#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 2.73 0.07 3.17 -2.07 -1.26 -0.76 119.66 121.54 2nr2 s GLN 2 Ca 0.00 -0.70 0.03 0.00 -1.82 0.00 0.00 55.36 52.88 2nr2 s GLN 2 Cb 0.00 -2.64 -0.03 0.00 -1.09 0.00 0.00 33.01 29.25 2nr2 s GLN 2 CO 0.00 0.59 -0.10 0.96 -1.32 0.00 0.00 175.29 175.42 2nr2 s ILE 3 N -1.21 0.78 -0.12 3.63 -4.36 -0.17 -0.17 121.20 119.58 2nr2 s ILE 3 Ca 0.23 -1.36 -0.02 0.00 -0.26 0.00 0.00 60.65 59.25 2nr2 s ILE 3 Cb -0.12 -1.01 -0.03 0.00 1.25 0.00 0.00 42.46 42.56 2nr2 s ILE 3 CO 0.15 -0.45 -0.05 -0.36 0.24 0.00 0.00 174.94 174.47 2nr2 s PHE 4 N -1.86 2.99 -0.31 1.37 0.08 -0.19 -0.80 117.98 119.26 2nr2 s PHE 4 Ca -0.02 -0.16 -0.02 0.00 0.12 0.00 0.00 56.93 56.84 2nr2 s PHE 4 Cb -0.07 -1.85 0.05 0.00 -0.57 0.00 0.00 43.02 40.59 2nr2 s PHE 4 CO 0.00 0.13 0.02 0.08 -0.10 0.00 0.00 175.22 175.35 2nr2 s VAL 5 N -0.16 3.08 -0.12 -0.44 1.01 0.32 -1.15 120.40 122.94 2nr2 s VAL 5 Ca 0.03 -1.38 -0.16 0.00 0.00 0.00 0.00 61.98 60.46 2nr2 s VAL 5 Cb -0.13 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 2nr2 s VAL 5 CO 0.03 -0.14 0.40 -0.75 0.00 0.00 0.00 175.10 174.64 2nr2 s LYS 6 N 1.26 4.25 0.71 2.72 2.47 0.00 -1.39 119.74 129.76 2nr2 s LYS 6 Ca -0.04 0.32 -0.04 0.00 -1.56 0.00 0.00 55.97 54.64 2nr2 s LYS 6 Cb -0.20 -3.40 0.15 0.00 -1.46 0.00 0.00 37.83 32.92 2nr2 s LYS 6 CO -0.01 0.26 0.97 0.25 0.16 0.00 0.00 175.35 176.98 2nr2 n THR 7 N 3.39 0.00 0.04 3.43 -2.24 -0.50 -1.87 114.28 116.53 2nr2 n THR 7 Ca -0.10 -1.26 -0.13 0.00 -2.27 0.00 0.00 64.05 60.29 2nr2 n THR 7 Cb 0.52 -1.11 -0.14 0.00 -2.10 0.00 0.00 70.33 67.50 2nr2 n THR 7 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2nr2 h LEU 8 N 0.00 0.22 -0.87 3.22 5.85 -1.90 -3.37 115.31 118.46 2nr2 h LEU 8 Ca -0.32 -0.33 -0.11 0.00 0.84 0.00 0.00 57.88 57.97 2nr2 h LEU 8 Cb 1.08 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2nr2 h LEU 8 CO 0.30 1.28 -0.34 0.71 -0.34 0.00 0.00 178.44 180.05 2nr2 h THR 9 N 0.04 1.29 0.00 1.05 1.35 -1.94 -3.46 112.91 111.23 2nr2 h THR 9 Ca -0.22 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 2nr2 h THR 9 Cb 1.97 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 2nr2 h THR 9 CO 0.13 0.44 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 2nr2 n GLY 10 N -0.23 1.00 3.22 5.82 0.00 -1.26 -5.15 105.19 108.59 2nr2 n GLY 10 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 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 1.03 -0.15 1.61 2.20 -1.26 -4.98 119.74 118.19 2nr2 s LYS 11 Ca 0.00 -1.01 0.01 0.00 -0.36 0.00 0.00 55.97 54.61 2nr2 s LYS 11 Cb 0.00 -1.16 0.02 0.00 -1.51 0.00 0.00 37.83 35.18 2nr2 s LYS 11 CO 0.00 0.27 -0.17 0.99 -0.36 0.00 0.00 175.35 176.08 2nr2 s THR 12 N -1.10 1.75 -0.23 3.43 2.01 -1.26 -1.42 115.64 118.82 2nr2 s THR 12 Ca 0.03 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.15 2nr2 s THR 12 Cb -0.10 -1.60 -0.05 0.00 0.01 0.00 0.00 72.50 70.77 2nr2 s THR 12 CO 0.03 0.49 0.24 -0.63 -0.69 0.00 0.00 174.62 174.06 2nr2 s ILE 13 N 1.25 5.30 -0.30 1.82 1.01 -0.49 -4.89 121.20 124.90 2nr2 s ILE 13 Ca 0.01 0.35 -0.11 0.00 0.00 0.00 0.00 60.65 60.91 2nr2 s ILE 13 Cb -0.14 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 2nr2 s ILE 13 CO -0.08 0.30 0.18 -0.89 0.00 0.00 0.00 174.94 174.45 2nr2 s THR 14 N 1.23 5.09 0.31 2.92 2.01 -1.26 -0.52 115.64 125.41 2nr2 s THR 14 Ca 0.11 -0.05 0.10 0.00 0.31 0.00 0.00 61.69 62.17 2nr2 s THR 14 Cb -0.14 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 2nr2 s THR 14 CO 0.06 0.17 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.32 2nr2 s LEU 15 N 1.71 2.85 -0.14 4.42 1.43 0.02 -4.97 118.68 124.00 2nr2 s LEU 15 Ca 0.06 -0.97 -0.07 0.00 -1.03 0.00 0.00 54.13 52.12 2nr2 s LEU 15 Cb -0.16 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 2nr2 s LEU 15 CO 0.09 -0.09 0.11 -1.61 0.23 0.00 0.00 176.35 175.08 2nr2 s GLU 16 N -3.62 3.65 0.23 1.70 2.02 -1.26 -1.00 118.70 120.42 2nr2 s GLU 16 Ca 0.32 -0.21 -0.02 0.00 0.02 0.00 0.00 54.97 55.08 2nr2 s GLU 16 Cb -0.03 -3.21 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 2nr2 s GLU 16 CO 0.18 0.58 0.22 0.14 0.02 0.00 0.00 175.26 176.40 2nr2 s VAL 17 N -0.47 0.00 0.10 2.63 -7.23 0.06 -4.96 120.40 110.52 2nr2 s VAL 17 Ca 0.11 -1.88 0.10 0.00 -1.81 0.00 0.00 61.98 58.50 2nr2 s VAL 17 Cb -0.12 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 2nr2 s VAL 17 CO 0.02 0.00 -0.23 -1.61 -0.31 0.00 0.00 175.10 172.96 2nr2 s GLU 18 N -4.02 1.67 0.00 4.82 0.41 -1.26 0.21 118.70 120.52 2nr2 s GLU 18 Ca 0.36 -1.21 0.14 0.00 -0.41 0.00 0.00 54.97 53.85 2nr2 s GLU 18 Cb 0.05 -2.01 0.67 0.00 -1.78 0.00 0.00 34.13 31.06 2nr2 s GLU 18 CO 0.13 0.48 1.36 -0.35 -0.49 0.00 0.00 175.26 176.40 2nr2 n PRO 19 N 1.14 0.17 0.00 0.39 -0.04 -1.26 -1.51 135.00 133.89 2nr2 n PRO 19 Ca -0.17 0.17 0.15 0.00 -0.04 0.00 0.00 63.50 63.61 2nr2 n PRO 19 Cb 0.53 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.22 2nr2 n PRO 19 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2nr2 n SER 20 N -1.31 0.05 -4.77 3.54 3.41 -1.26 -0.95 113.62 112.34 2nr2 n SER 20 Ca 0.06 -0.17 -0.39 0.00 -0.26 0.00 0.00 58.87 58.11 2nr2 n SER 20 Cb 0.11 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 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 -2.58 6.59 0.63 4.04 1.01 -0.57 -4.85 116.67 120.95 2nr2 s ASP 21 Ca 0.28 2.40 -0.14 0.00 0.71 0.00 0.00 52.55 55.81 2nr2 s ASP 21 Cb 0.20 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.49 2nr2 s ASP 21 CO 0.47 -0.63 1.05 0.42 0.21 0.00 0.00 175.17 176.69 2nr2 s THR 22 N -1.35 3.97 0.29 -1.27 -4.23 -1.26 -1.80 115.64 109.99 2nr2 s THR 22 Ca 0.55 0.80 0.11 0.00 -1.18 0.00 0.00 61.69 61.97 2nr2 s THR 22 Cb -0.32 -3.42 -0.01 0.00 1.34 0.00 0.00 72.50 70.09 2nr2 s THR 22 CO 0.41 -0.68 1.65 0.40 -0.54 0.00 0.00 174.62 175.86 2nr2 h ILE 23 N -0.04 1.41 -0.41 2.99 1.08 -0.90 -2.39 117.51 119.26 2nr2 h ILE 23 Ca -0.45 -1.97 0.06 0.00 -0.39 0.00 0.00 64.86 62.11 2nr2 h ILE 23 Cb 1.21 2.06 -0.09 0.00 -3.07 0.00 0.00 36.82 36.94 2nr2 h ILE 23 CO 0.57 0.56 -0.48 -0.08 -0.69 0.00 0.00 178.15 178.04 2nr2 h GLU 24 N 0.00 -0.34 -0.74 2.37 4.81 -1.27 -2.25 114.58 117.15 2nr2 h GLU 24 Ca -0.01 0.02 0.14 0.00 -0.13 0.00 0.00 59.36 59.39 2nr2 h GLU 24 Cb 1.02 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 2nr2 h GLU 24 CO 0.07 -0.23 0.50 -0.97 -0.73 0.00 0.00 179.01 177.65 2nr2 h ASN 25 N -0.36 0.39 0.06 1.04 -1.24 -1.74 -1.06 115.58 112.68 2nr2 h ASN 25 Ca 0.12 0.02 -0.15 0.00 0.71 0.00 0.00 56.30 56.99 2nr2 h ASN 25 Cb 0.59 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.58 2nr2 h ASN 25 CO -0.58 0.21 -0.54 0.58 -1.29 0.00 0.00 177.43 175.81 2nr2 h VAL 26 N 0.42 1.33 -0.08 2.57 2.07 -1.16 0.35 116.25 121.75 2nr2 h VAL 26 Ca 0.36 -1.79 -0.17 0.00 0.82 0.00 0.00 66.70 65.93 2nr2 h VAL 26 Cb 0.82 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 2nr2 h VAL 26 CO -0.12 0.55 -0.68 0.11 0.02 0.00 0.00 177.57 177.45 2nr2 h LYS 27 N 0.40 0.34 -0.17 1.57 1.57 -0.77 -1.65 116.57 117.86 2nr2 h LYS 27 Ca 0.01 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.46 2nr2 h LYS 27 Cb 1.07 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2nr2 h LYS 27 CO 0.10 0.90 -0.21 0.00 -0.57 0.00 0.00 179.45 179.66 2nr2 h ALA 28 N 1.03 1.33 -0.08 3.86 0.00 -0.88 0.80 119.26 125.32 2nr2 h ALA 28 Ca -0.02 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.45 2nr2 h ALA 28 Cb 1.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2nr2 h ALA 28 CO 0.11 0.45 -0.64 -0.22 0.00 0.00 0.00 179.25 178.96 2nr2 h LYS 29 N 0.26 0.30 0.00 0.00 3.64 -0.79 -1.43 116.57 118.56 2nr2 h LYS 29 Ca 0.05 -0.22 -0.13 0.00 -1.27 0.00 0.00 60.65 59.08 2nr2 h LYS 29 Cb 0.53 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2nr2 h LYS 29 CO 0.04 0.84 -0.62 0.82 -2.27 0.00 0.00 179.45 178.26 2nr2 h ILE 30 N 0.22 1.44 0.10 2.00 2.04 -1.03 -0.61 117.51 121.68 2nr2 h ILE 30 Ca -0.01 -2.12 -0.01 0.00 1.00 0.00 0.00 64.86 63.72 2nr2 h ILE 30 Cb 1.17 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 2nr2 h ILE 30 CO 0.10 0.61 -0.05 -0.61 0.00 0.00 0.00 178.15 178.20 2nr2 h GLN 31 N 0.00 -0.14 -0.91 2.37 4.15 -0.48 0.67 115.11 120.77 2nr2 h GLN 31 Ca -0.01 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 2nr2 h GLN 31 Cb 1.10 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.77 2nr2 h GLN 31 CO 0.08 0.08 0.56 0.22 -1.93 0.00 0.00 178.83 177.84 2nr2 h ASP 32 N -0.34 1.09 0.40 -0.69 3.58 -0.93 -1.17 116.42 118.36 2nr2 h ASP 32 Ca -0.01 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.36 2nr2 h ASP 32 Cb 0.28 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2nr2 h ASP 32 CO 0.02 0.83 -0.19 0.50 -2.88 0.00 0.00 179.24 177.52 2nr2 h LYS 33 N 1.25 -0.52 0.00 0.28 1.63 -0.97 -3.39 116.57 114.86 2nr2 h LYS 33 Ca 0.33 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.16 2nr2 h LYS 33 Cb -0.06 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2nr2 h LYS 33 CO -0.06 -0.21 -0.84 0.39 -3.45 0.00 0.00 179.45 175.28 2nr2 n GLU 34 N -5.18 2.40 -1.18 1.90 -0.58 0.21 -5.05 120.64 113.16 2nr2 n GLU 34 Ca -0.10 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 2nr2 n GLU 34 Cb 0.28 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 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 1.66 0.49 2.72 0.62 0.00 -0.44 -5.01 105.19 105.23 2nr2 n GLY 35 Ca -0.00 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.79 -0.17 0.74 -0.61 1.01 -1.25 -4.99 121.20 113.13 2nr2 s ILE 36 Ca 0.00 0.24 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 2nr2 s ILE 36 Cb 0.00 -0.33 0.03 0.00 0.01 0.00 0.00 42.46 42.17 2nr2 s ILE 36 CO 0.00 0.04 1.08 -2.65 0.00 0.00 0.00 174.94 173.42 2nr2 n PRO 37 N 5.31 0.49 0.17 2.79 -0.02 -1.26 -3.48 135.00 138.99 2nr2 n PRO 37 Ca -0.05 0.23 0.03 0.00 -2.02 0.00 0.00 63.50 61.70 2nr2 n PRO 37 Cb 0.50 -2.33 0.29 0.00 -0.02 0.00 0.00 33.50 31.93 2nr2 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2nr2 h PRO 38 N -0.36 0.00 -0.15 0.52 0.11 -1.96 -3.07 132.00 127.09 2nr2 h PRO 38 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2nr2 h PRO 38 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2nr2 h PRO 38 CO 0.47 0.45 0.03 0.22 -0.21 0.00 0.00 178.00 178.97 2nr2 h ASP 39 N 0.00 0.18 0.38 -2.05 3.58 -1.97 -2.66 116.42 113.89 2nr2 h ASP 39 Ca -0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2nr2 h ASP 39 Cb 0.94 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2nr2 h ASP 39 CO 0.06 0.20 -0.65 1.67 -2.88 0.00 0.00 179.24 177.64 2nr2 n GLN 40 N -4.44 0.02 -3.39 0.28 7.27 -1.16 -4.86 117.38 111.10 2nr2 n GLN 40 Ca -0.01 0.00 -0.38 0.00 0.07 0.00 0.00 57.00 56.69 2nr2 n GLN 40 Cb 0.14 -1.51 -0.06 0.00 2.41 0.00 0.00 30.24 31.22 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 -3.01 4.23 -0.22 3.69 -0.21 -1.00 -2.42 119.66 120.71 2nr2 s GLN 41 Ca 0.10 0.39 -0.08 0.00 0.02 0.00 0.00 55.36 55.78 2nr2 s GLN 41 Cb 0.17 -3.38 -0.04 0.00 1.00 0.00 0.00 33.01 30.76 2nr2 s GLN 41 CO 0.75 0.30 0.09 0.50 -2.12 0.00 0.00 175.29 174.81 2nr2 s ARG 42 N 0.18 3.90 -0.23 2.91 3.52 0.17 -5.00 118.95 124.40 2nr2 s ARG 42 Ca 0.24 -0.37 -0.03 0.00 -0.13 0.00 0.00 55.73 55.44 2nr2 s ARG 42 Cb -0.15 -3.33 0.01 0.00 -1.56 0.00 0.00 34.95 29.91 2nr2 s ARG 42 CO 0.10 0.07 -0.06 -0.51 -0.81 0.00 0.00 175.30 174.09 2nr2 s LEU 43 N 0.94 2.90 -0.18 -0.88 1.43 -1.26 -0.68 118.68 120.95 2nr2 s LEU 43 Ca 0.05 -0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 52.54 2nr2 s LEU 43 Cb -0.14 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 2nr2 s LEU 43 CO 0.03 -0.05 -0.05 -0.63 0.23 0.00 0.00 176.35 175.88 2nr2 s ILE 44 N 1.41 3.57 -0.07 -0.59 1.01 -0.96 -1.01 121.20 124.57 2nr2 s ILE 44 Ca 0.04 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.27 2nr2 s ILE 44 Cb -0.15 -2.59 0.01 0.00 0.01 0.00 0.00 42.46 39.74 2nr2 s ILE 44 CO -0.05 0.46 -0.17 0.12 0.00 0.00 0.00 174.94 175.30 2nr2 s PHE 45 N 0.89 1.88 0.00 3.97 5.36 -0.43 -0.78 117.98 128.87 2nr2 s PHE 45 Ca -0.01 -0.71 0.00 0.00 -0.96 0.00 0.00 56.93 55.25 2nr2 s PHE 45 Cb -0.15 -1.31 0.00 0.00 -0.34 0.00 0.00 43.02 41.23 2nr2 s PHE 45 CO 0.01 -0.31 0.00 0.00 -1.46 0.00 0.00 175.22 173.46 2nr2 n ALA 46 N 3.61 0.00 -1.93 11.12 0.00 -1.26 -2.27 120.51 129.78 2nr2 n ALA 46 Ca -0.21 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.22 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 -0.46 2.71 0.00 0.00 -1.26 -5.09 105.19 101.09 2nr2 n GLY 47 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 0.01 0.03 0.38 1.61 2.47 -0.96 -5.14 119.74 118.14 2nr2 s LYS 48 Ca 0.00 0.30 -0.26 0.00 -1.56 0.00 0.00 55.97 54.45 2nr2 s LYS 48 Cb 0.02 -0.52 -0.09 0.00 -1.46 0.00 0.00 37.83 35.78 2nr2 s LYS 48 CO -0.01 -0.29 1.17 -0.65 0.16 0.00 0.00 175.35 175.74 2nr2 s GLN 49 N 1.89 4.18 -0.12 4.03 -0.21 -1.26 -1.32 119.66 126.85 2nr2 s GLN 49 Ca 0.02 1.86 -0.07 0.00 0.02 0.00 0.00 55.36 57.19 2nr2 s GLN 49 Cb -0.12 -2.78 -0.04 0.00 1.00 0.00 0.00 33.01 31.06 2nr2 s GLN 49 CO -0.03 -0.22 0.14 -0.51 -2.12 0.00 0.00 175.29 172.55 2nr2 s LEU 50 N -2.28 4.39 0.59 2.90 1.43 -0.18 -4.93 118.68 120.60 2nr2 s LEU 50 Ca 0.54 0.47 -0.09 0.00 -1.03 0.00 0.00 54.13 54.03 2nr2 s LEU 50 Cb -0.31 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.81 2nr2 s LEU 50 CO 0.40 0.41 0.95 -1.61 0.23 0.00 0.00 176.35 176.73 2nr2 s GLU 51 N -1.03 3.33 -0.05 1.70 2.02 -1.26 -4.74 118.70 118.67 2nr2 s GLU 51 Ca 0.15 0.42 -0.17 0.00 0.02 0.00 0.00 54.97 55.39 2nr2 s GLU 51 Cb -0.12 -2.18 -0.11 0.00 0.10 0.00 0.00 34.13 31.81 2nr2 s GLU 51 CO 0.04 -0.58 0.67 -0.44 0.02 0.00 0.00 175.26 174.98 2nr2 h ASP 52 N -0.21 -0.27 -1.06 -0.19 3.32 -1.99 -3.34 116.42 112.69 2nr2 h ASP 52 Ca -0.45 -0.18 -0.60 0.00 0.02 0.00 0.00 57.03 55.82 2nr2 h ASP 52 Cb 1.22 0.07 -0.15 0.00 0.22 0.00 0.00 39.33 40.69 2nr2 h ASP 52 CO 0.62 0.24 1.28 0.61 -1.72 0.00 0.00 179.24 180.27 2nr2 n GLY 53 N 0.68 4.68 3.55 2.75 0.00 -1.26 -0.94 105.19 114.66 2nr2 n GLY 53 Ca -0.07 -1.93 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.35 1.84 0.55 1.61 1.81 -1.25 -5.03 118.95 117.13 2nr2 s ARG 54 Ca 0.57 -2.02 0.05 0.00 -1.72 0.00 0.00 55.73 52.61 2nr2 s ARG 54 Cb 0.29 -1.40 0.05 0.00 -0.45 0.00 0.00 34.95 33.44 2nr2 s ARG 54 CO -0.16 -0.06 0.43 0.25 -0.68 0.00 0.00 175.30 175.08 2nr2 n THR 55 N -0.85 0.00 0.07 0.02 -2.24 -1.26 -1.00 114.28 109.01 2nr2 n THR 55 Ca -0.04 -2.17 -0.07 0.00 -2.27 0.00 0.00 64.05 59.50 2nr2 n THR 55 Cb 0.66 -0.05 0.08 0.00 -2.10 0.00 0.00 70.33 68.92 2nr2 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 56 N 0.00 0.36 -0.24 3.22 3.38 -1.31 -3.22 115.31 117.50 2nr2 h LEU 56 Ca -0.34 -0.22 -0.21 0.00 0.09 0.00 0.00 57.88 57.19 2nr2 h LEU 56 Cb 1.27 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.92 2nr2 h LEU 56 CO 0.54 0.91 -0.80 -1.28 0.09 0.00 0.00 178.44 177.90 2nr2 h SER 57 N 0.22 0.74 -0.57 -0.43 0.87 -1.31 0.15 113.55 113.21 2nr2 h SER 57 Ca -0.01 -0.50 -0.06 0.00 -1.23 0.00 0.00 61.79 59.99 2nr2 h SER 57 Cb 1.19 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.91 2nr2 h SER 57 CO 0.11 1.28 0.15 0.44 -0.53 0.00 0.00 176.83 178.28 2nr2 h ASP 58 N 0.40 0.89 0.22 6.23 3.32 -1.83 -0.70 116.42 124.96 2nr2 h ASP 58 Ca -0.05 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2nr2 h ASP 58 Cb 1.41 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2nr2 h ASP 58 CO 0.15 0.87 -0.06 -1.22 -1.72 0.00 0.00 179.24 177.26 2nr2 n TYR 59 N -4.26 0.00 -3.63 4.55 4.01 -1.14 -4.97 117.16 111.72 2nr2 n TYR 59 Ca 0.05 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.56 2nr2 n TYR 59 Cb 0.24 -0.11 0.06 0.00 -0.31 0.00 0.00 39.34 39.21 2nr2 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2nr2 n ASN 60 N -0.81 -3.09 -4.52 7.72 4.05 -0.27 -4.97 115.26 113.38 2nr2 n ASN 60 Ca 0.18 -0.70 -0.43 0.00 0.45 0.00 0.00 54.58 54.08 2nr2 n ASN 60 Cb 0.24 -4.55 -0.05 0.00 1.23 0.00 0.00 39.78 36.65 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2nr2 s ILE 61 N -3.44 4.55 0.60 -1.44 1.01 0.38 -4.99 121.20 117.87 2nr2 s ILE 61 Ca 0.23 0.23 -0.10 0.00 0.00 0.00 0.00 60.65 61.01 2nr2 s ILE 61 Cb -0.11 -4.43 0.14 0.00 0.01 0.00 0.00 42.46 38.07 2nr2 s ILE 61 CO 0.77 -0.93 0.79 0.00 0.00 0.00 0.00 174.94 175.58 2nr2 n GLN 62 N 7.01 -0.88 -2.43 2.79 6.02 -1.26 -4.70 117.38 123.93 2nr2 n GLN 62 Ca 0.01 -1.22 -0.35 0.00 -0.01 0.00 0.00 57.00 55.43 2nr2 n GLN 62 Cb 0.47 -0.83 -0.02 0.00 1.02 0.00 0.00 30.24 30.88 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 -4.73 3.71 -0.79 -1.09 -2.85 -1.26 -3.80 119.74 108.94 2nr2 s LYS 63 Ca 0.45 1.50 0.00 0.00 -1.00 0.00 0.00 55.97 56.92 2nr2 s LYS 63 Cb -0.01 -2.16 0.00 0.00 -2.06 0.00 0.00 37.83 33.60 2nr2 s LYS 63 CO 0.32 -0.53 0.00 0.39 0.10 0.00 0.00 175.35 175.63 2nr2 n GLU 64 N -0.90 -0.66 -2.87 1.78 1.02 0.76 -5.00 120.64 114.77 2nr2 n GLU 64 Ca 0.09 0.71 -0.32 0.00 -0.02 0.00 0.00 57.16 57.62 2nr2 n GLU 64 Cb 0.51 -4.55 -0.05 0.00 -0.02 0.00 0.00 31.44 27.33 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 -2.75 6.75 -0.34 1.62 0.01 -1.25 -4.76 113.70 112.98 2nr2 s SER 65 Ca 0.00 1.41 -0.07 0.00 1.31 0.00 0.00 55.95 58.60 2nr2 s SER 65 Cb 0.00 -2.43 0.04 0.00 0.21 0.00 0.00 66.02 63.84 2nr2 s SER 65 CO 0.00 -0.35 0.11 -0.89 0.41 0.00 0.00 173.24 172.53 2nr2 s THR 66 N -2.22 3.89 0.24 1.44 2.01 -1.26 -1.02 115.64 118.71 2nr2 s THR 66 Ca 0.57 -1.07 -0.15 0.00 0.31 0.00 0.00 61.69 61.35 2nr2 s THR 66 Cb -0.10 -3.18 -0.08 0.00 0.01 0.00 0.00 72.50 69.15 2nr2 s THR 66 CO 0.21 -0.17 0.65 -0.76 -0.69 0.00 0.00 174.62 173.86 2nr2 s LEU 67 N 1.43 4.21 -0.32 4.42 1.43 -0.30 -4.67 118.68 124.88 2nr2 s LEU 67 Ca -0.01 1.18 -0.07 0.00 -1.03 0.00 0.00 54.13 54.20 2nr2 s LEU 67 Cb -0.19 -3.69 0.02 0.00 0.03 0.00 0.00 46.19 42.36 2nr2 s LEU 67 CO 0.03 -0.05 0.10 -1.00 0.23 0.00 0.00 176.35 175.66 2nr2 s HIS 68 N -1.72 3.19 -0.41 0.29 3.76 0.04 -0.82 115.29 119.62 2nr2 s HIS 68 Ca 0.46 -1.12 -0.23 0.00 -0.15 0.00 0.00 55.06 54.02 2nr2 s HIS 68 Cb -0.13 -2.28 0.02 0.00 1.11 0.00 0.00 32.58 31.30 2nr2 s HIS 68 CO 0.19 -0.63 0.80 -1.17 -0.85 0.00 0.00 174.74 173.08 2nr2 s LEU 69 N 1.47 4.17 -0.22 0.89 2.96 -0.78 -2.26 118.68 124.92 2nr2 s LEU 69 Ca 0.01 0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 54.00 2nr2 s LEU 69 Cb -0.18 -3.01 -0.01 0.00 0.50 0.00 0.00 46.19 43.49 2nr2 s LEU 69 CO 0.03 -0.85 -0.03 -0.69 -1.32 0.00 0.00 176.35 173.50 2nr2 s VAL 70 N 3.25 3.50 -0.05 1.68 1.01 0.15 -4.17 120.40 125.77 2nr2 s VAL 70 Ca 0.31 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2nr2 s VAL 70 Cb -0.12 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 2nr2 s VAL 70 CO 0.20 0.41 -0.06 -0.76 0.00 0.00 0.00 175.10 174.90 2nr2 s LEU 71 N 1.47 3.24 -0.12 3.92 1.43 -1.26 0.41 118.68 127.77 2nr2 s LEU 71 Ca 0.06 -0.03 -0.18 0.00 -1.03 0.00 0.00 54.13 52.94 2nr2 s LEU 71 Cb -0.14 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2nr2 s LEU 71 CO -0.02 0.34 0.49 -0.60 0.23 0.00 0.00 176.35 176.79 2nr2 s ARG 72 N -0.99 4.35 0.42 1.70 3.52 -1.02 -5.00 118.95 121.93 2nr2 s ARG 72 Ca 0.14 0.47 -0.14 0.00 -0.13 0.00 0.00 55.73 56.08 2nr2 s ARG 72 Cb -0.11 -3.44 -0.08 0.00 -1.56 0.00 0.00 34.95 29.77 2nr2 s ARG 72 CO 0.03 0.15 0.84 -0.51 -0.81 0.00 0.00 175.30 175.00 2nr2 s LEU 73 N 0.63 3.82 0.37 -0.88 1.43 -1.26 -4.97 118.68 117.83 2nr2 s LEU 73 Ca 0.27 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 2nr2 s LEU 73 Cb -0.15 -4.20 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 2nr2 s LEU 73 CO 0.11 -0.41 0.58 0.00 0.23 0.00 0.00 176.35 176.86 2nr2 s ARG 74 N -3.71 3.42 0.00 1.70 1.70 -1.26 -4.22 118.95 116.57 2nr2 s ARG 74 Ca 0.55 -0.34 0.00 0.00 -0.47 0.00 0.00 55.73 55.47 2nr2 s ARG 74 Cb -0.10 -2.63 0.00 0.00 -0.57 0.00 0.00 34.95 31.65 2nr2 s ARG 74 CO 0.28 0.06 0.00 0.41 -1.08 0.00 0.00 175.30 174.96 2nr2 n GLY 75 N -1.86 1.00 0.00 3.88 0.00 -1.26 -5.35 105.19 101.60 2nr2 n GLY 75 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93