#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 3.15 0.26 3.17 0.74 -1.26 -1.19 119.66 124.52 2nr2 s GLN 2 Ca 0.00 -0.42 0.03 0.00 0.05 0.00 0.00 55.36 55.02 2nr2 s GLN 2 Cb 0.00 -2.84 -0.05 0.00 1.10 0.00 0.00 33.01 31.22 2nr2 s GLN 2 CO 0.00 0.61 0.03 0.96 -0.55 0.00 0.00 175.29 176.34 2nr2 s ILE 3 N -0.61 0.97 -0.13 -2.34 -4.36 -0.70 0.00 121.20 114.03 2nr2 s ILE 3 Ca 0.10 -2.02 0.02 0.00 -0.26 0.00 0.00 60.65 58.49 2nr2 s ILE 3 Cb -0.12 -2.50 0.01 0.00 1.25 0.00 0.00 42.46 41.10 2nr2 s ILE 3 CO 0.02 -0.19 -0.20 -0.36 0.24 0.00 0.00 174.94 174.46 2nr2 s PHE 4 N -3.47 2.42 -0.32 1.37 0.08 -0.72 -2.58 117.98 114.76 2nr2 s PHE 4 Ca 0.32 -1.20 -0.07 0.00 0.12 0.00 0.00 56.93 56.11 2nr2 s PHE 4 Cb 0.07 -1.67 0.03 0.00 -0.57 0.00 0.00 43.02 40.87 2nr2 s PHE 4 CO 0.11 -0.56 0.10 0.08 -0.10 0.00 0.00 175.22 174.85 2nr2 s VAL 5 N 0.87 3.90 -0.06 -0.44 1.01 -0.70 -0.64 120.40 124.34 2nr2 s VAL 5 Ca -0.07 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.95 2nr2 s VAL 5 Cb -0.15 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2nr2 s VAL 5 CO -0.02 -0.07 0.11 -0.75 0.00 0.00 0.00 175.10 174.37 2nr2 s LYS 6 N 1.45 3.26 0.50 2.72 2.20 -0.52 -1.11 119.74 128.24 2nr2 s LYS 6 Ca 0.00 -0.32 0.01 0.00 -0.36 0.00 0.00 55.97 55.30 2nr2 s LYS 6 Cb -0.18 -3.01 0.02 0.00 -1.51 0.00 0.00 37.83 33.14 2nr2 s LYS 6 CO 0.03 0.71 0.73 0.95 -0.36 0.00 0.00 175.35 177.41 2nr2 s THR 7 N -1.11 3.33 0.16 3.43 -4.23 0.24 -0.21 115.64 117.25 2nr2 s THR 7 Ca 0.19 -0.57 0.20 0.00 -1.18 0.00 0.00 61.69 60.34 2nr2 s THR 7 Cb -0.12 -3.24 0.16 0.00 1.34 0.00 0.00 72.50 70.64 2nr2 s THR 7 CO 0.09 -0.17 1.76 0.25 -0.54 0.00 0.00 174.62 176.01 2nr2 h LEU 8 N 0.22 0.00 0.10 4.79 5.85 -1.90 -3.25 115.31 121.12 2nr2 h LEU 8 Ca -0.44 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 57.95 2nr2 h LEU 8 Cb 1.27 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 2nr2 h LEU 8 CO 0.55 0.33 -1.79 0.71 -0.34 0.00 0.00 178.44 177.90 2nr2 h THR 9 N 0.00 0.84 0.00 1.05 1.35 -1.95 -3.48 112.91 110.72 2nr2 h THR 9 Ca -0.00 -2.55 0.00 0.00 -0.55 0.00 0.00 66.41 63.30 2nr2 h THR 9 Cb 0.85 2.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.85 2nr2 h THR 9 CO 0.04 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.71 2nr2 n GLY 10 N 1.80 -0.32 3.66 5.82 0.00 -1.23 -5.15 105.19 109.78 2nr2 n GLY 10 Ca -0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 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 3.67 -0.26 1.61 2.47 -1.26 -4.86 119.74 121.12 2nr2 s LYS 11 Ca 0.00 -0.35 0.00 0.00 -1.56 0.00 0.00 55.97 54.06 2nr2 s LYS 11 Cb 0.00 -3.09 0.04 0.00 -1.46 0.00 0.00 37.83 33.32 2nr2 s LYS 11 CO 0.00 0.42 -0.08 0.99 0.16 0.00 0.00 175.35 176.84 2nr2 s THR 12 N -0.07 2.58 -0.11 3.43 2.01 -1.26 -0.59 115.64 121.63 2nr2 s THR 12 Ca 0.06 -1.31 -0.11 0.00 0.31 0.00 0.00 61.69 60.64 2nr2 s THR 12 Cb -0.12 -2.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.95 2nr2 s THR 12 CO 0.01 0.09 0.26 0.27 -0.69 0.00 0.00 174.62 174.56 2nr2 s ILE 13 N 1.23 5.31 -0.21 1.82 -4.36 -0.26 -4.92 121.20 119.80 2nr2 s ILE 13 Ca -0.04 0.48 -0.13 0.00 -0.26 0.00 0.00 60.65 60.71 2nr2 s ILE 13 Cb -0.18 -3.56 -0.05 0.00 1.25 0.00 0.00 42.46 39.92 2nr2 s ILE 13 CO -0.05 0.52 0.25 -0.89 0.24 0.00 0.00 174.94 175.01 2nr2 s THR 14 N -0.45 5.31 0.00 8.37 2.01 -1.26 -1.73 115.64 127.90 2nr2 s THR 14 Ca 0.17 0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.61 2nr2 s THR 14 Cb -0.13 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 2nr2 s THR 14 CO 0.06 0.34 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.45 2nr2 s LEU 15 N 0.92 2.06 -0.29 4.42 1.43 -1.06 -5.03 118.68 121.13 2nr2 s LEU 15 Ca 0.13 -0.26 -0.14 0.00 -1.03 0.00 0.00 54.13 52.83 2nr2 s LEU 15 Cb -0.13 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 2nr2 s LEU 15 CO 0.04 0.10 0.31 -1.61 0.23 0.00 0.00 176.35 175.43 2nr2 s GLU 16 N -0.48 3.87 0.43 1.70 2.02 -1.26 -1.71 118.70 123.26 2nr2 s GLU 16 Ca 0.03 -0.21 0.04 0.00 0.02 0.00 0.00 54.97 54.85 2nr2 s GLU 16 Cb -0.05 -3.70 -0.04 0.00 0.10 0.00 0.00 34.13 30.44 2nr2 s GLU 16 CO -0.00 -0.31 0.05 0.14 0.02 0.00 0.00 175.26 175.15 2nr2 s VAL 17 N 1.95 1.20 0.08 2.63 -7.23 -0.34 -4.94 120.40 113.76 2nr2 s VAL 17 Ca 0.11 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.36 2nr2 s VAL 17 Cb -0.16 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 2nr2 s VAL 17 CO 0.11 0.00 -0.18 -1.61 -0.31 0.00 0.00 175.10 173.11 2nr2 s GLU 18 N -3.80 1.92 0.45 4.82 2.02 -1.26 -0.12 118.70 122.73 2nr2 s GLU 18 Ca 0.22 -1.09 0.30 0.00 0.02 0.00 0.00 54.97 54.42 2nr2 s GLU 18 Cb 0.05 -2.16 1.24 0.00 0.10 0.00 0.00 34.13 33.37 2nr2 s GLU 18 CO 0.11 0.51 1.89 -1.00 0.02 0.00 0.00 175.26 176.79 2nr2 h PRO 19 N 4.06 0.00 0.00 0.39 0.13 -1.95 -1.79 132.00 132.84 2nr2 h PRO 19 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2nr2 h PRO 19 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2nr2 h PRO 19 CO 0.47 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.11 2nr2 n SER 20 N -2.78 0.00 -4.89 1.44 3.41 -1.26 -1.92 113.62 107.62 2nr2 n SER 20 Ca 0.01 0.44 -0.30 0.00 -0.26 0.00 0.00 58.87 58.77 2nr2 n SER 20 Cb 0.28 -0.47 0.06 0.00 -0.26 0.00 0.00 64.21 63.82 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2nr2 s ASP 21 N -2.95 5.08 0.21 4.04 1.01 -0.67 -4.88 116.67 118.51 2nr2 s ASP 21 Ca 0.09 0.99 -0.05 0.00 0.71 0.00 0.00 52.55 54.29 2nr2 s ASP 21 Cb 0.11 -1.67 -0.06 0.00 1.01 0.00 0.00 42.92 42.31 2nr2 s ASP 21 CO 0.29 -1.56 0.46 0.42 0.21 0.00 0.00 175.17 174.99 2nr2 s THR 22 N -3.45 5.08 0.35 -1.27 -4.23 -1.26 -2.96 115.64 107.90 2nr2 s THR 22 Ca 0.60 0.07 0.02 0.00 -1.18 0.00 0.00 61.69 61.20 2nr2 s THR 22 Cb -0.11 -3.67 0.27 0.00 1.34 0.00 0.00 72.50 70.33 2nr2 s THR 22 CO 0.51 -0.12 2.00 0.40 -0.54 0.00 0.00 174.62 176.87 2nr2 h ILE 23 N 1.76 1.15 -0.66 2.99 2.04 -1.19 -0.06 117.51 123.54 2nr2 h ILE 23 Ca -0.47 -0.30 0.10 0.00 1.00 0.00 0.00 64.86 65.19 2nr2 h ILE 23 Cb 1.18 0.21 -0.11 0.00 -0.74 0.00 0.00 36.82 37.35 2nr2 h ILE 23 CO 0.69 0.16 -0.43 -0.08 0.00 0.00 0.00 178.15 178.49 2nr2 h GLU 24 N 0.86 -0.17 -0.84 2.37 4.81 -1.09 -1.17 114.58 119.35 2nr2 h GLU 24 Ca 0.25 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 2nr2 h GLU 24 Cb -0.05 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 2nr2 h GLU 24 CO -0.06 -0.12 0.46 -0.97 -0.73 0.00 0.00 179.01 177.59 2nr2 h ASN 25 N -0.18 1.04 -0.68 1.04 -0.73 -1.69 -1.84 115.58 112.53 2nr2 h ASN 25 Ca 0.20 -0.09 -0.04 0.00 1.87 0.00 0.00 56.30 58.24 2nr2 h ASN 25 Cb 0.56 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.85 2nr2 h ASN 25 CO -0.74 0.84 0.27 0.58 -0.37 0.00 0.00 177.43 178.00 2nr2 h VAL 26 N 1.17 1.24 0.00 2.57 2.07 -0.64 0.15 116.25 122.81 2nr2 h VAL 26 Ca 0.29 -0.78 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 2nr2 h VAL 26 Cb 0.03 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2nr2 h VAL 26 CO -0.05 0.31 -0.39 0.11 0.02 0.00 0.00 177.57 177.58 2nr2 h LYS 27 N 1.02 0.00 0.00 1.57 1.57 -0.87 -0.60 116.57 119.26 2nr2 h LYS 27 Ca 0.23 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.98 2nr2 h LYS 27 Cb 0.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2nr2 h LYS 27 CO -0.02 0.39 -0.18 0.00 -0.57 0.00 0.00 179.45 179.07 2nr2 h ALA 28 N 1.61 1.15 -0.26 3.86 0.00 -0.20 -1.58 119.26 123.85 2nr2 h ALA 28 Ca -0.00 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 2nr2 h ALA 28 Cb 0.87 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2nr2 h ALA 28 CO 0.05 0.22 -0.46 0.87 0.00 0.00 0.00 179.25 179.94 2nr2 h LYS 29 N 0.00 0.68 -0.61 0.00 1.57 0.48 -1.34 116.57 117.35 2nr2 h LYS 29 Ca -0.00 -0.38 0.04 0.00 -1.87 0.00 0.00 60.65 58.44 2nr2 h LYS 29 Cb 0.54 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2nr2 h LYS 29 CO 0.02 1.00 0.41 0.82 -0.57 0.00 0.00 179.45 181.12 2nr2 h ILE 30 N 0.55 1.06 -0.49 1.86 2.04 -1.15 -1.73 117.51 119.64 2nr2 h ILE 30 Ca 0.03 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 2nr2 h ILE 30 Cb 1.00 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 2nr2 h ILE 30 CO 0.09 0.13 0.08 -0.61 0.00 0.00 0.00 178.15 177.83 2nr2 h GLN 31 N 0.69 0.82 -0.16 2.37 4.15 -0.25 0.23 115.11 122.96 2nr2 h GLN 31 Ca 0.25 -0.22 -0.04 0.00 0.77 0.00 0.00 58.65 59.41 2nr2 h GLN 31 Cb 0.14 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 2nr2 h GLN 31 CO -0.07 0.82 -0.09 0.22 -1.93 0.00 0.00 178.83 177.78 2nr2 h ASP 32 N 0.69 0.23 0.00 -0.69 3.58 -1.05 -3.17 116.42 116.01 2nr2 h ASP 32 Ca 0.15 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.56 2nr2 h ASP 32 Cb 0.40 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2nr2 h ASP 32 CO 0.01 0.35 -0.18 0.50 -2.88 0.00 0.00 179.24 177.05 2nr2 h LYS 33 N 0.24 0.00 0.00 0.28 1.63 -0.71 -3.42 116.57 114.59 2nr2 h LYS 33 Ca 0.05 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.69 2nr2 h LYS 33 Cb 0.32 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.92 2nr2 h LYS 33 CO 0.02 0.00 -2.12 -1.91 -3.45 0.00 0.00 179.45 171.99 2nr2 n GLU 34 N -3.22 0.67 -0.30 1.90 4.07 0.01 -5.00 120.64 118.77 2nr2 n GLU 34 Ca -0.02 -0.10 0.00 0.00 -0.06 0.00 0.00 57.16 56.98 2nr2 n GLU 34 Cb 0.09 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 29.93 2nr2 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2nr2 n GLY 35 N 1.47 0.81 3.20 8.31 0.00 -0.87 -5.04 105.19 113.07 2nr2 n GLY 35 Ca -0.16 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.81 1.98 0.54 -0.61 1.01 -1.24 -4.99 121.20 116.08 2nr2 s ILE 36 Ca 0.00 -0.97 -0.19 0.00 0.00 0.00 0.00 60.65 59.49 2nr2 s ILE 36 Cb 0.00 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.69 2nr2 s ILE 36 CO 0.00 0.54 1.10 -2.84 0.00 0.00 0.00 174.94 173.74 2nr2 s PRO 37 N 0.42 3.45 0.12 2.79 0.02 -1.26 -3.70 135.00 136.83 2nr2 s PRO 37 Ca -0.17 1.49 0.21 0.00 0.02 0.00 0.00 61.00 62.55 2nr2 s PRO 37 Cb -0.18 -2.03 0.87 0.00 0.02 0.00 0.00 34.50 33.18 2nr2 s PRO 37 CO 0.07 -0.75 1.66 -2.30 -0.33 0.00 0.00 177.00 175.36 2nr2 n PRO 38 N -1.33 0.10 0.07 5.54 -0.02 -1.26 -2.11 135.00 135.99 2nr2 n PRO 38 Ca 0.11 0.27 -0.11 0.00 -2.02 0.00 0.00 63.50 61.75 2nr2 n PRO 38 Cb 0.52 -1.67 -0.13 0.00 -0.02 0.00 0.00 33.50 32.19 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2nr2 h ASP 39 N 0.00 0.17 0.00 2.55 3.32 -1.97 -3.21 116.42 117.28 2nr2 h ASP 39 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2nr2 h ASP 39 Cb 0.40 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2nr2 h ASP 39 CO 0.00 1.15 0.00 0.00 -1.72 0.00 0.00 179.24 178.67 2nr2 n GLN 40 N -3.40 0.98 -3.76 3.56 6.02 -0.90 -4.72 117.38 115.17 2nr2 n GLN 40 Ca -0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.80 2nr2 n GLN 40 Cb 0.98 -1.20 -0.09 0.00 1.02 0.00 0.00 30.24 30.95 2nr2 n GLN 40 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2nr2 s GLN 41 N -2.00 0.60 0.20 -1.09 -2.07 -1.21 -1.31 119.66 112.78 2nr2 s GLN 41 Ca 0.19 -0.02 0.05 0.00 -1.82 0.00 0.00 55.36 53.75 2nr2 s GLN 41 Cb 0.09 0.27 -0.05 0.00 -1.09 0.00 0.00 33.01 32.23 2nr2 s GLN 41 CO 0.14 -0.15 -0.08 1.03 -1.32 0.00 0.00 175.29 174.92 2nr2 s ARG 42 N -0.94 1.25 0.11 9.60 0.52 -0.77 -4.90 118.95 123.81 2nr2 s ARG 42 Ca -0.10 -1.58 0.10 0.00 -0.52 0.00 0.00 55.73 53.63 2nr2 s ARG 42 Cb -0.05 -0.78 -0.04 0.00 0.52 0.00 0.00 34.95 34.61 2nr2 s ARG 42 CO 0.03 0.04 -0.26 -0.51 0.02 0.00 0.00 175.30 174.62 2nr2 s LEU 43 N -3.27 2.29 -0.08 2.53 1.43 -1.26 -1.62 118.68 118.70 2nr2 s LEU 43 Ca 0.23 -0.71 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2nr2 s LEU 43 Cb 0.03 -1.21 0.01 0.00 0.03 0.00 0.00 46.19 45.05 2nr2 s LEU 43 CO 0.05 0.19 -0.13 -0.63 0.23 0.00 0.00 176.35 176.06 2nr2 s ILE 44 N -1.01 1.25 -0.14 -0.59 1.01 -0.40 -0.49 121.20 120.83 2nr2 s ILE 44 Ca 0.13 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.26 2nr2 s ILE 44 Cb -0.10 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.23 2nr2 s ILE 44 CO 0.05 0.38 -0.19 0.12 0.00 0.00 0.00 174.94 175.31 2nr2 s PHE 45 N 0.72 2.72 0.00 3.97 5.36 -1.11 -0.08 117.98 129.57 2nr2 s PHE 45 Ca -0.13 -1.16 0.00 0.00 -0.96 0.00 0.00 56.93 54.68 2nr2 s PHE 45 Cb -0.16 -1.84 0.00 0.00 -0.34 0.00 0.00 43.02 40.68 2nr2 s PHE 45 CO 0.03 -0.52 0.00 0.00 -1.46 0.00 0.00 175.22 173.27 2nr2 n ALA 46 N 4.01 0.00 0.00 11.12 0.00 -1.26 -3.15 120.51 131.23 2nr2 n ALA 46 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2nr2 n ALA 46 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 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 0.08 3.87 0.00 0.00 -1.26 -5.13 105.19 102.75 2nr2 n GLY 47 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 3.62 -0.18 1.61 1.02 -1.19 -5.04 119.74 119.58 2nr2 s LYS 48 Ca 0.00 0.04 -0.29 0.00 0.02 0.00 0.00 55.97 55.74 2nr2 s LYS 48 Cb 0.00 -3.16 -0.01 0.00 -0.52 0.00 0.00 37.83 34.14 2nr2 s LYS 48 CO 0.00 0.72 1.19 -0.65 -0.92 0.00 0.00 175.35 175.69 2nr2 s GLN 49 N -1.26 4.25 0.32 1.68 -0.21 -1.26 -2.73 119.66 120.45 2nr2 s GLN 49 Ca 0.21 1.57 -0.25 0.00 0.02 0.00 0.00 55.36 56.91 2nr2 s GLN 49 Cb -0.14 -3.72 -0.10 0.00 1.00 0.00 0.00 33.01 30.06 2nr2 s GLN 49 CO 0.10 -0.67 0.91 -0.51 -2.12 0.00 0.00 175.29 173.01 2nr2 s LEU 50 N 3.34 4.30 -0.13 2.90 1.43 0.36 -5.00 118.68 125.88 2nr2 s LEU 50 Ca 0.51 1.76 -0.29 0.00 -1.03 0.00 0.00 54.13 55.08 2nr2 s LEU 50 Cb -0.20 -4.01 -0.02 0.00 0.03 0.00 0.00 46.19 41.99 2nr2 s LEU 50 CO 0.12 -0.08 1.26 -1.61 0.23 0.00 0.00 176.35 176.28 2nr2 s GLU 51 N -2.16 4.26 0.43 1.70 2.02 -1.26 -4.67 118.70 119.03 2nr2 s GLU 51 Ca 0.50 1.69 0.15 0.00 0.02 0.00 0.00 54.97 57.34 2nr2 s GLU 51 Cb -0.17 -3.71 0.96 0.00 0.10 0.00 0.00 34.13 31.30 2nr2 s GLU 51 CO 0.22 -0.64 1.95 -0.44 0.02 0.00 0.00 175.26 176.37 2nr2 h ASP 52 N 8.05 0.00 -0.51 -0.19 3.32 -1.94 -2.31 116.42 122.84 2nr2 h ASP 52 Ca -0.29 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.47 2nr2 h ASP 52 Cb 1.12 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.52 2nr2 h ASP 52 CO 0.94 0.24 0.37 0.61 -1.72 0.00 0.00 179.24 179.68 2nr2 n GLY 53 N -0.79 3.57 3.43 2.75 0.00 -1.26 -0.55 105.19 112.33 2nr2 n GLY 53 Ca -0.02 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.76 1.77 0.50 1.61 0.52 -0.87 -5.01 118.95 115.71 2nr2 s ARG 54 Ca 0.30 -2.05 0.07 0.00 -0.52 0.00 0.00 55.73 53.53 2nr2 s ARG 54 Cb 0.25 -0.38 0.02 0.00 0.52 0.00 0.00 34.95 35.36 2nr2 s ARG 54 CO 0.04 -0.46 0.40 0.95 0.02 0.00 0.00 175.30 176.26 2nr2 s THR 55 N -3.38 2.04 0.26 0.02 -4.23 -1.26 -1.63 115.64 107.47 2nr2 s THR 55 Ca 0.31 -1.43 0.27 0.00 -1.18 0.00 0.00 61.69 59.66 2nr2 s THR 55 Cb 0.04 -2.47 0.28 0.00 1.34 0.00 0.00 72.50 71.69 2nr2 s THR 55 CO 0.17 0.00 1.96 -0.07 -0.54 0.00 0.00 174.62 176.14 2nr2 h LEU 56 N 0.85 0.00 -0.67 4.79 3.38 -1.40 -3.29 115.31 118.97 2nr2 h LEU 56 Ca -0.38 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 2nr2 h LEU 56 Cb 1.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 2nr2 h LEU 56 CO 0.57 0.15 0.10 -1.28 0.09 0.00 0.00 178.44 178.08 2nr2 h SER 57 N 0.00 1.07 0.96 -0.43 0.87 -1.67 -2.10 113.55 112.25 2nr2 h SER 57 Ca -0.00 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.27 2nr2 h SER 57 Cb 0.53 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2nr2 h SER 57 CO 0.02 1.06 -0.10 0.44 -0.53 0.00 0.00 176.83 177.72 2nr2 h ASP 58 N 1.04 0.00 0.04 6.23 3.32 -1.87 -1.71 116.42 123.47 2nr2 h ASP 58 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2nr2 h ASP 58 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2nr2 h ASP 58 CO 0.01 0.10 -0.27 -1.22 -1.72 0.00 0.00 179.24 176.15 2nr2 n TYR 59 N -3.25 0.00 -3.64 4.55 4.01 -1.08 -4.94 117.16 112.81 2nr2 n TYR 59 Ca 0.00 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.50 2nr2 n TYR 59 Cb 0.36 -0.03 0.07 0.00 -0.31 0.00 0.00 39.34 39.43 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 0.14 -5.77 -4.70 7.72 3.02 -0.64 -4.94 115.26 110.10 2nr2 n ASN 60 Ca 0.12 -0.59 -0.42 0.00 -0.03 0.00 0.00 54.58 53.66 2nr2 n ASN 60 Cb 0.45 -4.85 -0.03 0.00 -0.61 0.00 0.00 39.78 34.75 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 -3.33 4.83 0.35 2.41 1.01 -0.82 -5.04 121.20 120.62 2nr2 s ILE 61 Ca 0.55 2.00 0.01 0.00 0.00 0.00 0.00 60.65 63.21 2nr2 s ILE 61 Cb -0.25 -4.30 0.07 0.00 0.01 0.00 0.00 42.46 37.99 2nr2 s ILE 61 CO 0.75 0.07 0.48 0.00 0.00 0.00 0.00 174.94 176.24 2nr2 n GLN 62 N 4.59 0.35 -2.28 2.79 6.02 -1.26 -4.73 117.38 122.86 2nr2 n GLN 62 Ca 0.07 -1.40 -0.34 0.00 -0.01 0.00 0.00 57.00 55.33 2nr2 n GLN 62 Cb 0.50 -0.30 -0.01 0.00 1.02 0.00 0.00 30.24 31.45 2nr2 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2nr2 s LYS 63 N -3.67 3.45 -1.41 -1.09 -2.85 -1.26 -3.98 119.74 108.94 2nr2 s LYS 63 Ca 0.33 1.43 -0.09 0.00 -1.00 0.00 0.00 55.97 56.64 2nr2 s LYS 63 Cb -0.02 -2.04 0.04 0.00 -2.06 0.00 0.00 37.83 33.75 2nr2 s LYS 63 CO 0.22 -0.73 1.03 0.39 0.10 0.00 0.00 175.35 176.36 2nr2 n GLU 64 N -1.41 -6.54 -3.93 1.78 1.02 0.10 -4.99 120.64 106.68 2nr2 n GLU 64 Ca 0.10 0.72 -0.35 0.00 -0.02 0.00 0.00 57.16 57.61 2nr2 n GLU 64 Cb 0.52 -5.65 -0.06 0.00 -0.02 0.00 0.00 31.44 26.24 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 -3.54 6.28 -0.38 1.62 0.01 -1.26 -4.85 113.70 111.58 2nr2 s SER 65 Ca 0.49 0.37 -0.12 0.00 1.31 0.00 0.00 55.95 58.00 2nr2 s SER 65 Cb -0.23 -1.98 0.02 0.00 0.21 0.00 0.00 66.02 64.05 2nr2 s SER 65 CO 0.78 0.32 0.23 -0.89 0.41 0.00 0.00 173.24 174.10 2nr2 s THR 66 N -1.19 4.79 -0.34 1.44 2.01 -1.26 -1.76 115.64 119.33 2nr2 s THR 66 Ca 0.22 -0.78 -0.16 0.00 0.31 0.00 0.00 61.69 61.28 2nr2 s THR 66 Cb -0.12 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 2nr2 s THR 66 CO 0.12 -0.24 0.41 -0.76 -0.69 0.00 0.00 174.62 173.45 2nr2 s LEU 67 N 1.60 4.40 -0.22 4.42 1.02 0.19 -4.75 118.68 125.33 2nr2 s LEU 67 Ca 0.03 -0.15 -0.23 0.00 0.02 0.00 0.00 54.13 53.80 2nr2 s LEU 67 Cb -0.19 -2.42 -0.01 0.00 0.02 0.00 0.00 46.19 43.59 2nr2 s LEU 67 CO 0.08 -0.38 0.75 -1.00 0.02 0.00 0.00 176.35 175.82 2nr2 s HIS 68 N 2.13 3.34 0.04 0.29 3.76 0.89 -1.44 115.29 124.30 2nr2 s HIS 68 Ca 0.14 1.05 -0.19 0.00 -0.15 0.00 0.00 55.06 55.90 2nr2 s HIS 68 Cb -0.16 -2.95 -0.06 0.00 1.11 0.00 0.00 32.58 30.52 2nr2 s HIS 68 CO 0.12 -0.31 0.57 -1.17 -0.85 0.00 0.00 174.74 173.10 2nr2 s LEU 69 N 2.45 4.49 0.25 0.89 0.20 0.71 -1.28 118.68 126.39 2nr2 s LEU 69 Ca 0.32 1.21 0.07 0.00 0.69 0.00 0.00 54.13 56.43 2nr2 s LEU 69 Cb -0.16 -2.88 -0.05 0.00 -0.43 0.00 0.00 46.19 42.67 2nr2 s LEU 69 CO 0.09 0.22 -0.10 0.68 -0.29 0.00 0.00 176.35 176.95 2nr2 s VAL 70 N -0.81 1.75 0.11 1.68 -7.23 -0.64 -3.87 120.40 111.39 2nr2 s VAL 70 Ca 0.29 -2.18 0.01 0.00 -1.81 0.00 0.00 61.98 58.30 2nr2 s VAL 70 Cb -0.19 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 2nr2 s VAL 70 CO 0.18 -0.41 0.25 -0.76 -0.31 0.00 0.00 175.10 174.05 2nr2 s LEU 71 N -3.41 4.34 0.00 1.32 1.43 -1.26 -1.85 118.68 119.25 2nr2 s LEU 71 Ca 0.27 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.60 2nr2 s LEU 71 Cb 0.01 -2.93 -0.00 0.00 0.03 0.00 0.00 46.19 43.30 2nr2 s LEU 71 CO 0.10 0.11 -0.04 -0.60 0.23 0.00 0.00 176.35 176.15 2nr2 s ARG 72 N -2.88 0.32 0.20 1.70 3.52 -0.42 -4.84 118.95 116.55 2nr2 s ARG 72 Ca 0.35 -0.19 0.03 0.00 -0.13 0.00 0.00 55.73 55.79 2nr2 s ARG 72 Cb -0.12 -0.28 -0.03 0.00 -1.56 0.00 0.00 34.95 32.95 2nr2 s ARG 72 CO 0.28 0.08 0.34 -0.51 -0.81 0.00 0.00 175.30 174.67 2nr2 s LEU 73 N -0.22 4.30 -0.85 -0.88 1.43 -1.26 -4.59 118.68 116.61 2nr2 s LEU 73 Ca 0.00 0.17 -0.25 0.00 -1.03 0.00 0.00 54.13 53.03 2nr2 s LEU 73 Cb -0.02 -2.94 0.02 0.00 0.03 0.00 0.00 46.19 43.28 2nr2 s LEU 73 CO -0.00 -0.02 1.51 -0.60 0.23 0.00 0.00 176.35 177.47 2nr2 s ARG 74 N -3.57 3.18 0.00 1.70 6.06 -1.26 -4.72 118.95 120.33 2nr2 s ARG 74 Ca 0.35 -0.48 0.00 0.00 -2.50 0.00 0.00 55.73 53.10 2nr2 s ARG 74 Cb -0.10 -4.78 0.00 0.00 0.06 0.00 0.00 34.95 30.13 2nr2 s ARG 74 CO 0.29 -2.42 0.00 0.41 -2.50 0.00 0.00 175.30 171.08 2nr2 n GLY 75 N 6.21 -0.52 0.00 8.12 0.00 -1.26 -5.28 105.19 112.45 2nr2 n GLY 75 Ca 0.22 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93