0.25 -2.44 -0.14 0.00 -0.44 0.00 0.00 34.13 30.86 2nr2 s GLU 51 CO 0.30 -0.02 1.45 -0.44 0.95 0.00 0.00 175.26 177.49 2nr2 h ASP 52 N 1.12 0.19 0.00 0.83 3.32 -1.96 -3.33 116.42 116.59 2nr2 h ASP 52 Ca -0.47 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.24 2nr2 h ASP 52 Cb 1.19 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.69 2nr2 h ASP 52 CO 0.64 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 179.25 2nr2 n GLY 53 N -0.20 1.94 3.00 2.75 0.00 -1.26 -3.01 105.19 108.40 2nr2 n GLY 53 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 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 0.47 0.35 0.38 1.61 0.52 -1.25 -5.05 118.95 115.99 2nr2 s ARG 54 Ca 0.00 -0.66 -0.03 0.00 -0.52 0.00 0.00 55.73 54.52 2nr2 s ARG 54 Cb 0.00 0.08 -0.04 0.00 0.52 0.00 0.00 34.95 35.51 2nr2 s ARG 54 CO 0.00 -0.04 0.64 0.95 0.02 0.00 0.00 175.30 176.86 2nr2 s THR 55 N -1.61 5.01 0.21 0.02 -4.23 -1.26 -1.41 115.64 112.37 2nr2 s THR 55 Ca -0.14 -0.10 -0.12 0.00 -1.18 0.00 0.00 61.69 60.15 2nr2 s THR 55 Cb -0.09 -3.83 0.20 0.00 1.34 0.00 0.00 72.50 70.12 2nr2 s THR 55 CO -0.01 -0.61 1.65 -0.07 -0.54 0.00 0.00 174.62 175.04 2nr2 h LEU 56 N 0.77 -0.36 -1.05 4.79 3.38 -1.47 -2.77 115.31 118.60 2nr2 h LEU 56 Ca -0.48 0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.73 2nr2 h LEU 56 Cb 1.21 0.30 -0.07 0.00 0.09 0.00 0.00 40.66 42.19 2nr2 h LEU 56 CO 0.62 -0.14 0.63 0.77 0.09 0.00 0.00 178.44 180.41 2nr2 h SER 57 N 0.08 0.97 0.19 -0.43 4.64 -1.55 -1.29 113.55 116.16 2nr2 h SER 57 Ca 0.31 0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.67 2nr2 h SER 57 Cb 0.50 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.37 2nr2 h SER 57 CO -0.56 0.59 -0.41 -0.78 -0.87 0.00 0.00 176.83 174.80 2nr2 h ASP 58 N 1.08 -1.17 0.28 4.97 3.58 -1.79 -2.07 116.42 121.30 2nr2 h ASP 58 Ca 0.44 0.12 0.00 0.00 0.42 0.00 0.00 57.03 58.02 2nr2 h ASP 58 Cb 0.29 0.43 0.00 0.00 1.72 0.00 0.00 39.33 41.77 2nr2 h ASP 58 CO -0.19 -0.50 0.00 1.88 -2.88 0.00 0.00 179.24 177.55 2nr2 h TYR 59 N -0.68 0.00 -4.02 0.28 0.05 -1.41 -3.47 116.97 107.72 2nr2 h TYR 59 Ca 0.01 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.62 2nr2 h TYR 59 Cb 0.68 0.00 0.09 0.00 1.01 0.00 0.00 36.73 38.52 2nr2 h TYR 59 CO -0.32 0.00 -0.42 -1.71 -1.05 0.00 0.00 178.16 174.65 2nr2 n ASN 60 N -2.47 -2.41 -4.65 3.88 5.15 -0.72 -5.02 115.26 109.02 2nr2 n ASN 60 Ca -0.01 -0.34 -0.39 0.00 -0.60 0.00 0.00 54.58 53.24 2nr2 n ASN 60 Cb 0.12 -3.00 -0.07 0.00 -0.53 0.00 0.00 39.78 36.30 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2nr2 s ILE 61 N -3.20 5.09 0.00 -1.44 1.01 -0.57 -5.00 121.20 117.09 2nr2 s ILE 61 Ca 0.04 0.95 0.00 0.00 0.00 0.00 0.00 60.65 61.63 2nr2 s ILE 61 Cb -0.01 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.62 2nr2 s ILE 61 CO 0.39 0.14 0.00 0.00 0.00 0.00 0.00 174.94 175.48 2nr2 n GLN 62 N 5.03 0.83 -2.53 2.79 6.02 -1.26 -4.57 117.38 123.69 2nr2 n GLN 62 Ca -0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.54 2nr2 n GLN 62 Cb 0.50 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.72 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2nr2 s LYS 63 N -1.58 4.65 -1.25 -1.09 2.20 -1.26 -3.81 119.74 117.60 2nr2 s LYS 63 Ca 0.00 1.72 -0.02 0.00 -0.36 0.00 0.00 55.97 57.30 2nr2 s LYS 63 Cb 0.00 -3.24 -0.01 0.00 -1.51 0.00 0.00 37.83 33.07 2nr2 s LYS 63 CO 0.00 0.20 0.78 0.39 -0.36 0.00 0.00 175.35 176.36 2nr2 n GLU 64 N 1.75 -4.63 -3.99 4.03 1.02 0.34 -4.99 120.64 114.17 2nr2 n GLU 64 Ca 0.00 0.67 -0.31 0.00 -0.02 0.00 0.00 57.16 57.51 2nr2 n GLU 64 Cb 0.46 -5.28 -0.05 0.00 -0.02 0.00 0.00 31.44 26.55 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 -4.19 5.90 -0.30 1.62 0.01 -1.25 -4.85 113.70 110.65 2nr2 s SER 65 Ca 0.09 0.12 -0.11 0.00 1.31 0.00 0.00 55.95 57.35 2nr2 s SER 65 Cb -0.02 -1.70 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 2nr2 s SER 65 CO 0.79 0.17 0.20 -0.89 0.41 0.00 0.00 173.24 173.92 2nr2 s THR 66 N -1.44 5.20 0.04 1.44 2.01 -1.26 -0.86 115.64 120.77 2nr2 s THR 66 Ca 0.32 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.31 2nr2 s THR 66 Cb -0.13 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 2nr2 s THR 66 CO 0.24 0.16 0.15 -0.76 -0.69 0.00 0.00 174.62 173.72 2nr2 s LEU 67 N 1.73 4.14 -0.19 4.42 1.02 -0.05 -4.80 118.68 124.94 2nr2 s LEU 67 Ca 0.07 0.20 -0.11 0.00 0.02 0.00 0.00 54.13 54.31 2nr2 s LEU 67 Cb -0.16 -2.63 -0.05 0.00 0.02 0.00 0.00 46.19 43.37 2nr2 s LEU 67 CO 0.10 0.21 0.16 -1.00 0.02 0.00 0.00 176.35 175.84 2nr2 s HIS 68 N -1.37 3.42 -0.28 0.29 3.76 0.07 0.66 115.29 121.83 2nr2 s HIS 68 Ca 0.29 0.38 -0.06 0.00 -0.15 0.00 0.00 55.06 55.52 2nr2 s HIS 68 Cb -0.13 -2.19 0.00 0.00 1.11 0.00 0.00 32.58 31.38 2nr2 s HIS 68 CO 0.22 0.29 0.06 -1.17 -0.85 0.00 0.00 174.74 173.28 2nr2 s LEU 69 N 0.36 3.65 -0.19 0.89 2.96 0.21 -1.89 118.68 124.67 2nr2 s LEU 69 Ca 0.09 -0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 53.29 2nr2 s LEU 69 Cb -0.11 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 2nr2 s LEU 69 CO -0.01 -0.15 0.13 -0.69 -1.32 0.00 0.00 176.35 174.32 2nr2 s VAL 70 N 1.50 5.42 -0.41 1.68 1.01 -0.43 -4.24 120.40 124.93 2nr2 s VAL 70 Ca 0.03 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 2nr2 s VAL 70 Cb -0.17 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.76 2nr2 s VAL 70 CO 0.02 0.46 0.70 -0.76 0.00 0.00 0.00 175.10 175.51 2nr2 s LEU 71 N 0.23 4.32 0.06 3.92 1.43 -1.26 0.28 118.68 127.66 2nr2 s LEU 71 Ca 0.09 -0.06 -0.31 0.00 -1.03 0.00 0.00 54.13 52.82 2nr2 s LEU 71 Cb -0.11 -2.85 -0.07 0.00 0.03 0.00 0.00 46.19 43.20 2nr2 s LEU 71 CO -0.01 -0.76 1.37 -0.60 0.23 0.00 0.00 176.35 176.57 2nr2 s ARG 72 N 2.96 4.32 0.00 1.70 3.52 0.18 -4.96 118.95 126.67 2nr2 s ARG 72 Ca 0.26 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 57.85 2nr2 s ARG 72 Cb -0.13 -3.38 0.00 0.00 -1.56 0.00 0.00 34.95 29.87 2nr2 s ARG 72 CO 0.19 -0.46 0.00 1.28 -0.81 0.00 0.00 175.30 175.50 2nr2 n LEU 73 N 4.47 0.00 0.02 -0.88 4.77 -1.26 -4.71 117.00 119.41 2nr2 n LEU 73 Ca 0.12 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.08 2nr2 n LEU 73 Cb 0.43 -0.47 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2nr2 n LEU 73 CO 0.58 -0.50 -0.18 0.54 -1.33 0.00 0.00 177.39 176.51 2nr2 n ARG 74 N -2.49 0.10 0.00 3.23 5.12 -1.26 -5.08 116.66 116.28 2nr2 n ARG 74 Ca 0.00 0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 2nr2 n ARG 74 Cb 0.00 -0.67 0.00 0.00 -1.16 0.00 0.00 32.46 30.63 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2nr2 n GLY 75 N 3.09 2.55 0.00 -0.13 0.00 -1.26 -5.23 105.19 104.22 2nr2 n GLY 75 Ca -0.03 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93