#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 3.24 0.44 2.12 0.74 -1.26 -1.69 119.66 123.25 2nr2 s GLN 2 Ca 0.00 -0.76 0.04 0.00 0.05 0.00 0.00 55.36 54.69 2nr2 s GLN 2 Cb 0.00 -2.52 -0.05 0.00 1.10 0.00 0.00 33.01 31.54 2nr2 s GLN 2 CO 0.00 0.16 0.02 0.96 -0.55 0.00 0.00 175.29 175.87 2nr2 s ILE 3 N 0.46 1.56 0.09 -2.34 -4.36 -0.57 -1.23 121.20 114.81 2nr2 s ILE 3 Ca -0.12 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.33 2nr2 s ILE 3 Cb -0.16 -2.64 -0.03 0.00 1.25 0.00 0.00 42.46 40.88 2nr2 s ILE 3 CO 0.05 0.00 -0.17 -0.36 0.24 0.00 0.00 174.94 174.71 2nr2 s PHE 4 N -2.84 1.47 -0.14 1.37 0.08 -0.47 -1.01 117.98 116.43 2nr2 s PHE 4 Ca 0.23 -0.46 -0.04 0.00 0.12 0.00 0.00 56.93 56.79 2nr2 s PHE 4 Cb 0.06 -0.80 0.05 0.00 -0.57 0.00 0.00 43.02 41.76 2nr2 s PHE 4 CO 0.12 0.13 0.07 0.08 -0.10 0.00 0.00 175.22 175.52 2nr2 s VAL 5 N -1.40 0.04 0.31 -0.44 1.01 0.24 -1.46 120.40 118.70 2nr2 s VAL 5 Ca 0.03 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.84 2nr2 s VAL 5 Cb -0.09 -0.56 -0.06 0.00 0.00 0.00 0.00 36.38 35.66 2nr2 s VAL 5 CO 0.03 -0.14 0.64 -0.54 0.00 0.00 0.00 175.10 175.09 2nr2 s LYS 6 N 2.09 3.75 0.00 2.72 1.02 0.45 -2.57 119.74 127.20 2nr2 s LYS 6 Ca 0.02 0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.28 2nr2 s LYS 6 Cb -0.15 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.61 2nr2 s LYS 6 CO -0.07 0.15 0.00 -2.37 -0.92 0.00 0.00 175.35 172.14 2nr2 n THR 7 N -0.82 0.00 0.00 2.17 5.66 -1.26 -0.03 114.28 120.00 2nr2 n THR 7 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2nr2 n THR 7 Cb 0.54 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.32 2nr2 n THR 7 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2nr2 n LEU 8 N 0.00 1.26 0.11 1.09 4.77 -1.26 -4.85 117.00 118.12 2nr2 n LEU 8 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 2nr2 n LEU 8 Cb 0.00 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 2nr2 n LEU 8 CO 0.00 0.00 -0.20 0.71 -1.33 0.00 0.00 177.39 176.57 2nr2 h THR 9 N 0.00 1.30 -1.45 -5.08 1.35 -2.01 -3.48 112.91 103.55 2nr2 h THR 9 Ca 0.00 -2.63 0.00 0.00 -0.55 0.00 0.00 66.41 63.23 2nr2 h THR 9 Cb 0.00 3.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 2nr2 h THR 9 CO 0.00 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.67 2nr2 n GLY 10 N 1.72 -2.07 3.72 5.82 0.00 -1.26 -5.04 105.19 108.08 2nr2 n GLY 10 Ca -0.17 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 43.99 2nr2 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nr2 s LYS 11 N -2.49 2.36 -0.31 1.61 -0.14 -1.26 -4.65 119.74 114.85 2nr2 s LYS 11 Ca 0.00 2.00 -0.14 0.00 -1.36 0.00 0.00 55.97 56.47 2nr2 s LYS 11 Cb 0.00 -1.83 -0.03 0.00 -1.68 0.00 0.00 37.83 34.29 2nr2 s LYS 11 CO 0.00 -1.73 0.30 0.99 -0.76 0.00 0.00 175.35 174.15 2nr2 s THR 12 N -1.56 5.23 0.13 2.17 2.01 -1.26 -4.16 115.64 118.20 2nr2 s THR 12 Ca 0.81 0.11 0.02 0.00 0.31 0.00 0.00 61.69 62.93 2nr2 s THR 12 Cb -0.36 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2nr2 s THR 12 CO 0.42 0.05 0.27 0.27 -0.69 0.00 0.00 174.62 174.94 2nr2 s ILE 13 N 1.90 5.33 -0.19 1.82 -4.36 -1.06 -4.93 121.20 119.72 2nr2 s ILE 13 Ca 0.10 -0.61 -0.05 0.00 -0.26 0.00 0.00 60.65 59.82 2nr2 s ILE 13 Cb -0.16 -3.72 -0.03 0.00 1.25 0.00 0.00 42.46 39.80 2nr2 s ILE 13 CO 0.11 -0.05 0.01 -0.89 0.24 0.00 0.00 174.94 174.36 2nr2 s THR 14 N -1.70 4.12 -0.12 8.37 2.01 -1.26 -0.59 115.64 126.47 2nr2 s THR 14 Ca 0.35 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 62.11 2nr2 s THR 14 Cb -0.11 -2.86 -0.00 0.00 0.01 0.00 0.00 72.50 69.53 2nr2 s THR 14 CO 0.28 0.44 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.71 2nr2 s LEU 15 N 0.80 2.37 -0.21 4.42 1.43 -0.18 -4.98 118.68 122.33 2nr2 s LEU 15 Ca 0.01 -0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 52.51 2nr2 s LEU 15 Cb -0.14 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 2nr2 s LEU 15 CO 0.02 0.15 0.29 -1.61 0.23 0.00 0.00 176.35 175.43 2nr2 s GLU 16 N 0.44 4.15 0.24 1.70 2.02 -1.26 -1.51 118.70 124.48 2nr2 s GLU 16 Ca -0.13 0.01 0.01 0.00 0.02 0.00 0.00 54.97 54.87 2nr2 s GLU 16 Cb -0.17 -3.52 -0.05 0.00 0.10 0.00 0.00 34.13 30.50 2nr2 s GLU 16 CO 0.06 0.04 0.12 0.14 0.02 0.00 0.00 175.26 175.64 2nr2 s VAL 17 N 1.08 0.31 0.19 2.63 -7.23 -0.68 -4.98 120.40 111.73 2nr2 s VAL 17 Ca 0.14 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.39 2nr2 s VAL 17 Cb -0.14 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 2nr2 s VAL 17 CO 0.06 0.00 0.04 -1.61 -0.31 0.00 0.00 175.10 173.28 2nr2 s GLU 18 N -4.06 2.53 0.35 4.82 0.41 -1.26 -0.88 118.70 120.61 2nr2 s GLU 18 Ca 0.38 -1.10 0.27 0.00 -0.41 0.00 0.00 54.97 54.11 2nr2 s GLU 18 Cb 0.07 -2.40 1.04 0.00 -1.78 0.00 0.00 34.13 31.06 2nr2 s GLU 18 CO 0.13 0.44 1.79 -1.00 -0.49 0.00 0.00 175.26 176.14 2nr2 h PRO 19 N 2.41 0.00 -0.39 0.39 0.13 -1.95 -2.39 132.00 130.19 2nr2 h PRO 19 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.60 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.80 2nr2 n SER 20 N -2.54 4.21 -4.79 1.44 7.64 -1.26 -1.39 113.62 116.93 2nr2 n SER 20 Ca 0.02 -2.75 -0.34 0.00 1.01 0.00 0.00 58.87 56.82 2nr2 n SER 20 Cb 0.29 -0.53 -0.02 0.00 -1.01 0.00 0.00 64.21 62.95 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 -1.41 6.09 0.40 6.43 1.01 -0.90 -4.77 116.67 123.52 2nr2 s ASP 21 Ca 0.43 1.95 -0.02 0.00 0.71 0.00 0.00 52.55 55.62 2nr2 s ASP 21 Cb 0.32 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.66 2nr2 s ASP 21 CO 0.14 -0.96 0.65 0.42 0.21 0.00 0.00 175.17 175.62 2nr2 s THR 22 N -2.05 5.01 0.32 -1.27 -4.23 -1.26 -1.22 115.64 110.95 2nr2 s THR 22 Ca 0.67 -0.20 0.04 0.00 -1.18 0.00 0.00 61.69 61.02 2nr2 s THR 22 Cb -0.18 -3.86 0.29 0.00 1.34 0.00 0.00 72.50 70.10 2nr2 s THR 22 CO 0.25 -0.67 1.91 0.40 -0.54 0.00 0.00 174.62 175.97 2nr2 h ILE 23 N 0.53 0.99 -0.79 2.99 1.08 -1.45 -1.63 117.51 119.23 2nr2 h ILE 23 Ca -0.49 -0.31 0.13 0.00 -0.39 0.00 0.00 64.86 63.81 2nr2 h ILE 23 Cb 1.21 0.02 -0.09 0.00 -3.07 0.00 0.00 36.82 34.90 2nr2 h ILE 23 CO 0.61 0.16 0.38 -0.08 -0.69 0.00 0.00 178.15 178.54 2nr2 h GLU 24 N 0.89 0.55 0.05 2.37 4.81 -1.80 -0.73 114.58 120.72 2nr2 h GLU 24 Ca 0.39 -0.03 -0.22 0.00 -0.13 0.00 0.00 59.36 59.37 2nr2 h GLU 24 Cb 0.35 -0.12 0.02 0.00 0.63 0.00 0.00 28.75 29.62 2nr2 h GLU 24 CO -0.16 0.36 -0.88 -0.97 -0.73 0.00 0.00 179.01 176.64 2nr2 h ASN 25 N 0.57 0.69 -0.52 1.04 -0.73 -1.72 -0.20 115.58 114.70 2nr2 h ASN 25 Ca 0.42 -0.80 0.05 0.00 1.87 0.00 0.00 56.30 57.84 2nr2 h ASN 25 Cb 0.58 -0.21 -0.05 0.00 0.27 0.00 0.00 38.32 38.91 2nr2 h ASN 25 CO -0.35 1.41 0.26 0.58 -0.37 0.00 0.00 177.43 178.96 2nr2 h VAL 26 N 0.05 0.95 -0.95 2.57 2.07 -1.01 -0.41 116.25 119.52 2nr2 h VAL 26 Ca -0.12 -0.18 0.08 0.00 0.82 0.00 0.00 66.70 67.30 2nr2 h VAL 26 Cb 1.59 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.68 2nr2 h VAL 26 CO 0.17 0.09 0.60 0.11 0.02 0.00 0.00 177.57 178.56 2nr2 h LYS 27 N 0.51 1.00 -0.19 1.57 1.57 -1.08 -0.70 116.57 119.25 2nr2 h LYS 27 Ca 0.23 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 2nr2 h LYS 27 Cb 0.15 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2nr2 h LYS 27 CO -0.16 0.66 -0.29 0.00 -0.57 0.00 0.00 179.45 179.08 2nr2 h ALA 28 N 1.47 1.15 -0.50 3.86 0.00 -0.66 -1.20 119.26 123.38 2nr2 h ALA 28 Ca 0.43 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2nr2 h ALA 28 Cb 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2nr2 h ALA 28 CO -0.21 0.54 -0.18 -0.22 0.00 0.00 0.00 179.25 179.18 2nr2 h LYS 29 N 0.32 1.00 -0.79 0.00 3.64 -0.77 -0.72 116.57 119.25 2nr2 h LYS 29 Ca 0.04 -0.41 -0.03 0.00 -1.27 0.00 0.00 60.65 58.98 2nr2 h LYS 29 Cb 0.69 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 2nr2 h LYS 29 CO 0.05 1.09 0.38 0.82 -2.27 0.00 0.00 179.45 179.53 2nr2 h ILE 30 N 0.86 1.25 -0.31 2.00 2.04 -0.94 -1.10 117.51 121.32 2nr2 h ILE 30 Ca 0.12 -0.69 0.05 0.00 1.00 0.00 0.00 64.86 65.34 2nr2 h ILE 30 Cb 0.76 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 2nr2 h ILE 30 CO 0.06 0.29 0.02 -0.61 0.00 0.00 0.00 178.15 177.92 2nr2 h GLN 31 N 1.11 0.12 -0.41 2.37 4.15 -1.06 -0.44 115.11 120.95 2nr2 h GLN 31 Ca 0.27 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.71 2nr2 h GLN 31 Cb 0.11 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.74 2nr2 h GLN 31 CO -0.04 0.08 0.21 0.22 -1.93 0.00 0.00 178.83 177.37 2nr2 h ASP 32 N 0.12 0.31 0.15 -0.69 3.58 -0.97 -2.49 116.42 116.44 2nr2 h ASP 32 Ca 0.15 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 2nr2 h ASP 32 Cb 0.18 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.19 2nr2 h ASP 32 CO -0.23 0.23 -0.07 0.11 -2.88 0.00 0.00 179.24 176.40 2nr2 h LYS 33 N 0.43 -0.19 0.04 0.28 1.79 -0.99 -3.42 116.57 114.50 2nr2 h LYS 33 Ca 0.17 0.01 -0.25 0.00 -2.18 0.00 0.00 60.65 58.41 2nr2 h LYS 33 Cb 0.07 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 2nr2 h LYS 33 CO -0.12 -0.03 -1.32 0.93 -1.08 0.00 0.00 179.45 177.82 2nr2 h GLU 34 N -1.04 0.09 0.00 3.15 4.39 -1.23 -3.50 114.58 116.45 2nr2 h GLU 34 Ca -0.02 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.53 2nr2 h GLU 34 Cb 0.25 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2nr2 h GLU 34 CO 0.03 1.07 0.00 0.41 -1.16 0.00 0.00 179.01 179.37 2nr2 n GLY 35 N 1.60 1.52 3.49 -3.84 0.00 -0.93 -5.03 105.19 101.98 2nr2 n GLY 35 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 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 3.94 0.39 -0.61 1.01 -1.26 -5.01 121.20 117.66 2nr2 s ILE 36 Ca 0.00 -0.34 -0.27 0.00 0.00 0.00 0.00 60.65 60.04 2nr2 s ILE 36 Cb 0.00 -2.74 -0.10 0.00 0.01 0.00 0.00 42.46 39.63 2nr2 s ILE 36 CO 0.00 0.48 1.39 -2.84 0.00 0.00 0.00 174.94 173.96 2nr2 s PRO 37 N 0.53 4.06 0.00 2.79 0.02 -1.26 -3.88 135.00 137.26 2nr2 s PRO 37 Ca -0.02 2.36 0.24 0.00 0.02 0.00 0.00 61.00 63.59 2nr2 s PRO 37 Cb -0.14 -2.89 1.35 0.00 0.02 0.00 0.00 34.50 32.84 2nr2 s PRO 37 CO 0.02 -0.49 1.79 -0.35 -0.33 0.00 0.00 177.00 177.64 2nr2 n PRO 38 N 0.35 0.62 0.08 5.54 -0.04 -1.26 -1.66 135.00 138.62 2nr2 n PRO 38 Ca 0.02 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.39 2nr2 n PRO 38 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2nr2 h ASP 39 N 0.00 0.39 1.26 3.54 3.32 -1.96 -3.26 116.42 119.71 2nr2 h ASP 39 Ca 0.00 -0.31 -0.13 0.00 0.02 0.00 0.00 57.03 56.60 2nr2 h ASP 39 Cb 0.07 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2nr2 h ASP 39 CO 0.00 1.12 -0.76 1.56 -1.72 0.00 0.00 179.24 179.44 2nr2 h GLN 40 N 0.16 0.00 -6.12 3.56 4.20 -1.58 -3.39 115.11 111.94 2nr2 h GLN 40 Ca -0.06 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.08 2nr2 h GLN 40 Cb 1.55 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.28 2nr2 h GLN 40 CO 0.15 0.54 0.46 -0.65 -0.67 0.00 0.00 178.83 178.66 2nr2 s GLN 41 N -2.91 4.37 -0.43 1.46 -0.21 -1.20 -0.99 119.66 119.76 2nr2 s GLN 41 Ca 0.02 1.21 -0.01 0.00 0.02 0.00 0.00 55.36 56.60 2nr2 s GLN 41 Cb 0.08 -3.55 0.12 0.00 1.00 0.00 0.00 33.01 30.66 2nr2 s GLN 41 CO 0.77 -0.29 0.21 1.03 -2.12 0.00 0.00 175.29 174.88 2nr2 s ARG 42 N 1.99 1.96 -0.10 2.91 0.52 -0.42 -4.98 118.95 120.83 2nr2 s ARG 42 Ca 0.44 -1.98 -0.30 0.00 -0.52 0.00 0.00 55.73 53.37 2nr2 s ARG 42 Cb -0.18 -3.50 -0.02 0.00 0.52 0.00 0.00 34.95 31.77 2nr2 s ARG 42 CO 0.16 -1.06 1.04 -0.51 0.02 0.00 0.00 175.30 174.94 2nr2 s LEU 43 N 0.83 4.25 -0.19 2.53 1.43 -1.26 -0.75 118.68 125.53 2nr2 s LEU 43 Ca 0.11 1.58 -0.02 0.00 -1.03 0.00 0.00 54.13 54.76 2nr2 s LEU 43 Cb -0.22 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.44 2nr2 s LEU 43 CO -0.05 -0.47 -0.08 -0.63 0.23 0.00 0.00 176.35 175.36 2nr2 s ILE 44 N 2.03 3.22 0.00 -0.59 -1.09 0.25 -3.83 121.20 121.18 2nr2 s ILE 44 Ca 0.50 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 58.35 2nr2 s ILE 44 Cb -0.19 -2.43 0.00 0.00 -1.58 0.00 0.00 42.46 38.26 2nr2 s ILE 44 CO 0.19 0.46 0.00 0.33 -1.23 0.00 0.00 174.94 174.69 2nr2 n PHE 45 N 4.36 0.00 -0.00 3.97 7.35 -1.26 -0.78 117.46 131.10 2nr2 n PHE 45 Ca -0.18 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.51 2nr2 n PHE 45 Cb 0.51 -0.14 -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 h ALA 46 N -2.00 0.00 0.00 3.13 0.00 -1.95 -3.44 119.26 115.01 2nr2 h ALA 46 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2nr2 h ALA 46 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2nr2 h ALA 46 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2nr2 n GLY 47 N 1.89 0.48 3.16 0.00 0.00 -1.26 -5.12 105.19 104.34 2nr2 n GLY 47 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2nr2 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nr2 s LYS 48 N 0.00 0.84 1.08 1.61 2.20 -1.26 -5.17 119.74 119.04 2nr2 s LYS 48 Ca 0.00 -1.27 -0.12 0.00 -0.36 0.00 0.00 55.97 54.21 2nr2 s LYS 48 Cb 0.00 0.26 0.24 0.00 -1.51 0.00 0.00 37.83 36.82 2nr2 s LYS 48 CO 0.00 -0.23 1.06 -0.65 -0.36 0.00 0.00 175.35 175.17 2nr2 s GLN 49 N -3.97 -0.24 -0.10 4.03 -0.21 -1.26 -4.23 119.66 113.68 2nr2 s GLN 49 Ca 0.15 0.79 0.03 0.00 0.02 0.00 0.00 55.36 56.35 2nr2 s GLN 49 Cb 0.07 -1.64 0.01 0.00 1.00 0.00 0.00 33.01 32.45 2nr2 s GLN 49 CO -0.04 -3.25 -0.19 -0.51 -2.12 0.00 0.00 175.29 169.18 2nr2 s LEU 50 N -6.88 1.90 0.30 2.90 1.43 -1.25 -4.99 118.68 112.09 2nr2 s LEU 50 Ca 0.67 -0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 53.21 2nr2 s LEU 50 Cb -0.22 -1.21 -0.06 0.00 0.03 0.00 0.00 46.19 44.73 2nr2 s LEU 50 CO 0.61 0.09 0.61 -1.61 0.23 0.00 0.00 176.35 176.28 2nr2 s GLU 51 N 0.64 3.74 0.19 1.70 2.02 -1.26 -4.91 118.70 120.82 2nr2 s GLU 51 Ca -0.13 0.24 -0.06 0.00 0.02 0.00 0.00 54.97 55.04 2nr2 s GLU 51 Cb -0.16 -2.58 0.12 0.00 0.10 0.00 0.00 34.13 31.61 2nr2 s GLU 51 CO 0.04 0.19 1.57 -0.44 0.02 0.00 0.00 175.26 176.64 2nr2 h ASP 52 N 1.91 0.80 -1.31 -0.19 5.19 -1.99 -2.75 116.42 118.09 2nr2 h ASP 52 Ca -0.47 -0.33 -0.68 0.00 -0.62 0.00 0.00 57.03 54.92 2nr2 h ASP 52 Cb 1.18 -0.22 -0.27 0.00 0.18 0.00 0.00 39.33 40.20 2nr2 h ASP 52 CO 0.67 1.06 0.89 0.61 -3.12 0.00 0.00 179.24 179.35 2nr2 n GLY 53 N -0.05 5.57 3.46 2.75 0.00 -1.26 -2.69 105.19 112.97 2nr2 n GLY 53 Ca -0.01 -2.27 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 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 -3.68 1.63 0.47 1.61 1.81 -1.04 -5.01 118.95 114.74 2nr2 s ARG 54 Ca 0.58 -1.78 0.03 0.00 -1.72 0.00 0.00 55.73 52.84 2nr2 s ARG 54 Cb 0.46 -1.54 0.02 0.00 -0.45 0.00 0.00 34.95 33.44 2nr2 s ARG 54 CO -0.16 0.21 0.67 0.95 -0.68 0.00 0.00 175.30 176.29 2nr2 s THR 55 N -2.70 3.16 0.16 0.02 -4.23 -1.26 -2.04 115.64 108.76 2nr2 s THR 55 Ca 0.29 -0.76 -0.15 0.00 -1.18 0.00 0.00 61.69 59.89 2nr2 s THR 55 Cb -0.01 -3.14 0.04 0.00 1.34 0.00 0.00 72.50 70.74 2nr2 s THR 55 CO 0.13 -0.08 1.76 -0.07 -0.54 0.00 0.00 174.62 175.83 2nr2 h LEU 56 N 0.37 0.21 -1.16 4.79 3.38 -1.30 -3.26 115.31 118.35 2nr2 h LEU 56 Ca -0.43 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 2nr2 h LEU 56 Cb 1.28 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.00 2nr2 h LEU 56 CO 0.51 0.16 0.44 -1.28 0.09 0.00 0.00 178.44 178.36 2nr2 h SER 57 N 0.35 0.90 -0.35 -0.43 0.87 -1.45 -0.33 113.55 113.11 2nr2 h SER 57 Ca 0.18 -0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 2nr2 h SER 57 Cb 0.14 -0.23 -0.07 0.00 -0.44 0.00 0.00 62.40 61.80 2nr2 h SER 57 CO -0.17 0.70 -0.52 -0.78 -0.53 0.00 0.00 176.83 175.53 2nr2 h ASP 58 N 1.03 -1.74 0.16 6.23 1.82 -1.86 -2.58 116.42 119.49 2nr2 h ASP 58 Ca 0.27 0.22 0.00 0.00 -0.39 0.00 0.00 57.03 57.13 2nr2 h ASP 58 Cb -0.02 0.71 0.00 0.00 0.68 0.00 0.00 39.33 40.70 2nr2 h ASP 58 CO -0.05 -0.39 0.00 -1.22 -1.61 0.00 0.00 179.24 175.97 2nr2 n TYR 59 N -5.21 0.00 -2.35 0.28 4.01 -1.23 -4.92 117.16 107.74 2nr2 n TYR 59 Ca -0.04 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.65 2nr2 n TYR 59 Cb 0.32 -0.08 0.03 0.00 -0.31 0.00 0.00 39.34 39.30 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 -1.08 -2.32 -4.57 7.72 4.13 -0.97 -4.99 115.26 113.17 2nr2 n ASN 60 Ca 0.21 -0.20 -0.40 0.00 1.68 0.00 0.00 54.58 55.87 2nr2 n ASN 60 Cb 0.15 -1.92 -0.09 0.00 -1.54 0.00 0.00 39.78 36.37 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 -3.11 5.16 0.53 2.41 1.01 -0.14 -5.02 121.20 122.04 2nr2 s ILE 61 Ca 0.03 0.30 0.04 0.00 0.00 0.00 0.00 60.65 61.02 2nr2 s ILE 61 Cb -0.00 -3.77 0.02 0.00 0.01 0.00 0.00 42.46 38.71 2nr2 s ILE 61 CO 0.22 0.01 0.26 -1.10 0.00 0.00 0.00 174.94 174.34 2nr2 s GLN 62 N 2.07 2.24 0.14 2.79 -0.21 -1.26 -4.48 119.66 120.94 2nr2 s GLN 62 Ca 0.14 -2.16 -0.31 0.00 0.02 0.00 0.00 55.36 53.05 2nr2 s GLN 62 Cb -0.16 -1.90 -0.10 0.00 1.00 0.00 0.00 33.01 31.86 2nr2 s GLN 62 CO 0.11 -0.53 1.57 -1.59 -2.12 0.00 0.00 175.29 172.73 2nr2 s LYS 63 N -4.14 4.22 0.00 2.91 -2.85 -1.26 -3.29 119.74 115.34 2nr2 s LYS 63 Ca 0.24 2.33 0.00 0.00 -1.00 0.00 0.00 55.97 57.53 2nr2 s LYS 63 Cb -0.01 -3.24 0.00 0.00 -2.06 0.00 0.00 37.83 32.52 2nr2 s LYS 63 CO 0.15 -0.61 0.00 0.39 0.10 0.00 0.00 175.35 175.37 2nr2 n GLU 64 N 4.26 0.00 -4.03 1.78 1.02 -0.36 -5.01 120.64 118.30 2nr2 n GLU 64 Ca 0.14 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.93 2nr2 n GLU 64 Cb 0.39 -2.88 -0.12 0.00 -0.02 0.00 0.00 31.44 28.82 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 -3.00 5.04 -0.31 1.62 0.01 -1.21 -4.98 113.70 110.87 2nr2 s SER 65 Ca 0.00 -0.14 -0.14 0.00 1.31 0.00 0.00 55.95 56.97 2nr2 s SER 65 Cb 0.00 -1.87 -0.03 0.00 0.21 0.00 0.00 66.02 64.34 2nr2 s SER 65 CO 0.00 0.07 0.33 -0.89 0.41 0.00 0.00 173.24 173.16 2nr2 s THR 66 N 0.95 5.20 0.33 1.44 2.01 -1.26 -1.37 115.64 122.94 2nr2 s THR 66 Ca 0.02 0.23 0.07 0.00 0.31 0.00 0.00 61.69 62.32 2nr2 s THR 66 Cb -0.14 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 2nr2 s THR 66 CO 0.02 0.05 0.41 -0.76 -0.69 0.00 0.00 174.62 173.65 2nr2 s LEU 67 N 1.98 3.89 -0.24 4.42 1.02 -0.54 -4.96 118.68 124.25 2nr2 s LEU 67 Ca 0.12 -0.26 0.02 0.00 0.02 0.00 0.00 54.13 54.03 2nr2 s LEU 67 Cb -0.16 -2.60 0.05 0.00 0.02 0.00 0.00 46.19 43.49 2nr2 s LEU 67 CO 0.11 -0.38 -0.13 -1.00 0.02 0.00 0.00 176.35 174.97 2nr2 s HIS 68 N -2.20 3.12 0.04 0.29 3.76 0.04 -0.41 115.29 119.94 2nr2 s HIS 68 Ca 0.43 -2.09 -0.29 0.00 -0.15 0.00 0.00 55.06 52.95 2nr2 s HIS 68 Cb -0.08 -1.94 -0.04 0.00 1.11 0.00 0.00 32.58 31.63 2nr2 s HIS 68 CO 0.30 -0.85 0.95 -1.17 -0.85 0.00 0.00 174.74 173.11 2nr2 s LEU 69 N 1.17 4.42 -0.14 0.89 2.96 0.95 0.84 118.68 129.77 2nr2 s LEU 69 Ca -0.04 1.68 -0.01 0.00 -0.22 0.00 0.00 54.13 55.53 2nr2 s LEU 69 Cb -0.18 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 2nr2 s LEU 69 CO -0.07 -0.17 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.99 2nr2 s VAL 70 N 0.56 3.23 -0.46 1.68 1.01 0.07 -4.59 120.40 121.91 2nr2 s VAL 70 Ca 0.49 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 2nr2 s VAL 70 Cb -0.22 -2.38 0.05 0.00 0.00 0.00 0.00 36.38 33.84 2nr2 s VAL 70 CO 0.28 0.51 0.45 -0.22 0.00 0.00 0.00 175.10 176.12 2nr2 s LEU 71 N 0.42 5.19 0.00 3.92 2.96 -1.26 -1.30 118.68 128.61 2nr2 s LEU 71 Ca -0.09 -0.99 0.00 0.00 -0.22 0.00 0.00 54.13 52.83 2nr2 s LEU 71 Cb -0.15 -2.30 0.00 0.00 0.50 0.00 0.00 46.19 44.23 2nr2 s LEU 71 CO 0.05 -0.66 0.00 -1.14 -1.32 0.00 0.00 176.35 173.27 2nr2 n ARG 72 N 5.54 1.88 -4.51 1.98 3.00 -0.16 -5.02 116.66 119.37 2nr2 n ARG 72 Ca -0.09 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.51 2nr2 n ARG 72 Cb 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.81 2nr2 n ARG 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2nr2 s LEU 73 N 0.00 2.62 -0.45 6.15 1.43 -1.26 -4.66 118.68 122.51 2nr2 s LEU 73 Ca 0.00 -1.25 -0.29 0.00 -1.03 0.00 0.00 54.13 51.57 2nr2 s LEU 73 Cb 0.00 -0.80 0.02 0.00 0.03 0.00 0.00 46.19 45.44 2nr2 s LEU 73 CO 0.00 -0.34 1.34 -0.60 0.23 0.00 0.00 176.35 176.98 2nr2 s ARG 74 N -3.70 3.58 0.00 1.70 3.52 -1.26 -4.83 118.95 117.96 2nr2 s ARG 74 Ca 0.32 0.77 0.00 0.00 -0.13 0.00 0.00 55.73 56.70 2nr2 s ARG 74 Cb 0.05 -4.01 0.00 0.00 -1.56 0.00 0.00 34.95 29.43 2nr2 s ARG 74 CO 0.15 -1.57 0.00 0.41 -0.81 0.00 0.00 175.30 173.48 2nr2 n GLY 75 N 5.05 -1.13 0.00 8.12 0.00 -1.26 -5.13 105.19 110.84 2nr2 n GLY 75 Ca 0.15 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.99 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93