#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 4.14 0.17 3.17 0.74 -1.26 -0.71 119.66 125.91 2nr2 s GLN 2 Ca 0.00 -0.24 0.06 0.00 0.05 0.00 0.00 55.36 55.23 2nr2 s GLN 2 Cb 0.00 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2nr2 s GLN 2 CO 0.00 0.30 -0.13 0.96 -0.55 0.00 0.00 175.29 175.88 2nr2 s ILE 3 N 0.34 1.45 -0.03 -2.34 -4.36 0.41 -0.43 121.20 116.24 2nr2 s ILE 3 Ca 0.07 -2.09 -0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2nr2 s ILE 3 Cb -0.11 -1.90 -0.04 0.00 1.25 0.00 0.00 42.46 41.66 2nr2 s ILE 3 CO -0.02 -0.64 0.02 -0.36 0.24 0.00 0.00 174.94 174.18 2nr2 s PHE 4 N -3.02 3.15 -0.18 1.37 0.08 -0.92 -1.30 117.98 117.16 2nr2 s PHE 4 Ca 0.18 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.38 2nr2 s PHE 4 Cb 0.00 -1.72 0.02 0.00 -0.57 0.00 0.00 43.02 40.75 2nr2 s PHE 4 CO 0.04 0.48 -0.19 0.08 -0.10 0.00 0.00 175.22 175.53 2nr2 s VAL 5 N -1.04 2.17 -0.07 -0.44 1.01 0.29 -0.12 120.40 122.20 2nr2 s VAL 5 Ca 0.18 -0.90 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 2nr2 s VAL 5 Cb -0.12 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2nr2 s VAL 5 CO 0.08 0.53 0.04 -0.54 0.00 0.00 0.00 175.10 175.22 2nr2 s LYS 6 N 1.30 3.06 0.64 2.72 1.02 0.23 -0.04 119.74 128.67 2nr2 s LYS 6 Ca 0.05 -0.39 0.04 0.00 0.02 0.00 0.00 55.97 55.69 2nr2 s LYS 6 Cb -0.13 -2.86 0.10 0.00 -0.52 0.00 0.00 37.83 34.42 2nr2 s LYS 6 CO -0.12 0.70 0.89 0.95 -0.92 0.00 0.00 175.35 176.84 2nr2 s THR 7 N -0.99 2.18 0.18 2.17 -4.23 -0.99 0.64 115.64 114.59 2nr2 s THR 7 Ca 0.16 -0.79 -0.13 0.00 -1.18 0.00 0.00 61.69 59.75 2nr2 s THR 7 Cb -0.12 -2.39 0.07 0.00 1.34 0.00 0.00 72.50 71.40 2nr2 s THR 7 CO 0.06 0.00 1.79 0.25 -0.54 0.00 0.00 174.62 176.18 2nr2 h LEU 8 N -0.17 0.39 -0.12 4.79 5.85 -1.92 -2.49 115.31 121.65 2nr2 h LEU 8 Ca -0.34 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2nr2 h LEU 8 Cb 1.28 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2nr2 h LEU 8 CO 0.41 0.28 0.00 0.35 -0.34 0.00 0.00 178.44 179.13 2nr2 n THR 9 N -4.86 0.58 0.00 1.05 -2.24 -1.26 -4.89 114.28 102.66 2nr2 n THR 9 Ca 0.04 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2nr2 n THR 9 Cb 0.11 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 2nr2 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nr2 n GLY 10 N 1.07 1.97 3.53 3.38 0.00 -0.94 -5.08 105.19 109.13 2nr2 n GLY 10 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.72 3.38 -0.35 1.61 2.20 -1.26 -4.86 119.74 119.74 2nr2 s LYS 11 Ca 0.00 -0.28 -0.26 0.00 -0.36 0.00 0.00 55.97 55.07 2nr2 s LYS 11 Cb 0.00 -3.91 0.01 0.00 -1.51 0.00 0.00 37.83 32.42 2nr2 s LYS 11 CO 0.00 -0.92 0.93 0.99 -0.36 0.00 0.00 175.35 175.98 2nr2 s THR 12 N 2.75 4.61 -0.22 3.43 2.01 -1.26 -2.35 115.64 124.61 2nr2 s THR 12 Ca 0.22 1.29 -0.09 0.00 0.31 0.00 0.00 61.69 63.42 2nr2 s THR 12 Cb -0.14 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.01 2nr2 s THR 12 CO 0.18 -0.47 0.12 -0.63 -0.69 0.00 0.00 174.62 173.13 2nr2 s ILE 13 N 3.41 5.16 -0.21 1.82 1.01 0.94 -4.92 121.20 128.40 2nr2 s ILE 13 Ca 0.38 0.11 -0.07 0.00 0.00 0.00 0.00 60.65 61.06 2nr2 s ILE 13 Cb -0.12 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 2nr2 s ILE 13 CO 0.17 0.39 0.07 -0.89 0.00 0.00 0.00 174.94 174.68 2nr2 s THR 14 N 0.81 4.61 0.09 2.92 2.01 -1.26 -0.54 115.64 124.27 2nr2 s THR 14 Ca 0.06 -0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.04 2nr2 s THR 14 Cb -0.13 -3.12 -0.03 0.00 0.01 0.00 0.00 72.50 69.23 2nr2 s THR 14 CO 0.02 0.40 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.42 2nr2 s LEU 15 N 0.95 2.31 -0.11 4.42 1.43 -0.42 -5.02 118.68 122.24 2nr2 s LEU 15 Ca 0.04 -0.67 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2nr2 s LEU 15 Cb -0.14 -0.66 -0.01 0.00 0.03 0.00 0.00 46.19 45.41 2nr2 s LEU 15 CO 0.03 -0.04 -0.17 -1.61 0.23 0.00 0.00 176.35 174.80 2nr2 s GLU 16 N -1.95 3.15 0.16 1.70 2.02 -1.26 -0.44 118.70 122.07 2nr2 s GLU 16 Ca 0.03 -0.75 -0.05 0.00 0.02 0.00 0.00 54.97 54.21 2nr2 s GLU 16 Cb -0.09 -2.49 -0.02 0.00 0.10 0.00 0.00 34.13 31.63 2nr2 s GLU 16 CO 0.03 0.26 0.19 0.14 0.02 0.00 0.00 175.26 175.91 2nr2 s VAL 17 N 0.19 0.07 0.12 2.63 -7.23 0.11 -4.92 120.40 111.37 2nr2 s VAL 17 Ca -0.10 -1.63 0.02 0.00 -1.81 0.00 0.00 61.98 58.46 2nr2 s VAL 17 Cb -0.16 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 2nr2 s VAL 17 CO 0.06 -0.33 0.23 -1.61 -0.31 0.00 0.00 175.10 173.13 2nr2 s GLU 18 N -4.01 3.34 0.20 4.82 0.41 -1.26 0.21 118.70 122.41 2nr2 s GLU 18 Ca 0.21 -0.59 0.20 0.00 -0.41 0.00 0.00 54.97 54.39 2nr2 s GLU 18 Cb 0.05 -2.93 0.89 0.00 -1.78 0.00 0.00 34.13 30.35 2nr2 s GLU 18 CO 0.02 0.55 1.61 -2.30 -0.49 0.00 0.00 175.26 174.65 2nr2 n PRO 19 N -0.19 0.14 -0.01 0.39 -0.02 -1.26 -0.93 135.00 133.13 2nr2 n PRO 19 Ca -0.07 0.43 0.14 0.00 -2.02 0.00 0.00 63.50 61.98 2nr2 n PRO 19 Cb 0.53 -1.79 0.71 0.00 -0.02 0.00 0.00 33.50 32.93 2nr2 n PRO 19 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2nr2 n SER 20 N -2.06 0.65 -4.74 2.55 3.41 -1.26 -0.88 113.62 111.29 2nr2 n SER 20 Ca 0.02 -1.28 -0.41 0.00 -0.26 0.00 0.00 58.87 56.94 2nr2 n SER 20 Cb 0.17 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 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 -1.91 7.33 0.61 4.04 1.01 -0.10 -4.88 116.67 122.76 2nr2 s ASP 21 Ca 0.41 2.05 -0.17 0.00 0.71 0.00 0.00 52.55 55.55 2nr2 s ASP 21 Cb 0.20 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.50 2nr2 s ASP 21 CO 0.33 -0.16 1.11 0.42 0.21 0.00 0.00 175.17 177.09 2nr2 s THR 22 N -0.38 3.26 0.62 -1.27 -4.23 -1.26 -2.89 115.64 109.48 2nr2 s THR 22 Ca 0.48 0.66 0.34 0.00 -1.18 0.00 0.00 61.69 61.99 2nr2 s THR 22 Cb -0.28 -3.20 0.37 0.00 1.34 0.00 0.00 72.50 70.73 2nr2 s THR 22 CO 0.34 -0.29 2.17 0.40 -0.54 0.00 0.00 174.62 176.71 2nr2 h ILE 23 N 0.54 0.27 -0.75 2.99 1.08 -1.07 -0.15 117.51 120.41 2nr2 h ILE 23 Ca -0.48 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.10 2nr2 h ILE 23 Cb 1.25 0.88 -0.08 0.00 -3.07 0.00 0.00 36.82 35.80 2nr2 h ILE 23 CO 0.55 0.00 0.37 -0.08 -0.69 0.00 0.00 178.15 178.31 2nr2 h GLU 24 N 0.00 0.58 0.00 2.37 4.81 -1.82 -2.71 114.58 117.81 2nr2 h GLU 24 Ca 0.04 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 0.32 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2nr2 h GLU 24 CO -0.00 0.38 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.46 2nr2 h ASN 25 N 0.60 0.00 -0.45 1.04 4.21 -1.35 0.19 115.58 119.81 2nr2 h ASN 25 Ca 0.39 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.80 2nr2 h ASN 25 Cb 0.46 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.65 2nr2 h ASN 25 CO -0.31 0.29 -0.10 0.58 -1.29 0.00 0.00 177.43 176.61 2nr2 h VAL 26 N 0.00 1.27 -0.10 2.81 2.07 -1.43 -1.00 116.25 119.87 2nr2 h VAL 26 Ca -0.00 -1.21 -0.15 0.00 0.82 0.00 0.00 66.70 66.16 2nr2 h VAL 26 Cb 0.55 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2nr2 h VAL 26 CO 0.04 0.42 -0.59 0.11 0.02 0.00 0.00 177.57 177.57 2nr2 h LYS 27 N 0.71 0.33 -0.63 1.57 1.57 -1.11 -1.99 116.57 117.01 2nr2 h LYS 27 Ca 0.12 -0.22 0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2nr2 h LYS 27 Cb 0.64 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.93 2nr2 h LYS 27 CO 0.04 0.82 0.36 0.00 -0.57 0.00 0.00 179.45 180.11 2nr2 h ALA 28 N 1.13 0.83 -0.78 3.86 0.00 -0.55 0.23 119.26 123.99 2nr2 h ALA 28 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2nr2 h ALA 28 Cb 1.10 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2nr2 h ALA 28 CO 0.10 0.06 0.42 0.87 0.00 0.00 0.00 179.25 180.70 2nr2 h LYS 29 N 0.69 1.08 -0.25 0.00 1.57 -0.90 -0.51 116.57 118.25 2nr2 h LYS 29 Ca 0.27 -0.12 -0.16 0.00 -1.87 0.00 0.00 60.65 58.77 2nr2 h LYS 29 Cb 0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2nr2 h LYS 29 CO -0.15 0.79 -0.48 0.82 -0.57 0.00 0.00 179.45 179.87 2nr2 h ILE 30 N 1.09 1.30 -0.58 1.86 2.04 -0.64 -2.98 117.51 119.60 2nr2 h ILE 30 Ca 0.27 -1.68 0.10 0.00 1.00 0.00 0.00 64.86 64.55 2nr2 h ILE 30 Cb 0.03 1.62 -0.08 0.00 -0.74 0.00 0.00 36.82 37.65 2nr2 h ILE 30 CO -0.04 0.54 0.16 -0.61 0.00 0.00 0.00 178.15 178.19 2nr2 h GLN 31 N 0.54 0.30 0.50 2.37 4.15 0.21 0.71 115.11 123.88 2nr2 h GLN 31 Ca 0.03 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 2nr2 h GLN 31 Cb 1.03 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.63 2nr2 h GLN 31 CO 0.10 0.20 -0.50 0.22 -1.93 0.00 0.00 178.83 176.91 2nr2 h ASP 32 N 0.31 -1.38 0.52 -0.69 3.58 -1.12 -1.96 116.42 115.67 2nr2 h ASP 32 Ca 0.30 0.11 -0.03 0.00 0.42 0.00 0.00 57.03 57.84 2nr2 h ASP 32 Cb 0.41 0.46 0.01 0.00 1.72 0.00 0.00 39.33 41.92 2nr2 h ASP 32 CO -0.35 -0.67 -0.25 0.11 -2.88 0.00 0.00 179.24 175.20 2nr2 h LYS 33 N -1.01 -0.67 0.00 0.28 1.57 -1.35 -3.40 116.57 111.99 2nr2 h LYS 33 Ca -0.06 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2nr2 h LYS 33 Cb 0.87 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 2nr2 h LYS 33 CO -0.07 -0.45 -0.02 0.93 -0.57 0.00 0.00 179.45 179.28 2nr2 h GLU 34 N -1.16 0.00 0.00 3.15 4.39 -1.01 -3.49 114.58 116.46 2nr2 h GLU 34 Ca -0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2nr2 h GLU 34 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2nr2 h GLU 34 CO 0.12 0.01 0.00 0.41 -1.16 0.00 0.00 179.01 178.38 2nr2 n GLY 35 N 1.77 1.52 3.67 -3.84 0.00 -0.74 -5.01 105.19 102.57 2nr2 n GLY 35 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.24 2.88 0.45 -0.61 1.01 -1.26 -4.83 121.20 117.60 2nr2 s ILE 36 Ca 0.00 0.09 -0.25 0.00 0.00 0.00 0.00 60.65 60.49 2nr2 s ILE 36 Cb 0.00 -3.06 -0.08 0.00 0.01 0.00 0.00 42.46 39.33 2nr2 s ILE 36 CO 0.00 -0.01 1.42 -2.84 0.00 0.00 0.00 174.94 173.52 2nr2 s PRO 37 N 3.74 3.66 0.00 2.79 0.02 -1.26 -4.11 135.00 139.84 2nr2 s PRO 37 Ca 0.84 2.41 0.29 0.00 0.02 0.00 0.00 61.00 64.56 2nr2 s PRO 37 Cb -0.43 -2.64 1.21 0.00 0.02 0.00 0.00 34.50 32.66 2nr2 s PRO 37 CO 0.39 -0.83 1.91 -0.35 -0.33 0.00 0.00 177.00 177.78 2nr2 n PRO 38 N -0.23 0.01 0.11 5.54 -0.04 -1.26 -0.95 135.00 138.17 2nr2 n PRO 38 Ca 0.05 -0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.64 2nr2 n PRO 38 Cb 0.42 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.76 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2nr2 n ASP 39 N -1.50 0.84 -0.06 3.54 5.75 -1.26 -3.61 116.55 120.26 2nr2 n ASP 39 Ca 0.07 0.55 -0.12 0.00 -0.01 0.00 0.00 54.79 55.28 2nr2 n ASP 39 Cb 0.34 -0.75 -0.15 0.00 -1.03 0.00 0.00 41.12 39.54 2nr2 n ASP 39 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2nr2 n GLN 40 N -2.29 0.67 -1.90 0.11 7.27 -0.13 -4.94 117.38 116.17 2nr2 n GLN 40 Ca 0.05 0.17 -0.39 0.00 0.07 0.00 0.00 57.00 56.91 2nr2 n GLN 40 Cb 0.44 -1.66 0.02 0.00 2.41 0.00 0.00 30.24 31.45 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2nr2 s GLN 41 N -2.55 3.45 -0.04 3.69 -0.21 -0.84 -1.55 119.66 121.62 2nr2 s GLN 41 Ca -0.12 2.17 0.01 0.00 0.02 0.00 0.00 55.36 57.45 2nr2 s GLN 41 Cb 0.07 -2.42 0.02 0.00 1.00 0.00 0.00 33.01 31.69 2nr2 s GLN 41 CO 0.80 -0.92 -0.04 1.03 -2.12 0.00 0.00 175.29 174.03 2nr2 s ARG 42 N -2.71 0.74 -0.19 2.91 0.52 0.08 -4.81 118.95 115.49 2nr2 s ARG 42 Ca 0.66 -0.09 -0.09 0.00 -0.52 0.00 0.00 55.73 55.69 2nr2 s ARG 42 Cb -0.39 -0.76 -0.05 0.00 0.52 0.00 0.00 34.95 34.27 2nr2 s ARG 42 CO 0.47 -0.07 0.12 -0.51 0.02 0.00 0.00 175.30 175.33 2nr2 s LEU 43 N 0.86 4.20 -0.02 2.53 1.43 -1.26 -1.27 118.68 125.14 2nr2 s LEU 43 Ca -0.11 0.25 0.08 0.00 -1.03 0.00 0.00 54.13 53.32 2nr2 s LEU 43 Cb -0.14 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 2nr2 s LEU 43 CO 0.00 0.22 -0.26 -0.63 0.23 0.00 0.00 176.35 175.91 2nr2 s ILE 44 N 0.15 2.03 -0.02 -0.59 1.01 0.32 -0.70 121.20 123.39 2nr2 s ILE 44 Ca 0.09 -1.10 0.01 0.00 0.00 0.00 0.00 60.65 59.65 2nr2 s ILE 44 Cb -0.11 -1.68 0.01 0.00 0.01 0.00 0.00 42.46 40.69 2nr2 s ILE 44 CO -0.01 0.57 -0.05 0.12 0.00 0.00 0.00 174.94 175.58 2nr2 s PHE 45 N -0.60 0.59 0.00 3.97 5.36 -1.04 0.10 117.98 126.37 2nr2 s PHE 45 Ca 0.10 -0.13 0.00 0.00 -0.96 0.00 0.00 56.93 55.94 2nr2 s PHE 45 Cb -0.10 -0.48 0.00 0.00 -0.34 0.00 0.00 43.02 42.10 2nr2 s PHE 45 CO -0.01 -0.10 0.00 0.00 -1.46 0.00 0.00 175.22 173.65 2nr2 n ALA 46 N 3.54 0.00 0.00 11.12 0.00 -1.26 -2.66 120.51 131.25 2nr2 n ALA 46 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2nr2 n ALA 46 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 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 -0.32 3.75 0.00 0.00 -1.26 -5.12 105.19 102.24 2nr2 n GLY 47 Ca 0.00 0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2nr2 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 48 N -1.73 4.60 -0.05 1.61 -2.85 -1.09 -5.03 119.74 115.21 2nr2 s LYS 48 Ca 0.00 1.83 -0.30 0.00 -1.00 0.00 0.00 55.97 56.50 2nr2 s LYS 48 Cb 0.00 -3.20 -0.04 0.00 -2.06 0.00 0.00 37.83 32.53 2nr2 s LYS 48 CO 0.00 0.14 1.29 -1.14 0.10 0.00 0.00 175.35 175.74 2nr2 s GLN 49 N -1.18 4.31 0.54 1.78 0.74 -1.26 -2.49 119.66 122.09 2nr2 s GLN 49 Ca 0.46 1.78 -0.07 0.00 0.05 0.00 0.00 55.36 57.59 2nr2 s GLN 49 Cb -0.32 -3.60 -0.02 0.00 1.10 0.00 0.00 33.01 30.16 2nr2 s GLN 49 CO 0.40 -0.54 0.87 -0.51 -0.55 0.00 0.00 175.29 174.97 2nr2 s LEU 50 N 2.51 3.42 -0.04 3.68 1.43 0.12 -5.00 118.68 124.80 2nr2 s LEU 50 Ca 0.59 0.95 -0.01 0.00 -1.03 0.00 0.00 54.13 54.63 2nr2 s LEU 50 Cb -0.27 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 42.04 2nr2 s LEU 50 CO 0.23 -0.80 0.06 -1.61 0.23 0.00 0.00 176.35 174.46 2nr2 s GLU 51 N -4.91 3.06 0.11 1.70 2.02 -1.26 -4.70 118.70 114.72 2nr2 s GLU 51 Ca 0.51 -0.44 -0.15 0.00 0.02 0.00 0.00 54.97 54.91 2nr2 s GLU 51 Cb -0.10 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 31.22 2nr2 s GLU 51 CO 0.47 0.67 1.52 -0.44 0.02 0.00 0.00 175.26 177.50 2nr2 h ASP 52 N 4.47 0.68 0.00 -0.19 3.32 -1.98 -2.84 116.42 119.87 2nr2 h ASP 52 Ca -0.50 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.19 2nr2 h ASP 52 Cb 1.19 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2nr2 h ASP 52 CO 0.59 0.87 0.00 0.61 -1.72 0.00 0.00 179.24 179.60 2nr2 n GLY 53 N -0.21 0.21 3.62 2.75 0.00 -1.26 -3.21 105.19 107.10 2nr2 n GLY 53 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.41 1.96 0.54 1.61 0.52 -1.07 -5.04 118.95 116.05 2nr2 s ARG 54 Ca 0.00 -2.13 0.07 0.00 -0.52 0.00 0.00 55.73 53.15 2nr2 s ARG 54 Cb 0.00 -1.56 0.04 0.00 0.52 0.00 0.00 34.95 33.95 2nr2 s ARG 54 CO 0.00 -0.10 0.49 0.95 0.02 0.00 0.00 175.30 176.66 2nr2 s THR 55 N -2.78 1.89 0.28 0.02 -4.23 -1.26 -0.94 115.64 108.62 2nr2 s THR 55 Ca 0.32 -1.36 0.07 0.00 -1.18 0.00 0.00 61.69 59.54 2nr2 s THR 55 Cb 0.09 -2.25 0.01 0.00 1.34 0.00 0.00 72.50 71.69 2nr2 s THR 55 CO 0.16 0.00 1.66 -0.07 -0.54 0.00 0.00 174.62 175.83 2nr2 h LEU 56 N 0.65 0.18 -0.52 4.79 3.38 -1.36 -3.27 115.31 119.16 2nr2 h LEU 56 Ca -0.36 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.43 2nr2 h LEU 56 Cb 1.29 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 2nr2 h LEU 56 CO 0.53 0.65 -0.05 -1.28 0.09 0.00 0.00 178.44 178.39 2nr2 h SER 57 N 0.13 0.95 -0.71 -0.43 0.87 -1.31 -2.61 113.55 110.43 2nr2 h SER 57 Ca 0.00 -0.33 0.15 0.00 -1.23 0.00 0.00 61.79 60.39 2nr2 h SER 57 Cb 0.94 -0.26 -0.11 0.00 -0.44 0.00 0.00 62.40 62.53 2nr2 h SER 57 CO 0.07 1.05 0.16 0.44 -0.53 0.00 0.00 176.83 178.03 2nr2 h ASP 58 N 0.83 0.00 0.04 6.23 3.32 -1.85 -1.38 116.42 123.61 2nr2 h ASP 58 Ca 0.14 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2nr2 h ASP 58 Cb 0.59 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2nr2 h ASP 58 CO 0.04 -0.03 -0.02 -1.22 -1.72 0.00 0.00 179.24 176.29 2nr2 n TYR 59 N -5.16 0.00 -3.41 4.55 4.01 -1.10 -4.95 117.16 111.11 2nr2 n TYR 59 Ca 0.13 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.63 2nr2 n TYR 59 Cb 0.44 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.48 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 -0.46 -5.54 -4.64 7.72 3.02 -0.52 -4.96 115.26 109.88 2nr2 n ASN 60 Ca 0.20 -0.47 -0.43 0.00 -0.03 0.00 0.00 54.58 53.86 2nr2 n ASN 60 Cb 0.25 -4.44 -0.02 0.00 -0.61 0.00 0.00 39.78 34.95 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 -3.20 3.79 0.76 2.41 1.01 -1.03 -5.03 121.20 119.91 2nr2 s ILE 61 Ca 0.47 0.91 -0.03 0.00 0.00 0.00 0.00 60.65 61.99 2nr2 s ILE 61 Cb -0.22 -3.73 0.14 0.00 0.01 0.00 0.00 42.46 38.66 2nr2 s ILE 61 CO 0.58 -0.25 1.05 -1.10 0.00 0.00 0.00 174.94 175.22 2nr2 s GLN 62 N 4.36 1.49 0.64 2.79 -0.21 -1.26 -4.77 119.66 122.69 2nr2 s GLN 62 Ca 0.68 -1.01 -0.17 0.00 0.02 0.00 0.00 55.36 54.89 2nr2 s GLN 62 Cb -0.25 -2.25 -0.01 0.00 1.00 0.00 0.00 33.01 31.50 2nr2 s GLN 62 CO 0.27 -1.62 1.15 -1.59 -2.12 0.00 0.00 175.29 171.38 2nr2 s LYS 63 N -5.27 2.82 -1.21 2.91 -2.85 -1.26 -3.96 119.74 110.91 2nr2 s LYS 63 Ca 0.68 1.59 0.00 0.00 -1.00 0.00 0.00 55.97 57.23 2nr2 s LYS 63 Cb -0.05 -1.94 0.00 0.00 -2.06 0.00 0.00 37.83 33.79 2nr2 s LYS 63 CO 0.46 -1.27 0.00 0.39 0.10 0.00 0.00 175.35 175.03 2nr2 n GLU 64 N -2.09 -1.03 -3.84 1.78 1.02 0.43 -4.99 120.64 111.92 2nr2 n GLU 64 Ca 0.12 0.73 -0.34 0.00 -0.02 0.00 0.00 57.16 57.64 2nr2 n GLU 64 Cb 0.51 -4.93 -0.05 0.00 -0.02 0.00 0.00 31.44 26.95 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 -2.52 6.43 -0.23 1.62 0.01 -1.25 -4.86 113.70 112.90 2nr2 s SER 65 Ca 0.00 0.46 -0.05 0.00 1.31 0.00 0.00 55.95 57.66 2nr2 s SER 65 Cb 0.00 -2.05 -0.02 0.00 0.21 0.00 0.00 66.02 64.16 2nr2 s SER 65 CO 0.00 0.28 0.01 -0.89 0.41 0.00 0.00 173.24 173.05 2nr2 s THR 66 N -1.27 3.86 0.42 1.44 2.01 -1.26 -2.16 115.64 118.69 2nr2 s THR 66 Ca 0.25 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 61.93 2nr2 s THR 66 Cb -0.13 -2.78 -0.01 0.00 0.01 0.00 0.00 72.50 69.59 2nr2 s THR 66 CO 0.15 0.39 0.65 -0.76 -0.69 0.00 0.00 174.62 174.36 2nr2 s LEU 67 N 1.46 3.74 -0.08 4.42 1.02 0.83 -4.74 118.68 125.34 2nr2 s LEU 67 Ca 0.05 0.38 0.05 0.00 0.02 0.00 0.00 54.13 54.63 2nr2 s LEU 67 Cb -0.15 -3.26 -0.01 0.00 0.02 0.00 0.00 46.19 42.80 2nr2 s LEU 67 CO 0.00 -0.58 -0.24 -1.00 0.02 0.00 0.00 176.35 174.55 2nr2 s HIS 68 N -2.51 2.51 -0.22 0.29 3.76 0.12 -0.60 115.29 118.64 2nr2 s HIS 68 Ca 0.46 -0.86 0.01 0.00 -0.15 0.00 0.00 55.06 54.51 2nr2 s HIS 68 Cb -0.10 -1.66 0.03 0.00 1.11 0.00 0.00 32.58 31.96 2nr2 s HIS 68 CO 0.38 -0.30 -0.14 -1.17 -0.85 0.00 0.00 174.74 172.66 2nr2 s LEU 69 N 0.07 2.72 0.42 0.89 2.96 0.21 -0.52 118.68 125.42 2nr2 s LEU 69 Ca -0.11 -0.86 0.07 0.00 -0.22 0.00 0.00 54.13 53.01 2nr2 s LEU 69 Cb -0.16 -1.55 -0.07 0.00 0.50 0.00 0.00 46.19 44.92 2nr2 s LEU 69 CO 0.06 -0.07 0.08 0.68 -1.32 0.00 0.00 176.35 175.77 2nr2 s VAL 70 N 1.26 2.08 0.12 1.68 -7.23 -0.40 -3.58 120.40 114.33 2nr2 s VAL 70 Ca 0.01 -1.88 0.05 0.00 -1.81 0.00 0.00 61.98 58.35 2nr2 s VAL 70 Cb -0.16 -2.96 -0.04 0.00 0.56 0.00 0.00 36.38 33.78 2nr2 s VAL 70 CO -0.09 0.00 0.03 -0.76 -0.31 0.00 0.00 175.10 173.97 2nr2 s LEU 71 N -3.79 3.50 0.25 1.32 1.43 -1.26 -0.74 118.68 119.39 2nr2 s LEU 71 Ca 0.36 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 2nr2 s LEU 71 Cb 0.07 -2.19 -0.09 0.00 0.03 0.00 0.00 46.19 44.01 2nr2 s LEU 71 CO 0.19 0.14 0.97 -0.60 0.23 0.00 0.00 176.35 177.28 2nr2 s ARG 72 N -2.58 4.81 0.11 1.70 3.52 -0.59 -4.89 118.95 121.02 2nr2 s ARG 72 Ca 0.27 1.55 -0.19 0.00 -0.13 0.00 0.00 55.73 57.23 2nr2 s ARG 72 Cb -0.11 -3.25 -0.07 0.00 -1.56 0.00 0.00 34.95 29.96 2nr2 s ARG 72 CO 0.19 0.45 0.59 -0.51 -0.81 0.00 0.00 175.30 175.22 2nr2 s LEU 73 N -1.26 4.48 0.23 -0.88 1.43 -1.26 -5.04 118.68 116.39 2nr2 s LEU 73 Ca 0.42 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.49 2nr2 s LEU 73 Cb -0.27 -3.06 -0.10 0.00 0.03 0.00 0.00 46.19 42.79 2nr2 s LEU 73 CO 0.34 0.22 1.48 -0.60 0.23 0.00 0.00 176.35 178.01 2nr2 s ARG 74 N -1.35 4.24 0.00 1.70 3.52 -1.26 -3.58 118.95 122.23 2nr2 s ARG 74 Ca 0.32 2.33 0.00 0.00 -0.13 0.00 0.00 55.73 58.26 2nr2 s ARG 74 Cb -0.19 -3.11 0.00 0.00 -1.56 0.00 0.00 34.95 30.09 2nr2 s ARG 74 CO 0.20 -0.48 0.00 0.41 -0.81 0.00 0.00 175.30 174.62 2nr2 n GLY 75 N 2.55 4.18 0.00 8.12 0.00 -1.26 -5.33 105.19 113.44 2nr2 n GLY 75 Ca 0.08 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93