#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 4.01 0.20 3.17 0.74 -1.26 -1.01 119.66 125.51 2nr2 s GLN 2 Ca 0.00 -0.18 0.11 0.00 0.05 0.00 0.00 55.36 55.34 2nr2 s GLN 2 Cb 0.00 -3.62 -0.04 0.00 1.10 0.00 0.00 33.01 30.44 2nr2 s GLN 2 CO 0.00 -0.13 -0.22 0.96 -0.55 0.00 0.00 175.29 175.34 2nr2 s ILE 3 N 1.63 2.45 -0.16 -2.34 -4.36 0.02 -0.74 121.20 117.70 2nr2 s ILE 3 Ca 0.10 -2.05 -0.01 0.00 -0.26 0.00 0.00 60.65 58.43 2nr2 s ILE 3 Cb -0.15 -2.20 -0.01 0.00 1.25 0.00 0.00 42.46 41.35 2nr2 s ILE 3 CO 0.09 -0.16 -0.11 -0.36 0.24 0.00 0.00 174.94 174.65 2nr2 s PHE 4 N -1.79 2.86 -0.32 1.37 0.08 0.35 -1.65 117.98 118.88 2nr2 s PHE 4 Ca 0.22 -0.81 -0.10 0.00 0.12 0.00 0.00 56.93 56.37 2nr2 s PHE 4 Cb -0.08 -1.93 0.00 0.00 -0.57 0.00 0.00 43.02 40.44 2nr2 s PHE 4 CO 0.11 -0.36 0.16 0.08 -0.10 0.00 0.00 175.22 175.10 2nr2 s VAL 5 N 0.78 4.51 -0.25 -0.44 1.01 0.15 -0.85 120.40 125.31 2nr2 s VAL 5 Ca -0.04 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.29 2nr2 s VAL 5 Cb -0.15 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2nr2 s VAL 5 CO 0.01 -0.00 0.11 -0.75 0.00 0.00 0.00 175.10 174.47 2nr2 s LYS 6 N 1.58 3.80 0.80 2.72 2.47 -0.60 -0.08 119.74 130.44 2nr2 s LYS 6 Ca 0.04 -0.40 -0.08 0.00 -1.56 0.00 0.00 55.97 53.97 2nr2 s LYS 6 Cb -0.18 -3.42 0.17 0.00 -1.46 0.00 0.00 37.83 32.95 2nr2 s LYS 6 CO 0.06 -0.12 1.10 0.25 0.16 0.00 0.00 175.35 176.80 2nr2 n THR 7 N 4.76 0.00 0.05 3.43 -2.24 -1.05 -0.59 114.28 118.63 2nr2 n THR 7 Ca -0.15 -1.22 -0.06 0.00 -2.27 0.00 0.00 64.05 60.34 2nr2 n THR 7 Cb 0.52 -1.21 -0.11 0.00 -2.10 0.00 0.00 70.33 67.43 2nr2 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 8 N 0.00 0.00 -0.62 3.22 3.38 -1.93 -3.24 115.31 116.12 2nr2 h LEU 8 Ca -0.36 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.55 2nr2 h LEU 8 Cb 1.14 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 2nr2 h LEU 8 CO 0.31 0.92 0.14 0.71 0.09 0.00 0.00 178.44 180.62 2nr2 h THR 9 N 0.00 1.25 0.00 0.22 1.35 -1.96 -3.47 112.91 110.31 2nr2 h THR 9 Ca -0.09 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2nr2 h THR 9 Cb 1.78 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2nr2 h THR 9 CO 0.11 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 2nr2 n GLY 10 N -0.63 -0.22 3.67 5.82 0.00 -1.22 -5.11 105.19 107.49 2nr2 n GLY 10 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 4.29 -1.07 1.61 2.20 -1.26 -4.76 119.74 120.75 2nr2 s LYS 11 Ca 0.00 1.63 -0.22 0.00 -0.36 0.00 0.00 55.97 57.02 2nr2 s LYS 11 Cb 0.00 -3.66 0.05 0.00 -1.51 0.00 0.00 37.83 32.71 2nr2 s LYS 11 CO 0.00 -0.58 1.50 0.99 -0.36 0.00 0.00 175.35 176.89 2nr2 s THR 12 N 2.91 3.97 -0.02 3.43 2.01 -1.26 -2.54 115.64 124.14 2nr2 s THR 12 Ca 0.54 -0.98 -0.27 0.00 0.31 0.00 0.00 61.69 61.29 2nr2 s THR 12 Cb -0.22 -5.08 -0.03 0.00 0.01 0.00 0.00 72.50 67.17 2nr2 s THR 12 CO 0.17 -1.95 0.86 -0.63 -0.69 0.00 0.00 174.62 172.38 2nr2 s ILE 13 N 4.81 4.92 -0.30 1.82 1.01 0.88 -4.88 121.20 129.47 2nr2 s ILE 13 Ca 0.47 1.81 -0.11 0.00 0.00 0.00 0.00 60.65 62.82 2nr2 s ILE 13 Cb 0.01 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 2nr2 s ILE 13 CO -0.07 0.21 0.18 -0.89 0.00 0.00 0.00 174.94 174.37 2nr2 s THR 14 N 0.85 4.99 0.09 2.92 2.01 -1.26 -0.68 115.64 124.56 2nr2 s THR 14 Ca 0.46 -0.14 0.05 0.00 0.31 0.00 0.00 61.69 62.36 2nr2 s THR 14 Cb -0.20 -3.47 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 2nr2 s THR 14 CO 0.24 0.14 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.42 2nr2 s LEU 15 N 1.69 2.34 -0.42 4.42 1.43 -0.66 -5.01 118.68 122.48 2nr2 s LEU 15 Ca 0.06 -0.71 -0.09 0.00 -1.03 0.00 0.00 54.13 52.36 2nr2 s LEU 15 Cb -0.17 -0.45 0.08 0.00 0.03 0.00 0.00 46.19 45.68 2nr2 s LEU 15 CO 0.09 -0.14 0.25 -1.61 0.23 0.00 0.00 176.35 175.17 2nr2 s GLU 16 N -2.21 2.61 0.47 1.70 2.02 -1.26 -0.80 118.70 121.23 2nr2 s GLU 16 Ca 0.02 -1.44 0.04 0.00 0.02 0.00 0.00 54.97 53.61 2nr2 s GLU 16 Cb -0.07 -3.77 -0.04 0.00 0.10 0.00 0.00 34.13 30.35 2nr2 s GLU 16 CO 0.02 -0.94 0.07 0.14 0.02 0.00 0.00 175.26 174.57 2nr2 s VAL 17 N 1.43 1.65 0.28 2.63 -7.23 -0.18 -4.87 120.40 114.11 2nr2 s VAL 17 Ca 0.03 -1.90 0.06 0.00 -1.81 0.00 0.00 61.98 58.35 2nr2 s VAL 17 Cb -0.23 -2.55 -0.06 0.00 0.56 0.00 0.00 36.38 34.10 2nr2 s VAL 17 CO 0.02 0.00 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.17 2nr2 s GLU 18 N -3.87 1.55 0.42 4.82 0.41 -1.26 -0.20 118.70 120.56 2nr2 s GLU 18 Ca 0.23 -1.80 0.23 0.00 -0.41 0.00 0.00 54.97 53.22 2nr2 s GLU 18 Cb 0.04 -1.07 0.61 0.00 -1.78 0.00 0.00 34.13 31.93 2nr2 s GLU 18 CO 0.12 -0.01 1.69 -1.00 -0.49 0.00 0.00 175.26 175.58 2nr2 h PRO 19 N 2.27 0.00 -0.58 0.39 0.13 -1.96 -2.36 132.00 129.89 2nr2 h PRO 19 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2nr2 h PRO 19 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2nr2 h PRO 19 CO 0.68 0.20 0.00 0.43 -0.23 0.00 0.00 178.00 179.08 2nr2 n SER 20 N -3.23 1.75 -4.95 1.44 7.64 -1.26 -1.50 113.62 113.52 2nr2 n SER 20 Ca 0.02 -2.14 -0.23 0.00 1.01 0.00 0.00 58.87 57.53 2nr2 n SER 20 Cb 0.52 -0.36 0.03 0.00 -1.01 0.00 0.00 64.21 63.38 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 -0.57 5.46 0.49 6.43 1.01 -0.89 -4.93 116.67 123.68 2nr2 s ASP 21 Ca 0.14 0.24 0.08 0.00 0.71 0.00 0.00 52.55 53.73 2nr2 s ASP 21 Cb 0.09 -1.24 0.03 0.00 1.01 0.00 0.00 42.92 42.82 2nr2 s ASP 21 CO 0.07 -1.03 0.55 0.42 0.21 0.00 0.00 175.17 175.39 2nr2 s THR 22 N -2.78 2.34 0.20 -1.27 -4.23 -1.26 -1.08 115.64 107.57 2nr2 s THR 22 Ca 0.54 -1.20 0.05 0.00 -1.18 0.00 0.00 61.69 59.90 2nr2 s THR 22 Cb -0.10 -2.54 -0.10 0.00 1.34 0.00 0.00 72.50 71.09 2nr2 s THR 22 CO 0.40 0.00 1.46 0.40 -0.54 0.00 0.00 174.62 176.34 2nr2 h ILE 23 N 0.62 1.49 -0.96 2.99 1.08 -1.33 -2.29 117.51 119.11 2nr2 h ILE 23 Ca -0.36 -2.46 0.06 0.00 -0.39 0.00 0.00 64.86 61.70 2nr2 h ILE 23 Cb 1.28 2.34 -0.06 0.00 -3.07 0.00 0.00 36.82 37.31 2nr2 h ILE 23 CO 0.50 0.71 0.62 -0.08 -0.69 0.00 0.00 178.15 179.21 2nr2 h GLU 24 N 0.08 1.12 -0.08 2.37 4.81 -1.46 0.63 114.58 122.05 2nr2 h GLU 24 Ca -0.02 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2nr2 h GLU 24 Cb 1.35 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 2nr2 h GLU 24 CO 0.11 0.74 0.01 -0.91 -0.73 0.00 0.00 179.01 178.23 2nr2 h ASN 25 N 1.15 0.13 -0.88 1.04 -0.26 -1.78 -1.03 115.58 113.95 2nr2 h ASN 25 Ca 0.41 -0.26 0.12 0.00 -0.56 0.00 0.00 56.30 56.00 2nr2 h ASN 25 Cb 0.11 -0.04 -0.08 0.00 -1.06 0.00 0.00 38.32 37.26 2nr2 h ASN 25 CO -0.16 0.36 0.51 0.58 -1.06 0.00 0.00 177.43 177.67 2nr2 h VAL 26 N -0.10 0.86 -0.36 2.81 2.07 -0.82 0.70 116.25 121.41 2nr2 h VAL 26 Ca 0.03 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2nr2 h VAL 26 Cb 0.29 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 2nr2 h VAL 26 CO 0.00 0.15 0.21 0.11 0.02 0.00 0.00 177.57 178.06 2nr2 h LYS 27 N 0.80 0.42 -0.91 1.57 1.57 0.45 -0.54 116.57 119.94 2nr2 h LYS 27 Ca 0.45 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.23 2nr2 h LYS 27 Cb 0.49 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 2nr2 h LYS 27 CO -0.28 0.28 0.60 0.00 -0.57 0.00 0.00 179.45 179.47 2nr2 h ALA 28 N 1.15 1.41 -0.57 3.86 0.00 -0.80 0.82 119.26 125.13 2nr2 h ALA 28 Ca 0.14 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2nr2 h ALA 28 Cb -0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 2nr2 h ALA 28 CO -0.06 0.51 0.23 0.87 0.00 0.00 0.00 179.25 180.80 2nr2 h LYS 29 N 1.16 0.85 -0.10 0.00 1.57 -0.68 -1.46 116.57 117.91 2nr2 h LYS 29 Ca 0.36 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.87 2nr2 h LYS 29 Cb -0.02 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 2nr2 h LYS 29 CO -0.10 0.73 -0.43 0.82 -0.57 0.00 0.00 179.45 179.91 2nr2 h ILE 30 N 0.78 1.32 -0.08 1.86 2.04 0.11 0.31 117.51 123.85 2nr2 h ILE 30 Ca 0.19 -1.55 -0.03 0.00 1.00 0.00 0.00 64.86 64.46 2nr2 h ILE 30 Cb 0.20 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2nr2 h ILE 30 CO -0.02 0.46 -0.08 -0.61 0.00 0.00 0.00 178.15 177.90 2nr2 h GLN 31 N 0.19 0.20 -0.55 2.37 4.15 -0.75 0.14 115.11 120.85 2nr2 h GLN 31 Ca 0.02 -0.11 0.06 0.00 0.77 0.00 0.00 58.65 59.39 2nr2 h GLN 31 Cb 0.83 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.44 2nr2 h GLN 31 CO 0.07 0.64 -0.55 0.22 -1.93 0.00 0.00 178.83 177.27 2nr2 h ASP 32 N -0.23 -1.88 0.21 -0.69 1.82 -1.19 -2.12 116.42 112.34 2nr2 h ASP 32 Ca 0.01 0.26 -0.01 0.00 -0.39 0.00 0.00 57.03 56.90 2nr2 h ASP 32 Cb 0.60 0.79 0.00 0.00 0.68 0.00 0.00 39.33 41.41 2nr2 h ASP 32 CO 0.02 -0.36 -0.10 0.50 -1.61 0.00 0.00 179.24 177.69 2nr2 h LYS 33 N -0.29 -0.27 0.00 0.28 1.63 -0.88 -3.43 116.57 113.60 2nr2 h LYS 33 Ca 0.11 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 2nr2 h LYS 33 Cb 0.56 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 2nr2 h LYS 33 CO -0.68 0.08 0.00 0.39 -3.45 0.00 0.00 179.45 175.79 2nr2 n GLU 34 N -5.04 0.00 0.00 1.90 -0.58 0.48 -5.07 120.64 112.33 2nr2 n GLU 34 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 2nr2 n GLU 34 Cb 0.25 -0.22 0.00 0.00 -0.57 0.00 0.00 31.44 30.89 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 2.18 0.00 3.71 0.62 0.00 -0.80 -5.00 105.19 105.91 2nr2 n GLY 35 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 5.34 0.32 -0.61 1.01 -1.26 -4.95 121.20 121.05 2nr2 s ILE 36 Ca 0.00 0.39 -0.29 0.00 0.00 0.00 0.00 60.65 60.75 2nr2 s ILE 36 Cb 0.00 -3.57 -0.11 0.00 0.01 0.00 0.00 42.46 38.79 2nr2 s ILE 36 CO 0.00 0.38 1.46 -2.84 0.00 0.00 0.00 174.94 173.94 2nr2 s PRO 37 N 0.63 4.20 0.52 2.79 0.02 -1.26 -4.06 135.00 137.84 2nr2 s PRO 37 Ca 0.13 2.43 0.35 0.00 0.02 0.00 0.00 61.00 63.93 2nr2 s PRO 37 Cb -0.13 -3.03 1.88 0.00 0.02 0.00 0.00 34.50 33.24 2nr2 s PRO 37 CO 0.03 -0.45 2.06 -1.35 -0.33 0.00 0.00 177.00 176.96 2nr2 h PRO 38 N 3.92 0.00 0.00 5.54 0.11 -1.93 0.93 132.00 140.57 2nr2 h PRO 38 Ca -0.49 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 2nr2 h PRO 38 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2nr2 h PRO 38 CO 0.71 0.00 -0.65 -0.44 -0.21 0.00 0.00 178.00 177.41 2nr2 h ASP 39 N 0.00 0.00 1.26 -2.05 3.32 -2.00 -3.25 116.42 113.70 2nr2 h ASP 39 Ca 0.00 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.91 2nr2 h ASP 39 Cb 0.01 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2nr2 h ASP 39 CO 0.00 0.65 -0.76 -0.61 -1.72 0.00 0.00 179.24 176.79 2nr2 h GLN 40 N 0.00 0.00 -5.78 3.56 4.15 -1.13 -3.45 115.11 112.46 2nr2 h GLN 40 Ca -0.01 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.83 2nr2 h GLN 40 Cb 1.26 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.87 2nr2 h GLN 40 CO 0.08 0.54 0.19 -0.65 -1.93 0.00 0.00 178.83 177.06 2nr2 s GLN 41 N -2.91 4.26 -0.26 1.69 -0.21 -1.10 -0.86 119.66 120.27 2nr2 s GLN 41 Ca 0.02 0.75 -0.03 0.00 0.02 0.00 0.00 55.36 56.12 2nr2 s GLN 41 Cb 0.08 -3.56 0.02 0.00 1.00 0.00 0.00 33.01 30.55 2nr2 s GLN 41 CO 0.77 -0.23 -0.02 1.03 -2.12 0.00 0.00 175.29 174.72 2nr2 s ARG 42 N 1.86 2.94 -0.33 2.91 0.52 0.89 -4.97 118.95 122.78 2nr2 s ARG 42 Ca 0.32 -0.92 -0.16 0.00 -0.52 0.00 0.00 55.73 54.45 2nr2 s ARG 42 Cb -0.16 -3.09 -0.02 0.00 0.52 0.00 0.00 34.95 32.20 2nr2 s ARG 42 CO 0.12 -0.40 0.40 -0.51 0.02 0.00 0.00 175.30 174.93 2nr2 s LEU 43 N 1.38 4.32 -0.25 2.53 2.01 -1.26 0.39 118.68 127.80 2nr2 s LEU 43 Ca 0.01 -0.06 -0.12 0.00 0.01 0.00 0.00 54.13 53.97 2nr2 s LEU 43 Cb -0.17 -2.42 -0.05 0.00 0.01 0.00 0.00 46.19 43.57 2nr2 s LEU 43 CO -0.02 -0.34 0.25 -0.63 1.01 0.00 0.00 176.35 176.62 2nr2 s ILE 44 N 2.12 5.29 0.01 -0.59 -1.09 0.24 -0.78 121.20 126.39 2nr2 s ILE 44 Ca 0.14 0.34 0.01 0.00 -2.23 0.00 0.00 60.65 58.91 2nr2 s ILE 44 Cb -0.16 -3.58 -0.01 0.00 -1.58 0.00 0.00 42.46 37.13 2nr2 s ILE 44 CO 0.12 0.27 -0.03 0.12 -1.23 0.00 0.00 174.94 174.19 2nr2 s PHE 45 N 1.47 0.26 -1.86 3.97 5.36 -0.06 -1.00 117.98 126.12 2nr2 s PHE 45 Ca 0.11 -0.15 0.00 0.00 -0.96 0.00 0.00 56.93 55.93 2nr2 s PHE 45 Cb -0.15 -0.17 0.00 0.00 -0.34 0.00 0.00 43.02 42.36 2nr2 s PHE 45 CO 0.08 -0.04 0.00 0.00 -1.46 0.00 0.00 175.22 173.80 2nr2 n ALA 46 N 2.68 -0.34 0.00 11.12 0.00 -1.26 -1.89 120.51 130.81 2nr2 n ALA 46 Ca -0.15 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2nr2 n ALA 46 Cb 0.58 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 -0.79 2.72 3.97 0.00 0.00 -1.26 -5.03 105.19 104.79 2nr2 n GLY 47 Ca -0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.20 3.34 -0.01 1.61 -2.85 -0.79 -5.09 119.74 115.74 2nr2 s LYS 48 Ca 0.00 -0.84 -0.12 0.00 -1.00 0.00 0.00 55.97 54.01 2nr2 s LYS 48 Cb 0.00 -2.86 -0.05 0.00 -2.06 0.00 0.00 37.83 32.86 2nr2 s LYS 48 CO 0.00 0.33 0.35 -1.14 0.10 0.00 0.00 175.35 174.99 2nr2 s GLN 49 N -4.03 3.79 0.13 1.78 0.74 -1.26 -0.88 119.66 119.94 2nr2 s GLN 49 Ca 0.37 0.25 -0.30 0.00 0.05 0.00 0.00 55.36 55.73 2nr2 s GLN 49 Cb -0.09 -3.18 -0.06 0.00 1.10 0.00 0.00 33.01 30.78 2nr2 s GLN 49 CO 0.29 0.69 0.96 -0.51 -0.55 0.00 0.00 175.29 176.17 2nr2 s LEU 50 N -1.20 4.53 0.15 3.68 1.43 0.04 -4.92 118.68 122.39 2nr2 s LEU 50 Ca 0.23 1.82 -0.16 0.00 -1.03 0.00 0.00 54.13 54.99 2nr2 s LEU 50 Cb -0.15 -3.59 -0.07 0.00 0.03 0.00 0.00 46.19 42.41 2nr2 s LEU 50 CO 0.12 -0.02 0.59 -1.61 0.23 0.00 0.00 176.35 175.66 2nr2 s GLU 51 N -0.22 4.08 0.04 1.70 2.02 -1.26 -4.71 118.70 120.34 2nr2 s GLU 51 Ca 0.46 0.62 -0.15 0.00 0.02 0.00 0.00 54.97 55.91 2nr2 s GLU 51 Cb -0.24 -2.96 -0.07 0.00 0.10 0.00 0.00 34.13 30.96 2nr2 s GLU 51 CO 0.30 0.48 1.24 -0.44 0.02 0.00 0.00 175.26 176.86 2nr2 h ASP 52 N 3.66 -0.63 0.00 -0.19 3.32 -1.98 -3.05 116.42 117.56 2nr2 h ASP 52 Ca -0.49 0.06 -0.47 0.00 0.02 0.00 0.00 57.03 56.15 2nr2 h ASP 52 Cb 1.20 0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.98 2nr2 h ASP 52 CO 0.65 -0.27 2.79 0.61 -1.72 0.00 0.00 179.24 181.30 2nr2 n GLY 53 N -1.23 3.51 2.94 2.75 0.00 -1.26 -1.30 105.19 110.60 2nr2 n GLY 53 Ca -0.05 -1.12 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 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 2.67 0.20 0.64 1.61 1.81 -1.15 -5.05 118.95 119.69 2nr2 s ARG 54 Ca 0.53 -0.33 -0.11 0.00 -1.72 0.00 0.00 55.73 54.10 2nr2 s ARG 54 Cb 0.15 -0.01 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 2nr2 s ARG 54 CO -0.04 -0.01 1.05 0.95 -0.68 0.00 0.00 175.30 176.57 2nr2 s THR 55 N -0.73 4.41 0.25 0.02 -4.23 -1.26 -2.18 115.64 111.92 2nr2 s THR 55 Ca -0.07 0.78 0.05 0.00 -1.18 0.00 0.00 61.69 61.27 2nr2 s THR 55 Cb -0.05 -3.76 -0.02 0.00 1.34 0.00 0.00 72.50 70.00 2nr2 s THR 55 CO -0.00 -1.02 1.59 -0.07 -0.54 0.00 0.00 174.62 174.58 2nr2 h LEU 56 N -0.41 0.26 -1.04 4.79 3.38 -0.99 -2.81 115.31 118.49 2nr2 h LEU 56 Ca -0.44 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2nr2 h LEU 56 Cb 1.20 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2nr2 h LEU 56 CO 0.62 0.77 -0.00 0.77 0.09 0.00 0.00 178.44 180.68 2nr2 h SER 57 N 0.18 0.65 -0.54 -0.43 4.64 -1.52 0.29 113.55 116.82 2nr2 h SER 57 Ca -0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2nr2 h SER 57 Cb 1.04 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.93 2nr2 h SER 57 CO 0.09 0.72 0.34 -0.78 -0.87 0.00 0.00 176.83 176.33 2nr2 h ASP 58 N 0.64 0.63 1.27 4.97 3.58 -1.79 -3.01 116.42 122.72 2nr2 h ASP 58 Ca 0.13 -0.04 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 2nr2 h ASP 58 Cb 0.41 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 2nr2 h ASP 58 CO 0.02 0.49 -0.19 1.88 -2.88 0.00 0.00 179.24 178.55 2nr2 h TYR 59 N 0.72 0.00 -4.27 0.28 0.05 -1.48 -3.48 116.97 108.80 2nr2 h TYR 59 Ca 0.19 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.80 2nr2 h TYR 59 Cb -0.04 0.00 0.11 0.00 1.01 0.00 0.00 36.73 37.81 2nr2 h TYR 59 CO -0.03 0.19 -0.48 0.09 -1.05 0.00 0.00 178.16 176.89 2nr2 n ASN 60 N -3.24 -3.20 -4.66 3.88 3.02 -0.03 -5.02 115.26 106.01 2nr2 n ASN 60 Ca 0.01 -0.39 -0.37 0.00 -0.03 0.00 0.00 54.58 53.81 2nr2 n ASN 60 Cb 0.49 -3.24 -0.09 0.00 -0.61 0.00 0.00 39.78 36.32 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 -3.22 5.32 0.29 2.41 -1.09 -0.50 -5.03 121.20 119.38 2nr2 s ILE 61 Ca 0.12 0.31 0.04 0.00 -2.23 0.00 0.00 60.65 58.88 2nr2 s ILE 61 Cb -0.02 -3.56 0.04 0.00 -1.58 0.00 0.00 42.46 37.35 2nr2 s ILE 61 CO 0.43 0.32 0.31 0.00 -1.23 0.00 0.00 174.94 174.77 2nr2 n GLN 62 N 4.36 0.94 -2.01 2.79 6.02 -1.26 -4.63 117.38 123.59 2nr2 n GLN 62 Ca -0.13 -1.70 -0.36 0.00 -0.01 0.00 0.00 57.00 54.80 2nr2 n GLN 62 Cb 0.52 0.04 0.03 0.00 1.02 0.00 0.00 30.24 31.85 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 -3.25 3.01 -0.05 -1.09 -2.85 -1.26 -3.68 119.74 110.57 2nr2 s LYS 63 Ca 0.23 1.85 0.00 0.00 -1.00 0.00 0.00 55.97 57.05 2nr2 s LYS 63 Cb -0.02 -1.96 0.00 0.00 -2.06 0.00 0.00 37.83 33.79 2nr2 s LYS 63 CO 0.15 -1.18 0.00 0.39 0.10 0.00 0.00 175.35 174.80 2nr2 n GLU 64 N -1.52 -0.28 -2.66 1.78 1.02 0.08 -4.98 120.64 114.09 2nr2 n GLU 64 Ca 0.13 0.15 -0.41 0.00 -0.02 0.00 0.00 57.16 57.01 2nr2 n GLU 64 Cb 0.49 -3.42 -0.04 0.00 -0.02 0.00 0.00 31.44 28.45 2nr2 n GLU 64 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2nr2 s SER 65 N -2.14 7.42 -0.45 1.62 0.15 -1.24 -4.82 113.70 114.25 2nr2 s SER 65 Ca 0.00 1.89 -0.14 0.00 0.70 0.00 0.00 55.95 58.39 2nr2 s SER 65 Cb 0.00 -2.59 0.06 0.00 -1.71 0.00 0.00 66.02 61.78 2nr2 s SER 65 CO 0.00 -0.12 0.35 -0.89 1.20 0.00 0.00 173.24 173.77 2nr2 s THR 66 N -0.04 5.06 0.06 6.45 2.01 -1.25 -0.49 115.64 127.43 2nr2 s THR 66 Ca 0.48 -1.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 2nr2 s THR 66 Cb -0.25 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 2nr2 s THR 66 CO 0.31 -0.49 0.59 -0.76 -0.69 0.00 0.00 174.62 173.58 2nr2 s LEU 67 N 1.61 4.50 -0.20 4.42 1.43 -0.03 -4.94 118.68 125.47 2nr2 s LEU 67 Ca 0.04 1.26 -0.16 0.00 -1.03 0.00 0.00 54.13 54.24 2nr2 s LEU 67 Cb -0.23 -2.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 2nr2 s LEU 67 CO 0.07 0.22 0.39 -1.00 0.23 0.00 0.00 176.35 176.26 2nr2 s HIS 68 N -0.85 3.37 -0.21 0.29 3.76 -0.17 -1.56 115.29 119.92 2nr2 s HIS 68 Ca 0.30 0.60 -0.08 0.00 -0.15 0.00 0.00 55.06 55.73 2nr2 s HIS 68 Cb -0.19 -2.51 -0.04 0.00 1.11 0.00 0.00 32.58 30.94 2nr2 s HIS 68 CO 0.19 -0.00 0.08 -1.17 -0.85 0.00 0.00 174.74 172.99 2nr2 s LEU 69 N 1.29 3.79 0.08 0.89 2.96 0.24 0.79 118.68 128.72 2nr2 s LEU 69 Ca 0.19 0.02 0.09 0.00 -0.22 0.00 0.00 54.13 54.21 2nr2 s LEU 69 Cb -0.15 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2nr2 s LEU 69 CO 0.08 0.11 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.30 2nr2 s VAL 70 N 0.78 2.50 -0.08 1.68 1.01 0.16 -3.68 120.40 122.77 2nr2 s VAL 70 Ca 0.04 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.58 2nr2 s VAL 70 Cb -0.13 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 2nr2 s VAL 70 CO 0.02 0.24 -0.08 -0.76 0.00 0.00 0.00 175.10 174.52 2nr2 s LEU 71 N -1.68 3.08 -0.97 3.92 1.43 -1.26 -0.08 118.68 123.12 2nr2 s LEU 71 Ca 0.14 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 53.00 2nr2 s LEU 71 Cb -0.10 -1.68 0.19 0.00 0.03 0.00 0.00 46.19 44.63 2nr2 s LEU 71 CO 0.06 0.31 1.07 -0.60 0.23 0.00 0.00 176.35 177.42 2nr2 s ARG 72 N -0.52 3.77 0.41 1.70 3.52 -0.04 -4.96 118.95 122.83 2nr2 s ARG 72 Ca 0.08 -2.32 -0.04 0.00 -0.13 0.00 0.00 55.73 53.31 2nr2 s ARG 72 Cb -0.12 -4.74 -0.04 0.00 -1.56 0.00 0.00 34.95 28.49 2nr2 s ARG 72 CO 0.02 -1.55 0.69 -0.51 -0.81 0.00 0.00 175.30 173.14 2nr2 s LEU 73 N 1.17 3.81 0.09 -0.88 1.43 -1.26 -4.80 118.68 118.23 2nr2 s LEU 73 Ca 0.30 0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 54.14 2nr2 s LEU 73 Cb -0.07 -3.69 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 2nr2 s LEU 73 CO -0.07 -0.44 0.31 0.00 0.23 0.00 0.00 176.35 176.38 2nr2 s ARG 74 N -4.40 3.57 0.00 1.70 1.70 -1.26 -4.50 118.95 115.76 2nr2 s ARG 74 Ca 0.45 -0.16 0.00 0.00 -0.47 0.00 0.00 55.73 55.55 2nr2 s ARG 74 Cb -0.10 -2.96 0.00 0.00 -0.57 0.00 0.00 34.95 31.32 2nr2 s ARG 74 CO 0.39 0.55 0.00 0.41 -1.08 0.00 0.00 175.30 175.57 2nr2 n GLY 75 N 0.42 1.58 0.00 3.88 0.00 -1.26 -5.32 105.19 104.49 2nr2 n GLY 75 Ca -0.05 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93