#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 4.31 0.07 3.17 0.74 -1.26 -1.74 119.66 124.95 2nr2 s GLN 2 Ca 0.00 0.33 0.06 0.00 0.05 0.00 0.00 55.36 55.79 2nr2 s GLN 2 Cb 0.00 -3.43 -0.03 0.00 1.10 0.00 0.00 33.01 30.65 2nr2 s GLN 2 CO 0.00 0.19 -0.15 0.96 -0.55 0.00 0.00 175.29 175.74 2nr2 s ILE 3 N 0.55 1.20 -0.15 -2.34 -4.36 -0.25 -0.14 121.20 115.71 2nr2 s ILE 3 Ca 0.23 -1.31 -0.03 0.00 -0.26 0.00 0.00 60.65 59.27 2nr2 s ILE 3 Cb -0.14 -1.13 -0.03 0.00 1.25 0.00 0.00 42.46 42.41 2nr2 s ILE 3 CO 0.08 -0.18 -0.04 -0.36 0.24 0.00 0.00 174.94 174.68 2nr2 s PHE 4 N -1.22 3.03 -0.12 1.37 0.08 -0.85 -1.78 117.98 118.49 2nr2 s PHE 4 Ca -0.01 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.79 2nr2 s PHE 4 Cb -0.10 -1.94 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 2nr2 s PHE 4 CO 0.02 -0.00 -0.16 0.08 -0.10 0.00 0.00 175.22 175.07 2nr2 s VAL 5 N 0.27 2.82 0.03 -0.44 1.01 -0.72 -1.26 120.40 122.12 2nr2 s VAL 5 Ca -0.03 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.24 2nr2 s VAL 5 Cb -0.14 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 2nr2 s VAL 5 CO 0.03 0.54 -0.05 -0.54 0.00 0.00 0.00 175.10 175.08 2nr2 s LYS 6 N 0.28 2.54 0.44 2.72 1.02 -0.46 0.12 119.74 126.41 2nr2 s LYS 6 Ca -0.12 -0.76 0.08 0.00 0.02 0.00 0.00 55.97 55.19 2nr2 s LYS 6 Cb -0.16 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 2nr2 s LYS 6 CO 0.06 0.58 0.48 0.95 -0.92 0.00 0.00 175.35 176.50 2nr2 s THR 7 N -1.10 2.62 0.10 2.17 -4.23 -0.09 0.03 115.64 115.13 2nr2 s THR 7 Ca 0.20 -1.22 -0.13 0.00 -1.18 0.00 0.00 61.69 59.36 2nr2 s THR 7 Cb -0.11 -2.84 -0.16 0.00 1.34 0.00 0.00 72.50 70.73 2nr2 s THR 7 CO 0.11 0.00 1.30 -0.07 -0.54 0.00 0.00 174.62 175.42 2nr2 h LEU 8 N 0.80 0.93 0.18 4.79 3.38 -1.89 -3.38 115.31 120.12 2nr2 h LEU 8 Ca -0.39 -0.63 -0.31 0.00 0.09 0.00 0.00 57.88 56.64 2nr2 h LEU 8 Cb 1.28 -0.28 0.02 0.00 0.09 0.00 0.00 40.66 41.77 2nr2 h LEU 8 CO 0.52 1.41 -1.40 0.71 0.09 0.00 0.00 178.44 179.77 2nr2 h THR 9 N 0.52 1.35 0.00 0.22 1.35 -1.97 -3.49 112.91 110.90 2nr2 h THR 9 Ca -0.05 -2.87 0.00 0.00 -0.55 0.00 0.00 66.41 62.94 2nr2 h THR 9 Cb 1.39 2.96 0.00 0.00 -1.73 0.00 0.00 68.15 70.77 2nr2 h THR 9 CO 0.16 0.85 0.00 0.61 -0.25 0.00 0.00 175.52 176.89 2nr2 n GLY 10 N 1.64 -0.98 3.66 5.82 0.00 -1.26 -5.15 105.19 108.92 2nr2 n GLY 10 Ca -0.13 0.28 -0.47 0.00 0.00 0.00 0.00 46.02 45.70 2nr2 n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2nr2 n LYS 11 N -2.72 1.99 -3.89 1.61 3.00 -1.26 -4.82 118.16 112.07 2nr2 n LYS 11 Ca 0.00 0.72 -0.35 0.00 -0.00 0.00 0.00 58.31 58.67 2nr2 n LYS 11 Cb 0.00 -2.47 -0.14 0.00 0.00 0.00 0.00 35.03 32.42 2nr2 n LYS 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 2nr2 s THR 12 N 0.96 3.29 -0.16 3.15 2.01 -1.26 -0.92 115.64 122.71 2nr2 s THR 12 Ca 0.80 -0.89 -0.15 0.00 0.31 0.00 0.00 61.69 61.77 2nr2 s THR 12 Cb -0.72 -2.68 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 2nr2 s THR 12 CO 0.40 0.16 0.35 -0.63 -0.69 0.00 0.00 174.62 174.21 2nr2 s ILE 13 N 1.39 5.26 -0.43 1.82 1.01 0.32 -4.93 121.20 125.65 2nr2 s ILE 13 Ca 0.01 0.65 -0.22 0.00 0.00 0.00 0.00 60.65 61.09 2nr2 s ILE 13 Cb -0.17 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.64 2nr2 s ILE 13 CO -0.02 0.35 0.74 -0.89 0.00 0.00 0.00 174.94 175.12 2nr2 s THR 14 N 0.67 4.72 -0.04 2.92 2.01 -1.26 -1.75 115.64 122.91 2nr2 s THR 14 Ca 0.19 0.44 0.02 0.00 0.31 0.00 0.00 61.69 62.65 2nr2 s THR 14 Cb -0.14 -4.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.08 2nr2 s THR 14 CO 0.06 -0.62 -0.09 -0.76 -0.69 0.00 0.00 174.62 172.53 2nr2 s LEU 15 N 3.11 3.07 -0.31 4.42 1.43 -0.73 -5.03 118.68 124.64 2nr2 s LEU 15 Ca 0.28 -0.10 -0.10 0.00 -1.03 0.00 0.00 54.13 53.17 2nr2 s LEU 15 Cb -0.13 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.38 2nr2 s LEU 15 CO 0.20 0.33 0.17 -0.70 0.23 0.00 0.00 176.35 176.58 2nr2 s GLU 16 N -1.01 3.41 0.11 1.70 2.56 -1.26 -1.09 118.70 123.13 2nr2 s GLU 16 Ca 0.14 -0.68 0.05 0.00 0.00 0.00 0.00 54.97 54.48 2nr2 s GLU 16 Cb -0.11 -3.61 -0.04 0.00 2.00 0.00 0.00 34.13 32.38 2nr2 s GLU 16 CO 0.03 -0.40 -0.11 0.14 -0.56 0.00 0.00 175.26 174.36 2nr2 s VAL 17 N 1.64 1.12 -0.02 3.70 -7.23 -0.71 -4.90 120.40 114.00 2nr2 s VAL 17 Ca 0.05 -1.74 -0.09 0.00 -1.81 0.00 0.00 61.98 58.39 2nr2 s VAL 17 Cb -0.17 -1.50 -0.05 0.00 0.56 0.00 0.00 36.38 35.22 2nr2 s VAL 17 CO 0.07 -0.54 0.27 -0.70 -0.31 0.00 0.00 175.10 173.90 2nr2 s GLU 18 N -2.91 3.63 0.43 4.82 2.12 -1.26 -0.25 118.70 125.28 2nr2 s GLU 18 Ca 0.09 0.03 0.23 0.00 0.36 0.00 0.00 54.97 55.67 2nr2 s GLU 18 Cb -0.03 -3.13 0.93 0.00 0.26 0.00 0.00 34.13 32.16 2nr2 s GLU 18 CO 0.01 0.68 1.84 -1.00 -0.54 0.00 0.00 175.26 176.25 2nr2 h PRO 19 N 4.35 0.00 -0.14 4.30 0.13 -1.96 -1.99 132.00 136.69 2nr2 h PRO 19 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2nr2 h PRO 19 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2nr2 h PRO 19 CO 0.63 0.25 0.00 0.43 -0.23 0.00 0.00 178.00 179.08 2nr2 n SER 20 N -3.47 0.87 -4.81 1.44 7.64 -1.26 -1.03 113.62 113.01 2nr2 n SER 20 Ca -0.00 -1.86 -0.34 0.00 1.01 0.00 0.00 58.87 57.68 2nr2 n SER 20 Cb 0.42 -0.09 -0.06 0.00 -1.01 0.00 0.00 64.21 63.47 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 -1.19 6.80 0.79 6.43 1.01 -0.75 -4.91 116.67 124.85 2nr2 s ASP 21 Ca 0.17 1.81 -0.11 0.00 0.71 0.00 0.00 52.55 55.13 2nr2 s ASP 21 Cb 0.09 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.53 2nr2 s ASP 21 CO 0.13 -0.46 1.09 0.42 0.21 0.00 0.00 175.17 176.56 2nr2 s THR 22 N -2.01 3.20 0.26 -1.27 -4.23 -1.26 -2.18 115.64 108.15 2nr2 s THR 22 Ca 0.62 0.39 -0.01 0.00 -1.18 0.00 0.00 61.69 61.51 2nr2 s THR 22 Cb -0.13 -3.10 0.09 0.00 1.34 0.00 0.00 72.50 70.69 2nr2 s THR 22 CO 0.17 -0.51 1.73 0.40 -0.54 0.00 0.00 174.62 175.87 2nr2 h ILE 23 N -1.07 1.25 -0.79 2.99 1.08 -0.09 -2.67 117.51 118.22 2nr2 h ILE 23 Ca -0.47 -1.13 0.14 0.00 -0.39 0.00 0.00 64.86 63.01 2nr2 h ILE 23 Cb 1.26 1.09 -0.09 0.00 -3.07 0.00 0.00 36.82 36.01 2nr2 h ILE 23 CO 0.58 0.38 0.37 -0.08 -0.69 0.00 0.00 178.15 178.71 2nr2 h GLU 24 N 0.61 0.53 -0.44 2.37 4.81 -1.65 -1.20 114.58 119.62 2nr2 h GLU 24 Ca 0.11 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 2nr2 h GLU 24 Cb 0.57 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 2nr2 h GLU 24 CO 0.04 0.35 0.21 -0.97 -0.73 0.00 0.00 179.01 177.90 2nr2 h ASN 25 N 0.54 0.29 -0.94 1.04 -0.73 -1.79 -1.51 115.58 112.49 2nr2 h ASN 25 Ca 0.42 0.03 0.02 0.00 1.87 0.00 0.00 56.30 58.64 2nr2 h ASN 25 Cb 0.60 -0.03 -0.05 0.00 0.27 0.00 0.00 38.32 39.11 2nr2 h ASN 25 CO -0.36 0.21 0.62 0.58 -0.37 0.00 0.00 177.43 178.10 2nr2 h VAL 26 N 0.42 1.22 -0.23 2.57 2.07 -1.10 -1.18 116.25 120.03 2nr2 h VAL 26 Ca 0.19 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 2nr2 h VAL 26 Cb 0.11 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 2nr2 h VAL 26 CO -0.14 0.23 -0.07 0.11 0.02 0.00 0.00 177.57 177.71 2nr2 h LYS 27 N 1.24 0.35 0.00 1.57 1.57 -0.87 -1.94 116.57 118.50 2nr2 h LYS 27 Ca 0.35 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.99 2nr2 h LYS 27 Cb -0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2nr2 h LYS 27 CO -0.09 0.44 -0.32 0.00 -0.57 0.00 0.00 179.45 178.91 2nr2 h ALA 28 N 1.60 1.25 0.00 3.86 0.00 -0.19 -1.54 119.26 124.24 2nr2 h ALA 28 Ca 0.07 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 2nr2 h ALA 28 Cb 0.34 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2nr2 h ALA 28 CO 0.02 0.40 -0.76 -0.22 0.00 0.00 0.00 179.25 178.68 2nr2 h LYS 29 N 0.00 0.00 -0.00 0.00 3.64 -0.74 -2.29 116.57 117.18 2nr2 h LYS 29 Ca -0.00 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 2nr2 h LYS 29 Cb 0.66 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 2nr2 h LYS 29 CO 0.04 0.58 -0.76 0.82 -2.27 0.00 0.00 179.45 177.86 2nr2 h ILE 30 N 0.00 1.53 -0.25 2.00 2.04 -1.07 -2.01 117.51 119.76 2nr2 h ILE 30 Ca -0.03 -2.56 0.03 0.00 1.00 0.00 0.00 64.86 63.30 2nr2 h ILE 30 Cb 1.51 2.38 -0.03 0.00 -0.74 0.00 0.00 36.82 39.94 2nr2 h ILE 30 CO 0.08 0.73 0.05 -0.61 0.00 0.00 0.00 178.15 178.40 2nr2 h GLN 31 N 0.02 0.14 0.16 2.37 4.15 -1.19 0.75 115.11 121.49 2nr2 h GLN 31 Ca -0.01 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.41 2nr2 h GLN 31 Cb 1.34 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.96 2nr2 h GLN 31 CO 0.10 0.09 -0.47 0.22 -1.93 0.00 0.00 178.83 176.84 2nr2 h ASP 32 N 0.14 -1.39 0.16 -0.69 3.58 -1.10 -2.58 116.42 114.53 2nr2 h ASP 32 Ca 0.11 0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.70 2nr2 h ASP 32 Cb 0.11 0.51 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2nr2 h ASP 32 CO -0.15 -0.53 -0.07 0.11 -2.88 0.00 0.00 179.24 175.71 2nr2 h LYS 33 N -0.73 -0.20 0.00 0.28 1.57 -0.96 -3.40 116.57 113.13 2nr2 h LYS 33 Ca 0.00 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2nr2 h LYS 33 Cb 0.73 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 2nr2 h LYS 33 CO -0.25 -0.13 -1.65 0.39 -0.57 0.00 0.00 179.45 177.24 2nr2 n GLU 34 N -4.23 0.64 -0.12 3.15 -0.58 0.22 -5.01 120.64 114.70 2nr2 n GLU 34 Ca -0.03 -0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 2nr2 n GLU 34 Cb 0.08 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 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 1.24 0.99 3.69 0.62 0.00 -0.97 -5.01 105.19 105.76 2nr2 n GLY 35 Ca -0.03 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 5.33 0.54 -0.61 1.01 -1.26 -4.95 121.20 119.26 2nr2 s ILE 36 Ca 0.00 0.38 -0.21 0.00 0.00 0.00 0.00 60.65 60.82 2nr2 s ILE 36 Cb 0.00 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 2nr2 s ILE 36 CO 0.00 0.36 1.25 -2.84 0.00 0.00 0.00 174.94 173.71 2nr2 s PRO 37 N 0.80 3.22 0.16 2.79 0.02 -1.26 -3.71 135.00 137.02 2nr2 s PRO 37 Ca 0.12 1.97 0.13 0.00 0.02 0.00 0.00 61.00 63.23 2nr2 s PRO 37 Cb -0.13 -2.17 0.64 0.00 0.02 0.00 0.00 34.50 32.86 2nr2 s PRO 37 CO 0.03 -1.04 1.39 -2.30 -0.33 0.00 0.00 177.00 174.75 2nr2 n PRO 38 N -1.11 0.08 0.12 5.54 -0.02 -1.26 -1.87 135.00 136.48 2nr2 n PRO 38 Ca 0.11 0.52 -0.03 0.00 -2.02 0.00 0.00 63.50 62.08 2nr2 n PRO 38 Cb 0.47 -1.73 0.11 0.00 -0.02 0.00 0.00 33.50 32.34 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2nr2 h ASP 39 N 0.00 0.04 0.74 2.55 2.03 -1.96 -3.35 116.42 116.47 2nr2 h ASP 39 Ca 0.00 -0.03 -0.23 0.00 -0.73 0.00 0.00 57.03 56.05 2nr2 h ASP 39 Cb 0.06 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 38.54 2nr2 h ASP 39 CO 0.00 0.71 -1.04 1.56 -1.03 0.00 0.00 179.24 179.45 2nr2 h GLN 40 N 0.02 0.15 -6.35 4.15 4.20 -1.74 -3.46 115.11 112.08 2nr2 h GLN 40 Ca -0.01 -0.22 -0.55 0.00 0.06 0.00 0.00 58.65 57.94 2nr2 h GLN 40 Cb 1.22 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.07 2nr2 h GLN 40 CO 0.09 1.05 0.84 -0.65 -0.67 0.00 0.00 178.83 179.49 2nr2 s GLN 41 N -2.86 4.28 -0.26 1.46 -0.21 -1.24 -2.59 119.66 118.24 2nr2 s GLN 41 Ca -0.02 1.93 0.03 0.00 0.02 0.00 0.00 55.36 57.32 2nr2 s GLN 41 Cb 0.09 -3.61 0.06 0.00 1.00 0.00 0.00 33.01 30.55 2nr2 s GLN 41 CO 0.84 -0.59 -0.10 1.03 -2.12 0.00 0.00 175.29 174.36 2nr2 s ARG 42 N 2.55 2.12 -0.19 2.91 0.52 0.10 -5.01 118.95 121.96 2nr2 s ARG 42 Ca 0.63 -1.30 -0.20 0.00 -0.52 0.00 0.00 55.73 54.34 2nr2 s ARG 42 Cb -0.30 -2.85 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 2nr2 s ARG 42 CO 0.25 -0.58 0.58 -0.51 0.02 0.00 0.00 175.30 175.06 2nr2 s LEU 43 N 1.14 4.16 -0.26 2.53 1.43 -1.26 -0.10 118.68 126.33 2nr2 s LEU 43 Ca -0.08 0.78 -0.09 0.00 -1.03 0.00 0.00 54.13 53.71 2nr2 s LEU 43 Cb -0.20 -2.81 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 2nr2 s LEU 43 CO -0.05 -0.21 0.13 -0.63 0.23 0.00 0.00 176.35 175.82 2nr2 s ILE 44 N 1.67 4.90 -0.02 -0.59 -1.09 0.49 -1.93 121.20 124.63 2nr2 s ILE 44 Ca 0.27 0.03 0.01 0.00 -2.23 0.00 0.00 60.65 58.73 2nr2 s ILE 44 Cb -0.16 -3.31 0.01 0.00 -1.58 0.00 0.00 42.46 37.42 2nr2 s ILE 44 CO 0.10 0.31 -0.03 0.12 -1.23 0.00 0.00 174.94 174.20 2nr2 s PHE 45 N 1.55 0.43 -1.36 3.97 5.36 -0.41 -0.68 117.98 126.84 2nr2 s PHE 45 Ca 0.06 -0.08 0.00 0.00 -0.96 0.00 0.00 56.93 55.96 2nr2 s PHE 45 Cb -0.15 -0.35 0.00 0.00 -0.34 0.00 0.00 43.02 42.17 2nr2 s PHE 45 CO 0.07 -0.06 0.00 0.00 -1.46 0.00 0.00 175.22 173.77 2nr2 n ALA 46 N 3.40 -0.58 -0.71 11.12 0.00 -1.26 -1.36 120.51 131.11 2nr2 n ALA 46 Ca -0.18 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2nr2 n ALA 46 Cb 0.55 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 -0.69 0.74 3.49 0.00 0.00 -1.26 -5.04 105.19 102.43 2nr2 n GLY 47 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.29 2.32 -0.33 1.61 1.02 -0.46 -5.11 119.74 118.51 2nr2 s LYS 48 Ca 0.00 -0.83 -0.15 0.00 0.02 0.00 0.00 55.97 55.02 2nr2 s LYS 48 Cb 0.00 -2.31 -0.02 0.00 -0.52 0.00 0.00 37.83 34.98 2nr2 s LYS 48 CO 0.00 0.58 0.34 -0.65 -0.92 0.00 0.00 175.35 174.70 2nr2 s GLN 49 N -1.17 3.64 -0.21 1.68 -0.21 -1.26 -1.29 119.66 120.83 2nr2 s GLN 49 Ca 0.14 -0.38 -0.29 0.00 0.02 0.00 0.00 55.36 54.85 2nr2 s GLN 49 Cb -0.11 -3.78 0.00 0.00 1.00 0.00 0.00 33.01 30.13 2nr2 s GLN 49 CO 0.04 -0.46 1.01 -0.51 -2.12 0.00 0.00 175.29 173.25 2nr2 s LEU 50 N 1.98 4.12 0.76 2.90 1.43 -0.81 -5.02 118.68 124.05 2nr2 s LEU 50 Ca 0.11 1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 54.46 2nr2 s LEU 50 Cb -0.16 -3.51 0.06 0.00 0.03 0.00 0.00 46.19 42.60 2nr2 s LEU 50 CO 0.11 -0.62 1.13 -1.61 0.23 0.00 0.00 176.35 175.59 2nr2 s GLU 51 N 2.97 2.14 -0.02 1.70 2.02 -1.26 -4.71 118.70 121.54 2nr2 s GLU 51 Ca 0.44 1.41 -0.22 0.00 0.02 0.00 0.00 54.97 56.61 2nr2 s GLU 51 Cb -0.16 -1.87 -0.15 0.00 0.10 0.00 0.00 34.13 32.06 2nr2 s GLU 51 CO 0.08 -1.76 1.01 -0.44 0.02 0.00 0.00 175.26 174.17 2nr2 h ASP 52 N -0.81 -0.33 0.00 -0.19 3.32 -1.95 -3.14 116.42 113.32 2nr2 h ASP 52 Ca -0.45 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.28 2nr2 h ASP 52 Cb 1.25 0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.85 2nr2 h ASP 52 CO 0.50 0.12 -0.21 0.61 -1.72 0.00 0.00 179.24 178.53 2nr2 n GLY 53 N 0.10 2.67 3.62 2.75 0.00 -1.26 -1.96 105.19 111.11 2nr2 n GLY 53 Ca -0.09 -0.75 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 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 0.85 2.24 0.42 1.61 1.81 -1.19 -4.99 118.95 119.71 2nr2 s ARG 54 Ca 0.42 -1.27 0.07 0.00 -1.72 0.00 0.00 55.73 53.22 2nr2 s ARG 54 Cb 0.20 -2.22 0.01 0.00 -0.45 0.00 0.00 34.95 32.49 2nr2 s ARG 54 CO 0.00 0.42 0.57 0.95 -0.68 0.00 0.00 175.30 176.56 2nr2 s THR 55 N -1.92 3.23 0.27 0.02 -4.23 -1.26 0.07 115.64 111.82 2nr2 s THR 55 Ca 0.28 -0.95 -0.03 0.00 -1.18 0.00 0.00 61.69 59.81 2nr2 s THR 55 Cb -0.08 -3.10 0.15 0.00 1.34 0.00 0.00 72.50 70.80 2nr2 s THR 55 CO 0.18 -0.04 1.81 -0.07 -0.54 0.00 0.00 174.62 175.95 2nr2 h LEU 56 N 0.63 0.84 -0.45 4.79 3.38 -1.32 -3.06 115.31 120.12 2nr2 h LEU 56 Ca -0.42 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 57.23 2nr2 h LEU 56 Cb 1.28 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2nr2 h LEU 56 CO 0.48 0.81 -0.61 -1.28 0.09 0.00 0.00 178.44 177.93 2nr2 h SER 57 N 0.86 0.63 -0.85 -0.43 0.87 -1.30 0.04 113.55 113.38 2nr2 h SER 57 Ca 0.19 -0.36 0.13 0.00 -1.23 0.00 0.00 61.79 60.52 2nr2 h SER 57 Cb 0.30 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.01 2nr2 h SER 57 CO -0.00 1.09 0.55 -0.78 -0.53 0.00 0.00 176.83 177.16 2nr2 h ASP 58 N 0.41 0.63 -0.43 6.23 3.58 -1.80 -0.28 116.42 124.76 2nr2 h ASP 58 Ca -0.01 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2nr2 h ASP 58 Cb 1.17 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.12 2nr2 h ASP 58 CO 0.11 0.33 0.00 -1.22 -2.88 0.00 0.00 179.24 175.59 2nr2 n TYR 59 N -4.54 0.57 -4.16 0.28 4.01 -1.11 -4.93 117.16 107.29 2nr2 n TYR 59 Ca 0.16 -0.29 -0.33 0.00 -0.16 0.00 0.00 57.90 57.29 2nr2 n TYR 59 Cb 0.44 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.44 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 0.80 -1.97 -4.65 7.72 3.02 -0.12 -4.97 115.26 115.10 2nr2 n ASN 60 Ca 0.15 -1.04 -0.41 0.00 -0.03 0.00 0.00 54.58 53.25 2nr2 n ASN 60 Cb 0.38 -2.71 -0.05 0.00 -0.61 0.00 0.00 39.78 36.79 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 -3.59 4.90 0.57 2.41 1.01 -0.02 -5.00 121.20 121.49 2nr2 s ILE 61 Ca 0.45 1.44 0.08 0.00 0.00 0.00 0.00 60.65 62.62 2nr2 s ILE 61 Cb -0.25 -4.06 0.07 0.00 0.01 0.00 0.00 42.46 38.23 2nr2 s ILE 61 CO 0.93 -0.01 0.62 -1.10 0.00 0.00 0.00 174.94 175.37 2nr2 s GLN 62 N 2.54 2.25 0.77 2.79 -0.21 -1.26 -4.44 119.66 122.09 2nr2 s GLN 62 Ca 0.33 -1.86 -0.16 0.00 0.02 0.00 0.00 55.36 53.69 2nr2 s GLN 62 Cb -0.16 -2.38 -0.05 0.00 1.00 0.00 0.00 33.01 31.43 2nr2 s GLN 62 CO 0.09 -0.79 0.28 0.36 -2.12 0.00 0.00 175.29 173.11 2nr2 n LYS 63 N -2.05 0.14 -1.98 2.91 2.85 -1.26 -3.91 118.16 114.87 2nr2 n LYS 63 Ca 0.08 0.08 -0.18 0.00 -1.05 0.00 0.00 58.31 57.23 2nr2 n LYS 63 Cb 0.63 -1.65 -0.04 0.00 -0.65 0.00 0.00 35.03 33.32 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2nr2 n GLU 64 N -0.25 -1.39 -3.53 -1.58 1.02 0.80 -4.99 120.64 110.72 2nr2 n GLU 64 Ca 0.08 1.01 -0.34 0.00 -0.02 0.00 0.00 57.16 57.88 2nr2 n GLU 64 Cb 0.51 -5.42 -0.05 0.00 -0.02 0.00 0.00 31.44 26.45 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 -2.46 6.67 -0.53 1.62 0.01 -1.25 -4.84 113.70 112.92 2nr2 s SER 65 Ca 0.00 0.85 -0.19 0.00 1.31 0.00 0.00 55.95 57.91 2nr2 s SER 65 Cb 0.00 -2.20 0.07 0.00 0.21 0.00 0.00 66.02 64.10 2nr2 s SER 65 CO 0.00 0.14 0.66 -0.89 0.41 0.00 0.00 173.24 173.55 2nr2 s THR 66 N -1.45 4.84 0.12 1.44 2.01 -1.26 -2.01 115.64 119.33 2nr2 s THR 66 Ca 0.35 -0.57 -0.17 0.00 0.31 0.00 0.00 61.69 61.61 2nr2 s THR 66 Cb -0.14 -4.35 -0.07 0.00 0.01 0.00 0.00 72.50 67.95 2nr2 s THR 66 CO 0.19 -0.89 0.58 -0.76 -0.69 0.00 0.00 174.62 173.05 2nr2 s LEU 67 N 2.70 4.42 -0.26 4.42 1.02 -0.38 -4.86 118.68 125.74 2nr2 s LEU 67 Ca 0.15 1.20 -0.08 0.00 0.02 0.00 0.00 54.13 55.42 2nr2 s LEU 67 Cb -0.20 -3.14 -0.03 0.00 0.02 0.00 0.00 46.19 42.84 2nr2 s LEU 67 CO 0.11 0.17 0.10 -1.00 0.02 0.00 0.00 176.35 175.74 2nr2 s HIS 68 N -1.31 3.11 -0.12 0.29 3.76 0.14 -1.35 115.29 119.81 2nr2 s HIS 68 Ca 0.35 -0.35 -0.18 0.00 -0.15 0.00 0.00 55.06 54.72 2nr2 s HIS 68 Cb -0.17 -2.27 -0.04 0.00 1.11 0.00 0.00 32.58 31.21 2nr2 s HIS 68 CO 0.19 -0.34 0.49 -1.17 -0.85 0.00 0.00 174.74 173.07 2nr2 s LEU 69 N 1.64 4.27 0.09 0.89 2.96 0.10 -0.38 118.68 128.26 2nr2 s LEU 69 Ca 0.06 0.83 0.08 0.00 -0.22 0.00 0.00 54.13 54.89 2nr2 s LEU 69 Cb -0.15 -2.72 -0.03 0.00 0.50 0.00 0.00 46.19 43.79 2nr2 s LEU 69 CO 0.05 -0.01 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.16 2nr2 s VAL 70 N 0.66 1.79 0.41 1.68 1.01 0.86 -4.19 120.40 122.61 2nr2 s VAL 70 Ca 0.27 -1.47 0.07 0.00 0.00 0.00 0.00 61.98 60.84 2nr2 s VAL 70 Cb -0.15 -1.59 -0.08 0.00 0.00 0.00 0.00 36.38 34.56 2nr2 s VAL 70 CO 0.11 0.04 0.02 -0.76 0.00 0.00 0.00 175.10 174.51 2nr2 s LEU 71 N -1.71 2.87 -0.41 3.92 1.43 -1.26 0.01 118.68 123.52 2nr2 s LEU 71 Ca 0.08 -1.37 -0.21 0.00 -1.03 0.00 0.00 54.13 51.60 2nr2 s LEU 71 Cb -0.10 -0.92 0.02 0.00 0.03 0.00 0.00 46.19 45.22 2nr2 s LEU 71 CO 0.04 -0.47 0.67 0.00 0.23 0.00 0.00 176.35 176.81 2nr2 s ARG 72 N -3.73 3.44 0.00 1.70 1.70 -1.07 -4.89 118.95 116.11 2nr2 s ARG 72 Ca 0.34 -0.17 0.00 0.00 -0.47 0.00 0.00 55.73 55.43 2nr2 s ARG 72 Cb 0.09 -3.90 0.00 0.00 -0.57 0.00 0.00 34.95 30.57 2nr2 s ARG 72 CO 0.18 -0.94 0.00 -0.11 -1.08 0.00 0.00 175.30 173.35 2nr2 n LEU 73 N 6.27 0.00 -4.84 -1.89 7.94 -1.26 -5.01 117.00 118.22 2nr2 n LEU 73 Ca -0.01 0.00 -0.29 0.00 -1.11 0.00 0.00 56.01 54.60 2nr2 n LEU 73 Cb 0.48 0.00 0.10 0.00 0.53 0.00 0.00 43.42 44.53 2nr2 n LEU 73 CO 0.53 0.00 0.74 0.00 -1.11 0.00 0.00 177.39 177.55 2nr2 s ARG 74 N 0.00 1.75 -1.12 1.96 1.70 -1.26 -5.00 118.95 116.98 2nr2 s ARG 74 Ca 0.00 0.30 -0.06 0.00 -0.47 0.00 0.00 55.73 55.51 2nr2 s ARG 74 Cb 0.00 -1.91 0.28 0.00 -0.57 0.00 0.00 34.95 32.75 2nr2 s ARG 74 CO 0.00 -1.78 1.50 0.41 -1.08 0.00 0.00 175.30 174.35 2nr2 n GLY 75 N -2.65 4.96 0.00 3.88 0.00 -1.26 -5.17 105.19 104.95 2nr2 n GLY 75 Ca 0.07 -2.56 0.00 0.00 0.00 0.00 0.00 46.02 43.53 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93