#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 4.22 0.29 3.17 0.74 -1.26 -0.05 119.66 126.77 2nr2 s GLN 2 Ca 0.00 0.26 0.05 0.00 0.05 0.00 0.00 55.36 55.73 2nr2 s GLN 2 Cb 0.00 -3.51 -0.06 0.00 1.10 0.00 0.00 33.01 30.54 2nr2 s GLN 2 CO 0.00 0.01 -0.00 0.96 -0.55 0.00 0.00 175.29 175.71 2nr2 s ILE 3 N 1.14 1.39 0.05 -2.34 -4.36 0.20 -0.29 121.20 116.99 2nr2 s ILE 3 Ca 0.21 -2.06 0.08 0.00 -0.26 0.00 0.00 60.65 58.62 2nr2 s ILE 3 Cb -0.15 -2.58 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 2nr2 s ILE 3 CO 0.08 -0.19 -0.22 -0.36 0.24 0.00 0.00 174.94 174.49 2nr2 s PHE 4 N -3.17 1.96 -0.12 1.37 0.08 0.91 -0.51 117.98 118.51 2nr2 s PHE 4 Ca 0.32 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 57.00 2nr2 s PHE 4 Cb 0.06 -1.17 0.02 0.00 -0.57 0.00 0.00 43.02 41.36 2nr2 s PHE 4 CO 0.13 0.11 -0.15 0.08 -0.10 0.00 0.00 175.22 175.29 2nr2 s VAL 5 N -0.82 1.53 -0.18 -0.44 1.01 0.01 -0.78 120.40 120.73 2nr2 s VAL 5 Ca 0.09 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 2nr2 s VAL 5 Cb -0.09 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 2nr2 s VAL 5 CO 0.02 0.45 0.02 -0.75 0.00 0.00 0.00 175.10 174.84 2nr2 s LYS 6 N 1.09 3.80 0.84 2.72 2.20 -0.33 -1.95 119.74 128.11 2nr2 s LYS 6 Ca -0.04 -0.44 -0.07 0.00 -0.36 0.00 0.00 55.97 55.06 2nr2 s LYS 6 Cb -0.14 -3.10 0.17 0.00 -1.51 0.00 0.00 37.83 33.25 2nr2 s LYS 6 CO -0.04 0.20 1.15 0.95 -0.36 0.00 0.00 175.35 177.25 2nr2 s THR 7 N 0.53 2.02 0.15 3.43 -4.23 0.01 -0.82 115.64 116.74 2nr2 s THR 7 Ca 0.00 -0.37 -0.12 0.00 -1.18 0.00 0.00 61.69 60.02 2nr2 s THR 7 Cb -0.13 -2.65 0.03 0.00 1.34 0.00 0.00 72.50 71.08 2nr2 s THR 7 CO 0.02 0.00 1.61 0.25 -0.54 0.00 0.00 174.62 175.96 2nr2 h LEU 8 N -1.05 0.86 -0.09 4.79 5.85 -1.89 -3.30 115.31 120.47 2nr2 h LEU 8 Ca -0.38 -0.29 -0.25 0.00 0.84 0.00 0.00 57.88 57.80 2nr2 h LEU 8 Cb 1.24 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 42.06 2nr2 h LEU 8 CO 0.36 0.94 -0.96 0.71 -0.34 0.00 0.00 178.44 179.15 2nr2 h THR 9 N 0.75 1.32 0.00 1.05 1.35 -1.94 -3.47 112.91 111.97 2nr2 h THR 9 Ca 0.15 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.75 2nr2 h THR 9 Cb 0.49 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2nr2 h THR 9 CO 0.02 0.69 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 2nr2 n GLY 10 N 0.96 0.23 3.72 5.82 0.00 -1.24 -5.14 105.19 109.53 2nr2 n GLY 10 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 4.27 -0.57 1.61 1.02 -1.26 -4.77 119.74 120.04 2nr2 s LYS 11 Ca 0.00 0.23 0.01 0.00 0.02 0.00 0.00 55.97 56.22 2nr2 s LYS 11 Cb 0.00 -3.45 0.15 0.00 -0.52 0.00 0.00 37.83 34.01 2nr2 s LYS 11 CO 0.00 0.16 0.35 0.99 -0.92 0.00 0.00 175.35 175.93 2nr2 s THR 12 N 0.67 3.14 -0.03 2.17 2.01 -1.26 -0.81 115.64 121.52 2nr2 s THR 12 Ca 0.20 -3.15 -0.16 0.00 0.31 0.00 0.00 61.69 58.89 2nr2 s THR 12 Cb -0.14 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 2nr2 s THR 12 CO 0.07 -0.84 0.42 0.27 -0.69 0.00 0.00 174.62 173.85 2nr2 s ILE 13 N -0.19 5.07 -0.17 1.82 -4.36 -0.82 -4.90 121.20 117.64 2nr2 s ILE 13 Ca 0.17 0.87 -0.15 0.00 -0.26 0.00 0.00 60.65 61.27 2nr2 s ILE 13 Cb -0.23 -3.74 -0.04 0.00 1.25 0.00 0.00 42.46 39.70 2nr2 s ILE 13 CO -0.02 0.51 0.36 -0.89 0.24 0.00 0.00 174.94 175.14 2nr2 s THR 14 N -0.58 5.25 0.13 8.37 2.01 -1.26 -0.81 115.64 128.75 2nr2 s THR 14 Ca 0.24 0.67 0.10 0.00 0.31 0.00 0.00 61.69 63.00 2nr2 s THR 14 Cb -0.16 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 2nr2 s THR 14 CO 0.12 0.33 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.39 2nr2 s LEU 15 N 0.79 2.34 -0.28 4.42 1.43 0.34 -4.99 118.68 122.73 2nr2 s LEU 15 Ca 0.19 -0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 52.51 2nr2 s LEU 15 Cb -0.14 -1.05 0.04 0.00 0.03 0.00 0.00 46.19 45.06 2nr2 s LEU 15 CO 0.06 0.11 -0.02 -1.61 0.23 0.00 0.00 176.35 175.12 2nr2 s GLU 16 N -2.16 2.66 0.47 1.70 2.02 -1.26 -0.63 118.70 121.51 2nr2 s GLU 16 Ca 0.12 -1.11 0.04 0.00 0.02 0.00 0.00 54.97 54.05 2nr2 s GLU 16 Cb -0.09 -3.10 -0.03 0.00 0.10 0.00 0.00 34.13 31.00 2nr2 s GLU 16 CO 0.06 -0.51 0.07 0.14 0.02 0.00 0.00 175.26 175.04 2nr2 s VAL 17 N 1.30 1.58 0.05 2.63 -7.23 0.93 -4.86 120.40 114.80 2nr2 s VAL 17 Ca -0.02 -1.91 0.03 0.00 -1.81 0.00 0.00 61.98 58.27 2nr2 s VAL 17 Cb -0.18 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 2nr2 s VAL 17 CO -0.02 0.00 0.01 -1.61 -0.31 0.00 0.00 175.10 173.16 2nr2 s GLU 18 N -3.87 2.67 0.47 4.82 0.41 -1.26 0.69 118.70 122.62 2nr2 s GLU 18 Ca 0.21 -0.74 0.30 0.00 -0.41 0.00 0.00 54.97 54.33 2nr2 s GLU 18 Cb 0.04 -2.61 1.12 0.00 -1.78 0.00 0.00 34.13 30.91 2nr2 s GLU 18 CO 0.11 0.57 1.87 -1.00 -0.49 0.00 0.00 175.26 176.33 2nr2 h PRO 19 N 3.77 0.00 -0.39 0.39 0.13 -1.95 -2.69 132.00 131.27 2nr2 h PRO 19 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2nr2 h PRO 19 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2nr2 h PRO 19 CO 0.59 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.23 2nr2 n SER 20 N -2.91 2.11 -4.91 1.44 3.41 -1.26 -2.34 113.62 109.16 2nr2 n SER 20 Ca 0.02 -2.00 -0.27 0.00 -0.26 0.00 0.00 58.87 56.36 2nr2 n SER 20 Cb 0.33 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 2nr2 n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2nr2 s ASP 21 N -1.01 6.33 0.82 4.04 -1.08 -1.02 -4.87 116.67 119.89 2nr2 s ASP 21 Ca 0.27 0.81 -0.12 0.00 -0.52 0.00 0.00 52.55 52.99 2nr2 s ASP 21 Cb 0.14 -2.19 0.09 0.00 -1.46 0.00 0.00 42.92 39.50 2nr2 s ASP 21 CO 0.18 -0.43 1.18 0.42 0.52 0.00 0.00 175.17 177.05 2nr2 s THR 22 N -2.49 2.03 0.15 1.71 -4.23 -1.26 -2.62 115.64 108.92 2nr2 s THR 22 Ca 0.46 -0.03 -0.10 0.00 -1.18 0.00 0.00 61.69 60.83 2nr2 s THR 22 Cb -0.10 -3.00 -0.04 0.00 1.34 0.00 0.00 72.50 70.70 2nr2 s THR 22 CO 0.39 0.00 1.48 0.40 -0.54 0.00 0.00 174.62 176.35 2nr2 h ILE 23 N -1.09 1.27 -0.84 2.99 1.08 -0.78 -3.02 117.51 117.13 2nr2 h ILE 23 Ca -0.46 -1.56 0.21 0.00 -0.39 0.00 0.00 64.86 62.66 2nr2 h ILE 23 Cb 1.32 1.38 -0.14 0.00 -3.07 0.00 0.00 36.82 36.31 2nr2 h ILE 23 CO 0.62 0.52 0.14 -0.08 -0.69 0.00 0.00 178.15 178.66 2nr2 h GLU 24 N 0.76 0.16 -0.28 2.37 4.81 -1.39 -1.76 114.58 119.25 2nr2 h GLU 24 Ca 0.06 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 0.98 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 2nr2 h GLU 24 CO 0.10 0.11 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.28 2nr2 h ASN 25 N 0.17 0.59 0.03 1.04 2.35 -1.83 -2.16 115.58 115.77 2nr2 h ASN 25 Ca 0.50 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 56.00 2nr2 h ASN 25 Cb 0.96 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.16 2nr2 h ASN 25 CO -0.66 0.85 -0.09 0.58 -1.65 0.00 0.00 177.43 176.46 2nr2 h VAL 26 N 0.50 1.13 0.00 2.81 2.07 -1.34 -0.51 116.25 120.89 2nr2 h VAL 26 Ca 0.06 -0.54 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 2nr2 h VAL 26 Cb 0.76 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2nr2 h VAL 26 CO 0.06 0.17 -0.32 0.11 0.02 0.00 0.00 177.57 177.61 2nr2 h LYS 27 N 0.15 0.00 0.00 1.57 1.57 -1.13 -2.54 116.57 116.19 2nr2 h LYS 27 Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2nr2 h LYS 27 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2nr2 h LYS 27 CO 0.01 0.32 -0.03 0.00 -0.57 0.00 0.00 179.45 179.19 2nr2 h ALA 28 N 1.68 0.99 0.00 3.86 0.00 -0.53 -0.61 119.26 124.65 2nr2 h ALA 28 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2nr2 h ALA 28 Cb 0.82 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2nr2 h ALA 28 CO 0.04 0.03 -0.40 0.87 0.00 0.00 0.00 179.25 179.80 2nr2 h LYS 29 N 0.00 0.00 0.00 0.00 1.57 -0.76 -0.84 116.57 116.54 2nr2 h LYS 29 Ca -0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 2nr2 h LYS 29 Cb 0.91 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 2nr2 h LYS 29 CO 0.00 0.34 -0.96 0.82 -0.57 0.00 0.00 179.45 179.08 2nr2 h ILE 30 N 0.00 1.29 -0.44 1.86 2.04 -1.41 -3.18 117.51 117.67 2nr2 h ILE 30 Ca -0.01 -2.90 -0.08 0.00 1.00 0.00 0.00 64.86 62.87 2nr2 h ILE 30 Cb 1.28 2.62 -0.02 0.00 -0.74 0.00 0.00 36.82 39.96 2nr2 h ILE 30 CO 0.04 0.73 -0.06 -0.61 0.00 0.00 0.00 178.15 178.26 2nr2 h GLN 31 N 0.00 0.75 0.69 2.37 4.15 -0.71 0.12 115.11 122.48 2nr2 h GLN 31 Ca -0.05 -0.22 -0.03 0.00 0.77 0.00 0.00 58.65 59.12 2nr2 h GLN 31 Cb 1.67 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 29.29 2nr2 h GLN 31 CO 0.10 0.80 -0.33 0.22 -1.93 0.00 0.00 178.83 177.69 2nr2 h ASP 32 N 0.69 -0.79 0.04 -0.69 3.58 -1.27 -3.06 116.42 114.92 2nr2 h ASP 32 Ca 0.13 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2nr2 h ASP 32 Cb 0.51 0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.76 2nr2 h ASP 32 CO 0.03 -0.56 -0.02 0.11 -2.88 0.00 0.00 179.24 175.92 2nr2 h LYS 33 N -0.93 -0.05 0.00 0.28 1.57 -1.50 -3.40 116.57 112.55 2nr2 h LYS 33 Ca -0.09 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.50 2nr2 h LYS 33 Cb 0.71 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 2nr2 h LYS 33 CO 0.16 0.60 -2.12 0.39 -0.57 0.00 0.00 179.45 177.90 2nr2 n GLU 34 N -4.74 0.67 -1.85 3.15 -0.58 0.02 -5.00 120.64 112.31 2nr2 n GLU 34 Ca -0.08 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2nr2 n GLU 34 Cb 0.32 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 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 1.50 0.90 3.52 0.62 0.00 -1.16 -5.03 105.19 105.54 2nr2 n GLY 35 Ca -0.18 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.57 4.23 0.56 -0.61 1.01 -1.26 -5.03 121.20 117.53 2nr2 s ILE 36 Ca 0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 60.65 60.23 2nr2 s ILE 36 Cb 0.00 -2.91 -0.05 0.00 0.01 0.00 0.00 42.46 39.51 2nr2 s ILE 36 CO 0.00 0.44 1.14 -2.84 0.00 0.00 0.00 174.94 173.69 2nr2 s PRO 37 N 0.73 3.26 0.25 2.79 0.02 -1.26 -4.18 135.00 136.61 2nr2 s PRO 37 Ca 0.01 1.65 0.23 0.00 0.02 0.00 0.00 61.00 62.91 2nr2 s PRO 37 Cb -0.14 -1.99 0.98 0.00 0.02 0.00 0.00 34.50 33.37 2nr2 s PRO 37 CO 0.02 -0.94 1.70 -0.35 -0.33 0.00 0.00 177.00 177.10 2nr2 n PRO 38 N -1.40 0.19 0.07 5.54 -0.04 -1.26 -1.66 135.00 136.43 2nr2 n PRO 38 Ca 0.12 0.43 -0.10 0.00 -0.04 0.00 0.00 63.50 63.91 2nr2 n PRO 38 Cb 0.51 -1.86 0.01 0.00 -0.04 0.00 0.00 33.50 32.11 2nr2 n PRO 38 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2nr2 h ASP 39 N 0.00 0.38 0.73 3.54 2.03 -1.98 -3.32 116.42 117.81 2nr2 h ASP 39 Ca 0.00 -0.28 -0.11 0.00 -0.73 0.00 0.00 57.03 55.91 2nr2 h ASP 39 Cb 0.34 -0.12 -0.02 0.00 -0.83 0.00 0.00 39.33 38.71 2nr2 h ASP 39 CO 0.00 1.05 -0.53 1.56 -1.03 0.00 0.00 179.24 180.29 2nr2 h GLN 40 N 0.19 0.00 -6.98 4.15 4.20 -1.53 -3.46 115.11 111.68 2nr2 h GLN 40 Ca -0.04 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.21 2nr2 h GLN 40 Cb 1.42 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.19 2nr2 h GLN 40 CO 0.13 0.53 0.36 -0.65 -0.67 0.00 0.00 178.83 178.53 2nr2 s GLN 41 N -3.58 4.33 -0.09 1.46 -0.21 -1.17 0.60 119.66 121.01 2nr2 s GLN 41 Ca -0.01 1.27 -0.01 0.00 0.02 0.00 0.00 55.36 56.64 2nr2 s GLN 41 Cb 0.12 -2.47 0.03 0.00 1.00 0.00 0.00 33.01 31.68 2nr2 s GLN 41 CO 0.73 0.05 -0.03 0.50 -2.12 0.00 0.00 175.29 174.43 2nr2 s ARG 42 N -2.64 0.94 -0.21 2.91 6.06 0.66 -4.78 118.95 121.89 2nr2 s ARG 42 Ca 0.57 -0.02 -0.14 0.00 -2.50 0.00 0.00 55.73 53.64 2nr2 s ARG 42 Cb -0.15 -1.19 -0.04 0.00 0.06 0.00 0.00 34.95 33.62 2nr2 s ARG 42 CO 0.20 -0.29 0.30 -0.51 -2.50 0.00 0.00 175.30 172.50 2nr2 s LEU 43 N 1.86 4.15 -0.23 -0.88 1.43 -1.26 -1.02 118.68 122.74 2nr2 s LEU 43 Ca 0.05 0.38 0.01 0.00 -1.03 0.00 0.00 54.13 53.54 2nr2 s LEU 43 Cb -0.12 -2.36 0.04 0.00 0.03 0.00 0.00 46.19 43.78 2nr2 s LEU 43 CO -0.06 -0.01 -0.13 -0.63 0.23 0.00 0.00 176.35 175.75 2nr2 s ILE 44 N 1.11 2.29 -0.02 -0.59 1.01 0.11 -0.02 121.20 125.09 2nr2 s ILE 44 Ca 0.15 -1.23 0.03 0.00 0.00 0.00 0.00 60.65 59.60 2nr2 s ILE 44 Cb -0.14 -2.16 -0.00 0.00 0.01 0.00 0.00 42.46 40.17 2nr2 s ILE 44 CO 0.06 0.24 -0.12 0.12 0.00 0.00 0.00 174.94 175.25 2nr2 s PHE 45 N 1.23 1.13 -1.45 3.97 5.36 -0.68 -0.44 117.98 127.09 2nr2 s PHE 45 Ca -0.01 -0.25 -0.07 0.00 -0.96 0.00 0.00 56.93 55.64 2nr2 s PHE 45 Cb -0.17 -0.75 0.05 0.00 -0.34 0.00 0.00 43.02 41.81 2nr2 s PHE 45 CO -0.08 -0.06 0.72 0.00 -1.46 0.00 0.00 175.22 174.34 2nr2 n ALA 46 N 3.00 -1.70 0.00 11.12 0.00 -1.26 -1.61 120.51 130.06 2nr2 n ALA 46 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2nr2 n ALA 46 Cb 0.55 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.22 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 -1.70 2.11 3.75 0.00 0.00 -1.26 -4.98 105.19 103.11 2nr2 n GLY 47 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 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 4.30 0.14 1.61 1.02 -0.63 -5.06 119.74 121.11 2nr2 s LYS 48 Ca 0.00 0.61 -0.30 0.00 0.02 0.00 0.00 55.97 56.30 2nr2 s LYS 48 Cb 0.00 -3.38 -0.07 0.00 -0.52 0.00 0.00 37.83 33.86 2nr2 s LYS 48 CO 0.00 0.29 1.16 -0.65 -0.92 0.00 0.00 175.35 175.23 2nr2 s GLN 49 N 0.13 4.51 -0.20 1.68 -0.21 -1.26 -1.68 119.66 122.62 2nr2 s GLN 49 Ca 0.29 1.78 -0.19 0.00 0.02 0.00 0.00 55.36 57.27 2nr2 s GLN 49 Cb -0.17 -3.29 -0.03 0.00 1.00 0.00 0.00 33.01 30.52 2nr2 s GLN 49 CO 0.14 -0.09 0.54 -0.51 -2.12 0.00 0.00 175.29 173.26 2nr2 s LEU 50 N 0.13 4.14 0.06 2.90 1.43 0.97 -4.95 118.68 123.36 2nr2 s LEU 50 Ca 0.53 0.70 -0.24 0.00 -1.03 0.00 0.00 54.13 54.09 2nr2 s LEU 50 Cb -0.30 -2.75 -0.06 0.00 0.03 0.00 0.00 46.19 43.11 2nr2 s LEU 50 CO 0.34 -0.21 0.74 -1.61 0.23 0.00 0.00 176.35 175.84 2nr2 s GLU 51 N 1.75 4.48 0.10 1.70 2.02 -1.26 -4.72 118.70 122.78 2nr2 s GLU 51 Ca 0.25 1.04 -0.26 0.00 0.02 0.00 0.00 54.97 56.02 2nr2 s GLU 51 Cb -0.16 -3.34 -0.10 0.00 0.10 0.00 0.00 34.13 30.63 2nr2 s GLU 51 CO 0.10 0.34 1.67 -0.44 0.02 0.00 0.00 175.26 176.95 2nr2 h ASP 52 N 5.44 -0.49 0.00 -0.19 5.19 -1.96 -2.44 116.42 121.97 2nr2 h ASP 52 Ca -0.45 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 2nr2 h ASP 52 Cb 1.21 0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.90 2nr2 h ASP 52 CO 0.70 -0.26 0.00 0.61 -3.12 0.00 0.00 179.24 177.17 2nr2 n GLY 53 N -1.30 1.11 3.70 2.75 0.00 -1.26 -1.14 105.19 109.04 2nr2 n GLY 53 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.80 2.23 0.53 1.61 0.52 -0.92 -4.96 118.95 117.15 2nr2 s ARG 54 Ca 0.00 -1.70 0.06 0.00 -0.52 0.00 0.00 55.73 53.57 2nr2 s ARG 54 Cb 0.00 -2.04 0.05 0.00 0.52 0.00 0.00 34.95 33.49 2nr2 s ARG 54 CO 0.00 0.06 0.72 0.95 0.02 0.00 0.00 175.30 177.05 2nr2 s THR 55 N -2.50 2.58 0.33 0.02 -4.23 -1.26 -0.94 115.64 109.63 2nr2 s THR 55 Ca 0.38 -0.89 0.08 0.00 -1.18 0.00 0.00 61.69 60.08 2nr2 s THR 55 Cb 0.00 -2.69 0.07 0.00 1.34 0.00 0.00 72.50 71.22 2nr2 s THR 55 CO 0.21 0.00 1.77 -0.07 -0.54 0.00 0.00 174.62 175.99 2nr2 h LEU 56 N 0.26 0.20 -0.46 4.79 3.38 -1.45 -3.13 115.31 118.90 2nr2 h LEU 56 Ca -0.37 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2nr2 h LEU 56 Cb 1.28 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 2nr2 h LEU 56 CO 0.44 0.54 0.23 -1.28 0.09 0.00 0.00 178.44 178.46 2nr2 h SER 57 N 0.17 0.59 -0.96 -0.43 0.87 -1.71 -1.97 113.55 110.11 2nr2 h SER 57 Ca 0.02 -0.12 0.16 0.00 -1.23 0.00 0.00 61.79 60.63 2nr2 h SER 57 Cb 0.70 -0.15 -0.09 0.00 -0.44 0.00 0.00 62.40 62.42 2nr2 h SER 57 CO 0.05 0.54 0.61 0.44 -0.53 0.00 0.00 176.83 177.94 2nr2 h ASP 58 N 0.60 0.73 0.03 6.23 3.32 -1.86 0.44 116.42 125.91 2nr2 h ASP 58 Ca 0.16 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2nr2 h ASP 58 Cb 0.10 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2nr2 h ASP 58 CO -0.02 0.33 -0.06 -1.22 -1.72 0.00 0.00 179.24 176.55 2nr2 n TYR 59 N -4.64 0.00 -2.51 4.55 4.01 -1.08 -4.96 117.16 112.53 2nr2 n TYR 59 Ca 0.20 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.75 2nr2 n TYR 59 Cb 0.51 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 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 -5.60 -4.55 7.72 4.13 0.14 -4.95 115.26 112.30 2nr2 n ASN 60 Ca 0.17 -0.08 -0.43 0.00 1.68 0.00 0.00 54.58 55.92 2nr2 n ASN 60 Cb 0.38 -4.59 -0.05 0.00 -1.54 0.00 0.00 39.78 33.98 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 -3.00 4.64 0.00 2.41 1.01 -0.78 -5.00 121.20 120.47 2nr2 s ILE 61 Ca 0.07 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.21 2nr2 s ILE 61 Cb -0.03 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.12 2nr2 s ILE 61 CO 0.08 -0.71 0.00 1.67 0.00 0.00 0.00 174.94 175.99 2nr2 n GLN 62 N 6.73 0.81 -1.69 2.79 7.27 -1.26 -4.56 117.38 127.47 2nr2 n GLN 62 Ca 0.03 0.00 -0.38 0.00 0.07 0.00 0.00 57.00 56.71 2nr2 n GLN 62 Cb 0.48 0.00 0.05 0.00 2.41 0.00 0.00 30.24 33.18 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 2nr2 n LYS 63 N -0.99 1.30 -3.63 3.69 2.85 -1.26 -4.12 118.16 116.00 2nr2 n LYS 63 Ca 0.00 0.49 -0.20 0.00 -1.05 0.00 0.00 58.31 57.54 2nr2 n LYS 63 Cb 0.00 -2.40 0.05 0.00 -0.65 0.00 0.00 35.03 32.03 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 -1.12 -5.53 -4.50 -1.58 1.02 0.61 -5.00 120.64 104.53 2nr2 n GLU 64 Ca 0.13 0.69 -0.30 0.00 -0.02 0.00 0.00 57.16 57.66 2nr2 n GLU 64 Cb 0.46 -5.42 -0.12 0.00 -0.02 0.00 0.00 31.44 26.34 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 -4.30 3.65 -0.47 1.62 0.01 -1.26 -4.95 113.70 108.00 2nr2 s SER 65 Ca 0.04 -0.57 -0.16 0.00 1.31 0.00 0.00 55.95 56.58 2nr2 s SER 65 Cb -0.02 -0.46 0.07 0.00 0.21 0.00 0.00 66.02 65.82 2nr2 s SER 65 CO 0.79 0.21 0.42 -0.89 0.41 0.00 0.00 173.24 174.18 2nr2 s THR 66 N -1.02 5.19 -0.12 1.44 2.01 -1.26 -0.06 115.64 121.82 2nr2 s THR 66 Ca 0.15 -0.97 -0.15 0.00 0.31 0.00 0.00 61.69 61.04 2nr2 s THR 66 Cb -0.10 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 2nr2 s THR 66 CO 0.07 -0.60 0.35 -0.76 -0.69 0.00 0.00 174.62 172.99 2nr2 s LEU 67 N 1.78 4.30 -0.17 4.42 1.43 0.04 -4.93 118.68 125.56 2nr2 s LEU 67 Ca 0.06 0.67 -0.21 0.00 -1.03 0.00 0.00 54.13 53.62 2nr2 s LEU 67 Cb -0.23 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.48 2nr2 s LEU 67 CO 0.07 0.13 0.62 -1.00 0.23 0.00 0.00 176.35 176.41 2nr2 s HIS 68 N 0.13 3.41 -0.24 0.29 3.76 0.42 -1.19 115.29 121.86 2nr2 s HIS 68 Ca 0.20 0.96 -0.15 0.00 -0.15 0.00 0.00 55.06 55.92 2nr2 s HIS 68 Cb -0.14 -2.77 -0.04 0.00 1.11 0.00 0.00 32.58 30.74 2nr2 s HIS 68 CO 0.07 -0.11 0.38 -1.17 -0.85 0.00 0.00 174.74 173.07 2nr2 s LEU 69 N 1.65 4.08 0.13 0.89 2.96 -0.00 0.08 118.68 128.47 2nr2 s LEU 69 Ca 0.29 0.38 0.09 0.00 -0.22 0.00 0.00 54.13 54.67 2nr2 s LEU 69 Cb -0.16 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 2nr2 s LEU 69 CO 0.11 -0.14 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.17 2nr2 s VAL 70 N 1.78 3.04 -0.22 1.68 1.01 -0.19 -3.08 120.40 124.41 2nr2 s VAL 70 Ca 0.17 -1.52 -0.12 0.00 0.00 0.00 0.00 61.98 60.51 2nr2 s VAL 70 Cb -0.15 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 2nr2 s VAL 70 CO 0.09 0.03 0.21 -0.76 0.00 0.00 0.00 175.10 174.67 2nr2 s LEU 71 N -2.37 4.15 -0.86 3.92 1.43 -1.26 -0.25 118.68 123.43 2nr2 s LEU 71 Ca 0.21 0.24 -0.06 0.00 -1.03 0.00 0.00 54.13 53.49 2nr2 s LEU 71 Cb -0.10 -2.20 0.22 0.00 0.03 0.00 0.00 46.19 44.14 2nr2 s LEU 71 CO 0.12 0.06 0.77 -0.60 0.23 0.00 0.00 176.35 176.93 2nr2 s ARG 72 N 0.93 3.36 -0.17 1.70 3.52 0.20 -4.82 118.95 123.67 2nr2 s ARG 72 Ca 0.10 -2.95 -0.18 0.00 -0.13 0.00 0.00 55.73 52.57 2nr2 s ARG 72 Cb -0.13 -4.11 -0.14 0.00 -1.56 0.00 0.00 34.95 29.01 2nr2 s ARG 72 CO 0.04 -1.24 0.18 -0.07 -0.81 0.00 0.00 175.30 173.40 2nr2 h LEU 73 N 6.68 0.00 0.00 -0.88 3.38 -1.95 -3.40 115.31 119.14 2nr2 h LEU 73 Ca 0.11 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 2nr2 h LEU 73 Cb 0.90 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2nr2 h LEU 73 CO 0.83 1.13 -0.89 -1.14 0.09 0.00 0.00 178.44 178.47 2nr2 n ARG 74 N -4.54 0.34 -1.45 1.13 0.63 -1.26 -5.10 116.66 106.40 2nr2 n ARG 74 Ca -0.19 0.14 0.00 0.00 -0.92 0.00 0.00 57.85 56.87 2nr2 n ARG 74 Cb 0.48 -1.09 0.00 0.00 0.45 0.00 0.00 32.46 32.30 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2nr2 n GLY 75 N 2.16 -0.39 0.00 5.14 0.00 -1.26 -5.25 105.19 105.60 2nr2 n GLY 75 Ca -0.14 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93