#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 3.46 0.46 3.17 -2.07 -1.26 -1.11 119.66 122.31 2nr2 s GLN 2 Ca 0.00 -0.59 0.07 0.00 -1.82 0.00 0.00 55.36 53.02 2nr2 s GLN 2 Cb 0.00 -3.05 -0.01 0.00 -1.09 0.00 0.00 33.01 28.86 2nr2 s GLN 2 CO 0.00 -0.14 0.36 0.96 -1.32 0.00 0.00 175.29 175.15 2nr2 s ILE 3 N 1.36 2.30 0.28 3.63 -4.36 -0.82 -1.11 121.20 122.48 2nr2 s ILE 3 Ca 0.04 -1.44 0.12 0.00 -0.26 0.00 0.00 60.65 59.11 2nr2 s ILE 3 Cb -0.14 -2.74 -0.05 0.00 1.25 0.00 0.00 42.46 40.78 2nr2 s ILE 3 CO -0.01 0.00 -0.19 -0.36 0.24 0.00 0.00 174.94 174.62 2nr2 s PHE 4 N -2.58 2.26 -0.01 1.37 0.08 0.27 -2.24 117.98 117.12 2nr2 s PHE 4 Ca 0.43 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 57.14 2nr2 s PHE 4 Cb -0.02 -0.98 0.02 0.00 -0.57 0.00 0.00 43.02 41.47 2nr2 s PHE 4 CO 0.25 0.70 0.01 0.08 -0.10 0.00 0.00 175.22 176.16 2nr2 s VAL 5 N -2.54 0.01 -0.09 -0.44 1.01 -0.68 -0.75 120.40 116.92 2nr2 s VAL 5 Ca 0.30 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2nr2 s VAL 5 Cb -0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 36.38 36.21 2nr2 s VAL 5 CO 0.15 0.07 -0.07 -0.75 0.00 0.00 0.00 175.10 174.49 2nr2 s LYS 6 N 0.69 2.93 0.00 2.72 2.47 -0.84 -1.11 119.74 126.60 2nr2 s LYS 6 Ca -0.06 -0.56 0.00 0.00 -1.56 0.00 0.00 55.97 53.79 2nr2 s LYS 6 Cb -0.09 -2.63 0.00 0.00 -1.46 0.00 0.00 37.83 33.65 2nr2 s LYS 6 CO -0.02 0.56 0.00 0.25 0.16 0.00 0.00 175.35 176.30 2nr2 n THR 7 N 2.54 0.00 0.08 3.43 -2.24 -0.67 -2.40 114.28 115.02 2nr2 n THR 7 Ca -0.18 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.43 2nr2 n THR 7 Cb 0.53 -1.92 -0.10 0.00 -2.10 0.00 0.00 70.33 66.74 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 0.66 0.16 3.22 3.38 -1.91 -3.37 115.31 117.46 2nr2 h LEU 8 Ca 0.00 -0.59 -0.32 0.00 0.09 0.00 0.00 57.88 57.05 2nr2 h LEU 8 Cb 0.00 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.55 2nr2 h LEU 8 CO 0.00 1.41 -1.58 0.71 0.09 0.00 0.00 178.44 179.07 2nr2 h THR 9 N 0.22 1.12 0.00 0.22 1.35 -1.95 -3.48 112.91 110.40 2nr2 h THR 9 Ca -0.13 -2.70 0.00 0.00 -0.55 0.00 0.00 66.41 63.02 2nr2 h THR 9 Cb 1.79 2.82 0.00 0.00 -1.73 0.00 0.00 68.15 71.03 2nr2 h THR 9 CO 0.20 0.83 0.00 0.61 -0.25 0.00 0.00 175.52 176.92 2nr2 n GLY 10 N 1.73 1.09 3.83 5.82 0.00 -1.26 -5.13 105.19 111.27 2nr2 n GLY 10 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 3.77 -0.23 1.61 2.20 -1.26 -4.89 119.74 120.94 2nr2 s LYS 11 Ca 0.00 0.05 -0.06 0.00 -0.36 0.00 0.00 55.97 55.60 2nr2 s LYS 11 Cb 0.00 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 33.04 2nr2 s LYS 11 CO 0.00 0.62 0.02 0.99 -0.36 0.00 0.00 175.35 176.63 2nr2 s THR 12 N -0.67 3.98 -0.41 3.43 2.01 -1.26 -1.67 115.64 121.04 2nr2 s THR 12 Ca 0.17 -0.29 -0.11 0.00 0.31 0.00 0.00 61.69 61.77 2nr2 s THR 12 Cb -0.13 -2.83 0.06 0.00 0.01 0.00 0.00 72.50 69.61 2nr2 s THR 12 CO 0.06 0.39 0.26 -0.63 -0.69 0.00 0.00 174.62 174.01 2nr2 s ILE 13 N 1.39 4.52 -0.88 1.82 1.01 -0.27 -4.94 121.20 123.85 2nr2 s ILE 13 Ca 0.05 -1.15 -0.25 0.00 0.00 0.00 0.00 60.65 59.31 2nr2 s ILE 13 Cb -0.15 -3.67 0.05 0.00 0.01 0.00 0.00 42.46 38.70 2nr2 s ILE 13 CO 0.01 -0.42 1.34 -0.89 0.00 0.00 0.00 174.94 174.99 2nr2 s THR 14 N 1.51 3.89 -0.17 2.92 2.01 -1.26 -1.68 115.64 122.85 2nr2 s THR 14 Ca 0.03 -0.28 -0.12 0.00 0.31 0.00 0.00 61.69 61.63 2nr2 s THR 14 Cb -0.22 -4.97 -0.05 0.00 0.01 0.00 0.00 72.50 67.27 2nr2 s THR 14 CO 0.05 -1.87 0.21 -0.76 -0.69 0.00 0.00 174.62 171.56 2nr2 s LEU 15 N 5.16 4.24 -0.18 4.42 1.43 -0.95 -4.97 118.68 127.84 2nr2 s LEU 15 Ca 0.40 0.40 -0.18 0.00 -1.03 0.00 0.00 54.13 53.71 2nr2 s LEU 15 Cb -0.04 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2nr2 s LEU 15 CO 0.02 0.16 0.49 -1.61 0.23 0.00 0.00 176.35 175.64 2nr2 s GLU 16 N 0.28 4.23 0.33 1.70 2.02 -1.26 -1.95 118.70 124.05 2nr2 s GLU 16 Ca 0.13 0.40 0.03 0.00 0.02 0.00 0.00 54.97 55.55 2nr2 s GLU 16 Cb -0.12 -3.52 -0.04 0.00 0.10 0.00 0.00 34.13 30.55 2nr2 s GLU 16 CO 0.02 -0.05 0.15 0.14 0.02 0.00 0.00 175.26 175.53 2nr2 s VAL 17 N 1.32 0.46 0.21 2.63 -7.23 -0.26 -4.99 120.40 112.53 2nr2 s VAL 17 Ca 0.24 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.49 2nr2 s VAL 17 Cb -0.15 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 2nr2 s VAL 17 CO 0.10 0.00 -0.15 -1.61 -0.31 0.00 0.00 175.10 173.13 2nr2 s GLU 18 N -3.79 1.34 0.00 4.82 0.41 -1.26 0.35 118.70 120.58 2nr2 s GLU 18 Ca 0.33 -1.60 0.26 0.00 -0.41 0.00 0.00 54.97 53.56 2nr2 s GLU 18 Cb 0.05 -1.15 1.11 0.00 -1.78 0.00 0.00 34.13 32.36 2nr2 s GLU 18 CO 0.17 0.19 1.84 -0.35 -0.49 0.00 0.00 175.26 176.62 2nr2 n PRO 19 N -0.39 0.00 0.19 0.39 -0.04 -1.26 -2.82 135.00 131.08 2nr2 n PRO 19 Ca -0.08 0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.52 2nr2 n PRO 19 Cb 0.60 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.74 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 -3.92 3.54 4.64 -1.97 -2.42 113.55 113.42 2nr2 h SER 20 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 2nr2 h SER 20 Cb 0.45 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.61 2nr2 h SER 20 CO 0.00 0.23 0.57 -1.81 -0.87 0.00 0.00 176.83 174.96 2nr2 s ASP 21 N -6.28 6.53 0.73 4.97 1.01 -1.13 -4.87 116.67 117.65 2nr2 s ASP 21 Ca 0.05 2.54 -0.11 0.00 0.71 0.00 0.00 52.55 55.73 2nr2 s ASP 21 Cb 0.07 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.40 2nr2 s ASP 21 CO 0.69 -0.68 1.09 0.42 0.21 0.00 0.00 175.17 176.90 2nr2 s THR 22 N -1.28 3.41 0.43 -1.27 -4.23 -1.26 -2.70 115.64 108.74 2nr2 s THR 22 Ca 0.54 0.46 0.09 0.00 -1.18 0.00 0.00 61.69 61.60 2nr2 s THR 22 Cb -0.36 -3.36 0.27 0.00 1.34 0.00 0.00 72.50 70.40 2nr2 s THR 22 CO 0.46 -0.60 2.08 0.40 -0.54 0.00 0.00 174.62 176.42 2nr2 h ILE 23 N -0.79 1.08 -0.44 2.99 1.08 -0.89 -1.76 117.51 118.77 2nr2 h ILE 23 Ca -0.46 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 63.84 2nr2 h ILE 23 Cb 1.25 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 35.59 2nr2 h ILE 23 CO 0.62 0.08 0.17 -0.08 -0.69 0.00 0.00 178.15 178.25 2nr2 h GLU 24 N 0.43 0.66 0.00 2.37 4.81 -1.73 -2.40 114.58 118.72 2nr2 h GLU 24 Ca 0.12 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2nr2 h GLU 24 Cb -0.04 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 2nr2 h GLU 24 CO -0.03 0.61 -0.03 -0.91 -0.73 0.00 0.00 179.01 177.93 2nr2 h ASN 25 N 0.57 0.00 1.09 1.04 -0.26 -1.66 -2.86 115.58 113.50 2nr2 h ASN 25 Ca 0.15 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.74 2nr2 h ASN 25 Cb 0.20 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.44 2nr2 h ASN 25 CO -0.01 0.03 -0.96 0.58 -1.06 0.00 0.00 177.43 176.01 2nr2 h VAL 26 N 0.00 0.80 -0.00 2.81 2.07 -0.94 -2.96 116.25 118.03 2nr2 h VAL 26 Ca -0.00 -2.26 -0.17 0.00 0.82 0.00 0.00 66.70 65.09 2nr2 h VAL 26 Cb 0.06 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 2nr2 h VAL 26 CO 0.00 0.46 -0.80 0.11 0.02 0.00 0.00 177.57 177.35 2nr2 h LYS 27 N 0.00 0.05 -0.90 1.57 1.57 -1.35 -2.80 116.57 114.71 2nr2 h LYS 27 Ca -0.08 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2nr2 h LYS 27 Cb 1.52 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.80 2nr2 h LYS 27 CO 0.06 0.83 0.55 0.00 -0.57 0.00 0.00 179.45 180.32 2nr2 h ALA 28 N 1.16 1.15 -0.49 3.86 0.00 -1.50 -1.81 119.26 121.63 2nr2 h ALA 28 Ca -0.02 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2nr2 h ALA 28 Cb 1.41 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2nr2 h ALA 28 CO 0.11 0.60 0.30 0.87 0.00 0.00 0.00 179.25 181.12 2nr2 h LYS 29 N 1.24 0.57 -0.46 0.00 1.57 -1.34 -2.21 116.57 115.95 2nr2 h LYS 29 Ca 0.33 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.11 2nr2 h LYS 29 Cb -0.07 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.09 2nr2 h LYS 29 CO -0.06 0.38 0.31 0.82 -0.57 0.00 0.00 179.45 180.33 2nr2 h ILE 30 N 0.59 1.01 -0.18 1.86 2.04 -1.19 -1.10 117.51 120.55 2nr2 h ILE 30 Ca 0.19 -0.16 -0.14 0.00 1.00 0.00 0.00 64.86 65.76 2nr2 h ILE 30 Cb 0.01 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2nr2 h ILE 30 CO -0.08 0.08 -0.46 -0.61 0.00 0.00 0.00 178.15 177.08 2nr2 h GLN 31 N 0.46 0.45 -0.04 2.37 -0.00 -0.73 0.06 115.11 117.68 2nr2 h GLN 31 Ca 0.19 -0.25 -0.05 0.00 -0.00 0.00 0.00 58.65 58.55 2nr2 h GLN 31 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.69 2nr2 h GLN 31 CO -0.05 0.83 -0.16 0.22 0.00 0.00 0.00 178.83 179.67 2nr2 h ASP 32 N 0.37 0.22 0.34 -0.69 3.58 -1.35 -3.18 116.42 115.71 2nr2 h ASP 32 Ca 0.02 -0.63 -0.02 0.00 0.42 0.00 0.00 57.03 56.82 2nr2 h ASP 32 Cb 0.95 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2nr2 h ASP 32 CO 0.08 0.81 -0.16 0.50 -2.88 0.00 0.00 179.24 177.59 2nr2 h LYS 33 N -0.36 -0.44 0.00 0.28 1.63 -1.08 -3.40 116.57 113.19 2nr2 h LYS 33 Ca -0.01 0.03 -0.27 0.00 -0.85 0.00 0.00 60.65 59.55 2nr2 h LYS 33 Cb 0.80 0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.49 2nr2 h LYS 33 CO 0.03 -0.29 -1.61 0.39 -3.45 0.00 0.00 179.45 174.52 2nr2 n GLU 34 N -3.46 0.56 0.00 1.90 -0.58 -0.11 -5.06 120.64 113.89 2nr2 n GLU 34 Ca -0.06 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.12 2nr2 n GLU 34 Cb 0.18 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 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 1.39 0.77 2.69 0.62 0.00 -0.51 -5.02 105.19 105.14 2nr2 n GLY 35 Ca -0.36 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.19 0.06 0.45 -0.61 1.01 -1.26 -4.99 121.20 114.66 2nr2 s ILE 36 Ca 0.00 0.17 -0.25 0.00 0.00 0.00 0.00 60.65 60.58 2nr2 s ILE 36 Cb 0.00 -0.38 -0.09 0.00 0.01 0.00 0.00 42.46 42.00 2nr2 s ILE 36 CO 0.00 0.08 1.32 -2.65 0.00 0.00 0.00 174.94 173.69 2nr2 n PRO 37 N 5.24 1.97 0.19 2.79 -0.02 -1.26 -4.07 135.00 139.85 2nr2 n PRO 37 Ca -0.05 0.70 0.14 0.00 -2.02 0.00 0.00 63.50 62.27 2nr2 n PRO 37 Cb 0.50 -2.46 0.69 0.00 -0.02 0.00 0.00 33.50 32.20 2nr2 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2nr2 h PRO 38 N 2.04 0.00 -0.39 0.52 0.11 -1.94 -2.51 132.00 129.83 2nr2 h PRO 38 Ca -0.49 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 2nr2 h PRO 38 Cb 1.29 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 2nr2 h PRO 38 CO 0.60 0.00 0.04 -0.44 -0.21 0.00 0.00 178.00 177.99 2nr2 h ASP 39 N 0.00 0.55 1.65 -2.05 3.32 -1.97 -2.94 116.42 114.98 2nr2 h ASP 39 Ca 0.00 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 2nr2 h ASP 39 Cb 0.09 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2nr2 h ASP 39 CO 0.00 0.59 -0.36 1.56 -1.72 0.00 0.00 179.24 179.32 2nr2 h GLN 40 N 0.57 0.00 -6.29 3.56 4.20 -1.64 -3.41 115.11 112.10 2nr2 h GLN 40 Ca 0.13 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.27 2nr2 h GLN 40 Cb 0.30 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.99 2nr2 h GLN 40 CO 0.01 0.17 0.87 -0.65 -0.67 0.00 0.00 178.83 178.55 2nr2 s GLN 41 N -3.14 3.38 -0.25 1.46 -0.21 -1.11 0.05 119.66 119.85 2nr2 s GLN 41 Ca 0.05 -0.03 -0.10 0.00 0.02 0.00 0.00 55.36 55.29 2nr2 s GLN 41 Cb 0.07 -4.07 -0.05 0.00 1.00 0.00 0.00 33.01 29.96 2nr2 s GLN 41 CO 0.72 -1.73 0.16 0.50 -2.12 0.00 0.00 175.29 172.81 2nr2 s ARG 42 N 4.80 4.00 -0.09 2.91 6.06 -0.64 -4.97 118.95 131.03 2nr2 s ARG 42 Ca 0.37 -0.30 0.01 0.00 -2.50 0.00 0.00 55.73 53.30 2nr2 s ARG 42 Cb -0.09 -3.55 -0.03 0.00 0.06 0.00 0.00 34.95 31.34 2nr2 s ARG 42 CO 0.21 -0.02 -0.09 -0.51 -2.50 0.00 0.00 175.30 172.39 2nr2 s LEU 43 N 1.28 3.04 0.10 -0.88 1.43 -1.26 -1.34 118.68 121.04 2nr2 s LEU 43 Ca 0.07 -0.11 0.08 0.00 -1.03 0.00 0.00 54.13 53.14 2nr2 s LEU 43 Cb -0.14 -1.67 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 2nr2 s LEU 43 CO 0.06 0.30 -0.21 -0.63 0.23 0.00 0.00 176.35 176.11 2nr2 s ILE 44 N -0.46 1.68 -0.10 -0.59 1.01 -0.33 -0.67 121.20 121.74 2nr2 s ILE 44 Ca 0.06 -1.52 -0.07 0.00 0.00 0.00 0.00 60.65 59.13 2nr2 s ILE 44 Cb -0.12 -1.53 0.03 0.00 0.01 0.00 0.00 42.46 40.86 2nr2 s ILE 44 CO 0.02 -0.06 0.25 0.12 0.00 0.00 0.00 174.94 175.27 2nr2 s PHE 45 N -1.15 -0.30 0.00 3.97 5.36 -0.23 -0.31 117.98 125.31 2nr2 s PHE 45 Ca 0.06 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.76 2nr2 s PHE 45 Cb -0.10 0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.66 2nr2 s PHE 45 CO 0.04 -0.18 0.00 0.00 -1.46 0.00 0.00 175.22 173.62 2nr2 n ALA 46 N 3.52 0.00 -1.37 11.12 0.00 -1.26 -0.90 120.51 131.61 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 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 0.57 3.19 0.00 0.00 -1.26 -5.13 105.19 102.56 2nr2 n GLY 47 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 2.24 0.30 1.61 1.02 -0.08 -5.11 119.74 119.72 2nr2 s LYS 48 Ca 0.00 -0.74 -0.29 0.00 0.02 0.00 0.00 55.97 54.96 2nr2 s LYS 48 Cb 0.00 -1.87 -0.10 0.00 -0.52 0.00 0.00 37.83 35.34 2nr2 s LYS 48 CO 0.00 0.27 1.13 -0.65 -0.92 0.00 0.00 175.35 175.18 2nr2 s GLN 49 N 0.05 4.55 -0.11 1.68 -0.21 -1.26 -1.07 119.66 123.29 2nr2 s GLN 49 Ca -0.07 1.85 -0.14 0.00 0.02 0.00 0.00 55.36 57.02 2nr2 s GLN 49 Cb -0.14 -3.12 -0.05 0.00 1.00 0.00 0.00 33.01 30.71 2nr2 s GLN 49 CO 0.04 0.12 0.35 -0.51 -2.12 0.00 0.00 175.29 173.16 2nr2 s LEU 50 N -1.60 4.32 -0.29 2.90 1.43 0.16 -4.92 118.68 120.68 2nr2 s LEU 50 Ca 0.46 0.68 -0.14 0.00 -1.03 0.00 0.00 54.13 54.10 2nr2 s LEU 50 Cb -0.32 -2.47 -0.03 0.00 0.03 0.00 0.00 46.19 43.40 2nr2 s LEU 50 CO 0.42 0.16 0.34 -1.61 0.23 0.00 0.00 176.35 175.89 2nr2 s GLU 51 N -0.01 3.90 0.26 1.70 2.02 -1.26 -4.74 118.70 120.58 2nr2 s GLU 51 Ca 0.20 -0.12 -0.11 0.00 0.02 0.00 0.00 54.97 54.96 2nr2 s GLU 51 Cb -0.14 -3.69 0.39 0.00 0.10 0.00 0.00 34.13 30.78 2nr2 s GLU 51 CO 0.07 -0.32 1.55 -0.25 0.02 0.00 0.00 175.26 176.33 2nr2 n ASP 52 N 5.31 -0.45 -1.77 -0.19 9.92 -1.26 -1.06 116.55 127.05 2nr2 n ASP 52 Ca -0.09 1.72 0.00 0.00 -0.53 0.00 0.00 54.79 55.88 2nr2 n ASP 52 Cb 0.51 -0.48 0.00 0.00 -0.64 0.00 0.00 41.12 40.51 2nr2 n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2nr2 n GLY 53 N -1.58 1.23 3.25 0.44 0.00 -1.26 -2.49 105.19 104.79 2nr2 n GLY 53 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 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 1.22 1.28 0.38 1.61 1.81 -0.22 -5.04 118.95 119.99 2nr2 s ARG 54 Ca 0.00 -1.68 0.06 0.00 -1.72 0.00 0.00 55.73 52.39 2nr2 s ARG 54 Cb 0.00 -0.01 -0.00 0.00 -0.45 0.00 0.00 34.95 34.49 2nr2 s ARG 54 CO 0.00 -0.33 0.54 0.95 -0.68 0.00 0.00 175.30 175.79 2nr2 s THR 55 N -3.94 3.76 0.31 0.02 -4.23 -1.26 -0.72 115.64 109.59 2nr2 s THR 55 Ca 0.37 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.99 2nr2 s THR 55 Cb 0.07 -3.31 0.19 0.00 1.34 0.00 0.00 72.50 70.79 2nr2 s THR 55 CO 0.12 -0.14 1.89 -0.07 -0.54 0.00 0.00 174.62 175.88 2nr2 h LEU 56 N 0.71 0.73 -0.49 4.79 3.38 -1.56 -3.09 115.31 119.78 2nr2 h LEU 56 Ca -0.44 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.43 2nr2 h LEU 56 Cb 1.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2nr2 h LEU 56 CO 0.52 0.66 0.30 -1.28 0.09 0.00 0.00 178.44 178.73 2nr2 h SER 57 N 0.79 0.58 -0.41 -0.43 0.87 -1.69 -0.99 113.55 112.26 2nr2 h SER 57 Ca 0.19 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2nr2 h SER 57 Cb 0.16 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2nr2 h SER 57 CO -0.02 0.45 0.25 0.44 -0.53 0.00 0.00 176.83 177.43 2nr2 h ASP 58 N 0.65 0.48 0.78 6.23 3.32 -1.86 -2.21 116.42 123.82 2nr2 h ASP 58 Ca 0.18 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2nr2 h ASP 58 Cb -0.03 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.40 2nr2 h ASP 58 CO -0.03 0.38 0.00 -1.22 -1.72 0.00 0.00 179.24 176.65 2nr2 n TYR 59 N -4.78 0.00 -3.24 4.55 4.01 -1.17 -4.96 117.16 111.58 2nr2 n TYR 59 Ca 0.01 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.60 2nr2 n TYR 59 Cb 0.04 -0.44 0.08 0.00 -0.31 0.00 0.00 39.34 38.71 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 -1.44 -2.56 -4.64 7.72 3.02 -0.69 -5.00 115.26 111.67 2nr2 n ASN 60 Ca 0.08 -0.56 -0.39 0.00 -0.03 0.00 0.00 54.58 53.68 2nr2 n ASN 60 Cb 0.28 -4.62 -0.07 0.00 -0.61 0.00 0.00 39.78 34.76 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 -3.32 5.11 0.00 2.41 1.01 -0.46 -5.02 121.20 120.92 2nr2 s ILE 61 Ca 0.05 0.85 0.00 0.00 0.00 0.00 0.00 60.65 61.56 2nr2 s ILE 61 Cb -0.01 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2nr2 s ILE 61 CO 0.65 0.14 0.00 0.00 0.00 0.00 0.00 174.94 175.73 2nr2 n GLN 62 N 5.15 1.82 -1.61 2.79 1.13 -1.26 -4.64 117.38 120.76 2nr2 n GLN 62 Ca -0.05 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.68 2nr2 n GLN 62 Cb 0.50 0.00 0.06 0.00 0.11 0.00 0.00 30.24 30.91 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 -1.40 2.59 -1.74 -1.09 -2.85 -1.26 -3.35 119.74 110.63 2nr2 s LYS 63 Ca 0.00 1.39 0.00 0.00 -1.00 0.00 0.00 55.97 56.36 2nr2 s LYS 63 Cb 0.00 -1.92 0.00 0.00 -2.06 0.00 0.00 37.83 33.85 2nr2 s LYS 63 CO 0.00 -1.42 0.00 0.39 0.10 0.00 0.00 175.35 174.42 2nr2 n GLU 64 N -2.69 -1.16 -3.05 1.78 1.02 -0.27 -4.99 120.64 111.28 2nr2 n GLU 64 Ca 0.10 1.07 -0.34 0.00 -0.02 0.00 0.00 57.16 57.97 2nr2 n GLU 64 Cb 0.52 -5.28 -0.06 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 -2.79 6.92 -0.30 1.62 0.01 -1.21 -4.67 113.70 113.27 2nr2 s SER 65 Ca 0.00 1.43 -0.06 0.00 1.31 0.00 0.00 55.95 58.63 2nr2 s SER 65 Cb 0.00 -2.43 0.02 0.00 0.21 0.00 0.00 66.02 63.82 2nr2 s SER 65 CO 0.00 -0.16 0.07 -0.89 0.41 0.00 0.00 173.24 172.67 2nr2 s THR 66 N -1.86 3.77 0.44 1.44 2.01 -1.25 0.96 115.64 121.15 2nr2 s THR 66 Ca 0.52 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.56 2nr2 s THR 66 Cb -0.12 -2.99 -0.06 0.00 0.01 0.00 0.00 72.50 69.33 2nr2 s THR 66 CO 0.18 0.03 0.83 -0.76 -0.69 0.00 0.00 174.62 174.21 2nr2 s LEU 67 N 1.45 3.74 -0.36 4.42 1.43 0.07 -4.89 118.68 124.54 2nr2 s LEU 67 Ca 0.01 1.22 -0.09 0.00 -1.03 0.00 0.00 54.13 54.25 2nr2 s LEU 67 Cb -0.18 -4.13 0.03 0.00 0.03 0.00 0.00 46.19 41.95 2nr2 s LEU 67 CO 0.02 -0.48 0.16 -1.00 0.23 0.00 0.00 176.35 175.27 2nr2 s HIS 68 N -2.50 3.25 -0.41 0.29 3.76 0.58 -1.99 115.29 118.27 2nr2 s HIS 68 Ca 0.53 -1.21 -0.29 0.00 -0.15 0.00 0.00 55.06 53.94 2nr2 s HIS 68 Cb -0.10 -2.36 0.02 0.00 1.11 0.00 0.00 32.58 31.25 2nr2 s HIS 68 CO 0.34 -0.69 1.09 -1.17 -0.85 0.00 0.00 174.74 173.45 2nr2 s LEU 69 N 1.47 3.78 -0.21 0.89 0.20 -1.01 -1.19 118.68 122.61 2nr2 s LEU 69 Ca 0.00 0.66 -0.05 0.00 0.69 0.00 0.00 54.13 55.43 2nr2 s LEU 69 Cb -0.19 -3.51 -0.02 0.00 -0.43 0.00 0.00 46.19 42.04 2nr2 s LEU 69 CO 0.05 -1.09 -0.01 -0.69 -0.29 0.00 0.00 176.35 174.32 2nr2 s VAL 70 N 4.07 3.73 -0.18 1.68 1.01 -0.45 -4.04 120.40 126.22 2nr2 s VAL 70 Ca 0.46 -0.38 -0.27 0.00 0.00 0.00 0.00 61.98 61.78 2nr2 s VAL 70 Cb -0.09 -2.70 -0.00 0.00 0.00 0.00 0.00 36.38 33.58 2nr2 s VAL 70 CO 0.25 0.41 0.94 -0.76 0.00 0.00 0.00 175.10 175.94 2nr2 s LEU 71 N 1.29 4.16 0.05 3.92 1.43 -1.26 -1.62 118.68 126.65 2nr2 s LEU 71 Ca 0.04 1.31 0.07 0.00 -1.03 0.00 0.00 54.13 54.53 2nr2 s LEU 71 Cb -0.15 -3.41 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 2nr2 s LEU 71 CO 0.00 -0.51 -0.18 -0.60 0.23 0.00 0.00 176.35 175.29 2nr2 s ARG 72 N 2.53 2.01 -0.06 1.70 3.52 0.11 -4.95 118.95 123.80 2nr2 s ARG 72 Ca 0.42 -1.02 -0.29 0.00 -0.13 0.00 0.00 55.73 54.71 2nr2 s ARG 72 Cb -0.16 -2.16 -0.07 0.00 -1.56 0.00 0.00 34.95 30.99 2nr2 s ARG 72 CO 0.11 0.53 1.92 -0.51 -0.81 0.00 0.00 175.30 176.54 2nr2 s LEU 73 N -1.55 4.16 0.88 -0.88 1.43 -1.26 -4.34 118.68 117.12 2nr2 s LEU 73 Ca 0.15 2.32 -0.11 0.00 -1.03 0.00 0.00 54.13 55.46 2nr2 s LEU 73 Cb -0.10 -3.53 0.12 0.00 0.03 0.00 0.00 46.19 42.71 2nr2 s LEU 73 CO 0.06 -1.24 1.15 -2.11 0.23 0.00 0.00 176.35 174.44 2nr2 n ARG 74 N 7.73 -0.25 0.00 1.70 1.85 -1.26 -4.98 116.66 121.45 2nr2 n ARG 74 Ca 0.21 -0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.06 2nr2 n ARG 74 Cb 0.43 -2.38 0.00 0.00 -1.05 0.00 0.00 32.46 29.45 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nr2 n GLY 75 N 0.40 -1.84 0.00 2.89 0.00 -1.26 -5.11 105.19 100.26 2nr2 n GLY 75 Ca 0.12 0.81 0.00 0.00 0.00 0.00 0.00 46.02 46.95 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93