#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 3.07 0.10 3.17 0.74 -1.26 -0.67 119.66 124.81 2nr2 s GLN 2 Ca 0.00 -0.41 0.04 0.00 0.05 0.00 0.00 55.36 55.05 2nr2 s GLN 2 Cb 0.00 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.20 2nr2 s GLN 2 CO 0.00 0.69 -0.11 0.96 -0.55 0.00 0.00 175.29 176.28 2nr2 s ILE 3 N -1.04 1.07 -0.20 -2.34 -4.36 -0.60 -1.47 121.20 112.26 2nr2 s ILE 3 Ca 0.17 -1.66 -0.05 0.00 -0.26 0.00 0.00 60.65 58.85 2nr2 s ILE 3 Cb -0.12 -1.41 -0.03 0.00 1.25 0.00 0.00 42.46 42.16 2nr2 s ILE 3 CO 0.07 -0.51 0.00 -0.36 0.24 0.00 0.00 174.94 174.39 2nr2 s PHE 4 N -2.33 3.05 -0.23 1.37 0.08 -0.60 -1.82 117.98 117.50 2nr2 s PHE 4 Ca 0.06 -0.42 -0.07 0.00 0.12 0.00 0.00 56.93 56.62 2nr2 s PHE 4 Cb -0.04 -2.07 -0.03 0.00 -0.57 0.00 0.00 43.02 40.31 2nr2 s PHE 4 CO 0.01 -0.21 0.06 0.08 -0.10 0.00 0.00 175.22 175.07 2nr2 s VAL 5 N 0.93 4.41 -0.21 -0.44 1.01 0.66 -1.10 120.40 125.65 2nr2 s VAL 5 Ca 0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.69 2nr2 s VAL 5 Cb -0.14 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2nr2 s VAL 5 CO 0.02 0.37 0.39 -0.54 0.00 0.00 0.00 175.10 175.34 2nr2 s LYS 6 N 1.27 4.15 0.37 2.72 -0.14 -0.53 0.26 119.74 127.85 2nr2 s LYS 6 Ca 0.05 0.17 -0.06 0.00 -1.36 0.00 0.00 55.97 54.77 2nr2 s LYS 6 Cb -0.15 -3.55 0.09 0.00 -1.68 0.00 0.00 37.83 32.54 2nr2 s LYS 6 CO 0.03 -0.07 0.46 0.25 -0.76 0.00 0.00 175.35 175.26 2nr2 n THR 7 N 4.44 0.00 -0.04 2.17 -2.24 -0.69 -1.58 114.28 116.33 2nr2 n THR 7 Ca -0.08 -0.31 -0.10 0.00 -2.27 0.00 0.00 64.05 61.29 2nr2 n THR 7 Cb 0.51 -1.64 -0.03 0.00 -2.10 0.00 0.00 70.33 67.06 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 0.21 -0.05 3.22 3.38 -1.91 -3.12 115.31 117.04 2nr2 h LEU 8 Ca -0.15 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2nr2 h LEU 8 Cb 0.43 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2nr2 h LEU 8 CO 0.11 0.15 0.00 0.71 0.09 0.00 0.00 178.44 179.50 2nr2 h THR 9 N 0.26 0.00 -0.93 0.22 1.35 -1.96 -3.47 112.91 108.37 2nr2 h THR 9 Ca 0.07 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 2nr2 h THR 9 Cb -0.02 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 2nr2 h THR 9 CO -0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.86 2nr2 n GLY 10 N 1.20 0.74 3.90 5.82 0.00 -1.18 -5.10 105.19 110.58 2nr2 n GLY 10 Ca 0.05 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.76 3.60 -0.37 1.61 2.20 -1.26 -4.84 119.74 117.92 2nr2 s LYS 11 Ca 0.00 -0.13 -0.13 0.00 -0.36 0.00 0.00 55.97 55.35 2nr2 s LYS 11 Cb 0.00 -2.82 0.01 0.00 -1.51 0.00 0.00 37.83 33.51 2nr2 s LYS 11 CO 0.00 0.42 0.25 0.99 -0.36 0.00 0.00 175.35 176.65 2nr2 s THR 12 N -1.75 5.08 -0.21 3.43 2.01 -1.26 -1.71 115.64 121.23 2nr2 s THR 12 Ca 0.41 -0.53 -0.15 0.00 0.31 0.00 0.00 61.69 61.73 2nr2 s THR 12 Cb -0.12 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2nr2 s THR 12 CO 0.26 -0.16 0.39 -0.63 -0.69 0.00 0.00 174.62 173.79 2nr2 s ILE 13 N 1.67 5.20 -0.30 1.82 -1.09 0.14 -4.94 121.20 123.70 2nr2 s ILE 13 Ca 0.05 0.67 -0.08 0.00 -2.23 0.00 0.00 60.65 59.06 2nr2 s ILE 13 Cb -0.18 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 2nr2 s ILE 13 CO 0.09 0.24 0.11 -0.89 -1.23 0.00 0.00 174.94 173.27 2nr2 s THR 14 N 1.39 4.26 -0.09 2.92 2.01 -1.26 -0.24 115.64 124.63 2nr2 s THR 14 Ca 0.18 -0.55 0.01 0.00 0.31 0.00 0.00 61.69 61.64 2nr2 s THR 14 Cb -0.15 -3.18 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 2nr2 s THR 14 CO 0.08 0.08 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.22 2nr2 s LEU 15 N 1.56 2.89 -0.26 4.42 1.43 -0.76 -4.98 118.68 122.97 2nr2 s LEU 15 Ca 0.04 -0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.65 2nr2 s LEU 15 Cb -0.17 -1.63 -0.00 0.00 0.03 0.00 0.00 46.19 44.42 2nr2 s LEU 15 CO 0.04 0.27 1.29 -1.61 0.23 0.00 0.00 176.35 176.57 2nr2 s GLU 16 N -0.26 4.00 0.40 1.70 0.41 -1.26 -1.56 118.70 122.13 2nr2 s GLU 16 Ca 0.02 1.35 0.03 0.00 -0.41 0.00 0.00 54.97 55.97 2nr2 s GLU 16 Cb -0.13 -3.84 -0.03 0.00 -1.78 0.00 0.00 34.13 28.34 2nr2 s GLU 16 CO 0.03 -1.00 0.09 0.14 -0.49 0.00 0.00 175.26 174.02 2nr2 s VAL 17 N 4.13 0.87 0.23 2.63 -7.23 0.16 -4.96 120.40 116.22 2nr2 s VAL 17 Ca 0.56 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.83 2nr2 s VAL 17 Cb -0.18 -2.46 -0.05 0.00 0.56 0.00 0.00 36.38 34.26 2nr2 s VAL 17 CO 0.20 0.00 -0.18 -1.61 -0.31 0.00 0.00 175.10 173.21 2nr2 s GLU 18 N -3.78 1.75 0.53 4.82 0.41 -1.26 -0.03 118.70 121.14 2nr2 s GLU 18 Ca 0.25 -1.55 0.32 0.00 -0.41 0.00 0.00 54.97 53.58 2nr2 s GLU 18 Cb 0.04 -1.91 1.19 0.00 -1.78 0.00 0.00 34.13 31.67 2nr2 s GLU 18 CO 0.13 0.38 1.92 -1.00 -0.49 0.00 0.00 175.26 176.20 2nr2 h PRO 19 N 2.71 0.00 -0.11 0.39 0.13 -1.96 -2.63 132.00 130.54 2nr2 h PRO 19 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 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 0.54 0.01 0.00 -1.13 -0.23 0.00 0.00 178.00 177.19 2nr2 n SER 20 N -3.10 1.24 -4.83 1.44 3.41 -1.26 -1.42 113.62 109.09 2nr2 n SER 20 Ca 0.01 -1.59 -0.33 0.00 -0.26 0.00 0.00 58.87 56.70 2nr2 n SER 20 Cb 0.34 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 64.16 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 -1.64 6.88 0.57 4.04 1.01 -0.99 -4.96 116.67 121.58 2nr2 s ASP 21 Ca 0.33 1.45 -0.01 0.00 0.71 0.00 0.00 52.55 55.02 2nr2 s ASP 21 Cb 0.17 -2.44 0.03 0.00 1.01 0.00 0.00 42.92 41.69 2nr2 s ASP 21 CO 0.27 -0.23 0.82 0.42 0.21 0.00 0.00 175.17 176.66 2nr2 s THR 22 N -1.99 2.98 0.37 -1.27 -4.23 -1.26 -2.41 115.64 107.83 2nr2 s THR 22 Ca 0.55 -0.47 0.27 0.00 -1.18 0.00 0.00 61.69 60.87 2nr2 s THR 22 Cb -0.11 -3.15 0.29 0.00 1.34 0.00 0.00 72.50 70.86 2nr2 s THR 22 CO 0.17 -0.13 2.04 0.40 -0.54 0.00 0.00 174.62 176.56 2nr2 h ILE 23 N -0.03 0.56 -0.02 2.99 1.08 -0.73 0.17 117.51 121.53 2nr2 h ILE 23 Ca -0.44 -0.61 -0.10 0.00 -0.39 0.00 0.00 64.86 63.32 2nr2 h ILE 23 Cb 1.29 1.40 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 2nr2 h ILE 23 CO 0.56 0.13 -0.45 -0.08 -0.69 0.00 0.00 178.15 177.62 2nr2 h GLU 24 N 0.00 0.04 0.00 2.37 4.81 -1.75 -1.59 114.58 118.46 2nr2 h GLU 24 Ca -0.00 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2nr2 h GLU 24 Cb 0.39 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2nr2 h GLU 24 CO 0.02 0.48 -0.46 -0.91 -0.73 0.00 0.00 179.01 177.41 2nr2 h ASN 25 N 0.03 0.00 0.02 1.04 -0.26 -1.02 -2.30 115.58 113.10 2nr2 h ASN 25 Ca -0.00 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2nr2 h ASN 25 Cb 0.81 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 2nr2 h ASN 25 CO 0.06 0.46 -0.01 0.58 -1.06 0.00 0.00 177.43 177.46 2nr2 h VAL 26 N 0.00 1.08 -0.30 2.81 2.07 -0.97 -2.86 116.25 118.07 2nr2 h VAL 26 Ca -0.00 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 2nr2 h VAL 26 Cb 1.18 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 2nr2 h VAL 26 CO 0.06 0.08 -0.13 0.11 0.02 0.00 0.00 177.57 177.71 2nr2 h LYS 27 N -0.17 0.52 -0.93 1.57 1.57 -1.21 -2.68 116.57 115.25 2nr2 h LYS 27 Ca -0.00 -0.15 0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2nr2 h LYS 27 Cb 0.15 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.35 2nr2 h LYS 27 CO 0.01 0.64 0.60 0.00 -0.57 0.00 0.00 179.45 180.13 2nr2 h ALA 28 N 1.39 1.51 -0.34 3.86 0.00 -1.48 -1.47 119.26 122.74 2nr2 h ALA 28 Ca 0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2nr2 h ALA 28 Cb 0.51 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2nr2 h ALA 28 CO 0.03 0.34 -0.17 0.87 0.00 0.00 0.00 179.25 180.33 2nr2 h LYS 29 N 1.04 0.61 0.00 0.00 1.57 -1.24 -1.72 116.57 116.83 2nr2 h LYS 29 Ca 0.41 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 2nr2 h LYS 29 Cb 0.24 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2nr2 h LYS 29 CO -0.16 0.75 -0.29 0.82 -0.57 0.00 0.00 179.45 180.00 2nr2 h ILE 30 N 0.55 0.64 0.00 1.86 2.04 -1.19 0.20 117.51 121.61 2nr2 h ILE 30 Ca 0.09 -1.38 -0.16 0.00 1.00 0.00 0.00 64.86 64.40 2nr2 h ILE 30 Cb 0.60 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.58 2nr2 h ILE 30 CO 0.04 0.28 -0.78 -0.61 0.00 0.00 0.00 178.15 177.08 2nr2 h GLN 31 N 0.00 0.00 -0.09 2.37 4.15 -0.85 -1.70 115.11 118.99 2nr2 h GLN 31 Ca -0.00 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 2nr2 h GLN 31 Cb 0.90 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.59 2nr2 h GLN 31 CO 0.04 0.78 -0.24 0.22 -1.93 0.00 0.00 178.83 177.71 2nr2 h ASP 32 N 0.00 0.36 0.00 -0.69 3.58 -0.86 -3.04 116.42 115.77 2nr2 h ASP 32 Ca -0.01 -0.59 0.00 0.00 0.42 0.00 0.00 57.03 56.85 2nr2 h ASP 32 Cb 1.39 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.34 2nr2 h ASP 32 CO 0.10 0.89 0.00 1.17 -2.88 0.00 0.00 179.24 178.52 2nr2 n LYS 33 N -4.49 0.00 0.02 0.28 3.00 0.66 -4.60 118.16 113.02 2nr2 n LYS 33 Ca -0.08 0.23 -0.22 0.00 -0.00 0.00 0.00 58.31 58.24 2nr2 n LYS 33 Cb 0.44 -1.10 -0.14 0.00 0.00 0.00 0.00 35.03 34.23 2nr2 n LYS 33 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2nr2 h GLU 34 N 0.00 0.28 0.00 1.64 4.39 -1.55 -3.49 114.58 115.85 2nr2 h GLU 34 Ca 0.00 -0.47 0.00 0.00 0.34 0.00 0.00 59.36 59.23 2nr2 h GLU 34 Cb 0.00 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2nr2 h GLU 34 CO 0.00 1.23 0.00 0.41 -1.16 0.00 0.00 179.01 179.49 2nr2 n GLY 35 N 1.81 1.83 3.60 -3.84 0.00 -0.72 -5.03 105.19 102.85 2nr2 n GLY 35 Ca -0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.00 5.01 0.35 -0.61 1.01 -1.22 -4.96 121.20 118.78 2nr2 s ILE 36 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 60.65 60.42 2nr2 s ILE 36 Cb 0.00 -3.33 -0.11 0.00 0.01 0.00 0.00 42.46 39.03 2nr2 s ILE 36 CO 0.00 0.36 1.51 -2.84 0.00 0.00 0.00 174.94 173.96 2nr2 s PRO 37 N 1.12 4.12 0.48 2.79 0.02 -1.26 -3.98 135.00 138.28 2nr2 s PRO 37 Ca 0.06 2.56 0.17 0.00 0.02 0.00 0.00 61.00 63.81 2nr2 s PRO 37 Cb -0.14 -2.99 1.15 0.00 0.02 0.00 0.00 34.50 32.54 2nr2 s PRO 37 CO 0.04 -0.55 2.05 -1.00 -0.33 0.00 0.00 177.00 177.22 2nr2 h PRO 38 N 3.51 0.00 0.00 5.54 0.13 -1.96 -1.28 132.00 137.94 2nr2 h PRO 38 Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 2nr2 h PRO 38 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2nr2 h PRO 38 CO 0.68 0.13 -0.12 -0.44 -0.23 0.00 0.00 178.00 178.02 2nr2 h ASP 39 N 0.00 0.00 1.08 1.44 3.32 -1.99 -2.77 116.42 117.51 2nr2 h ASP 39 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nr2 h ASP 39 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2nr2 h ASP 39 CO 0.02 0.12 0.00 0.00 -1.72 0.00 0.00 179.24 177.66 2nr2 n GLN 40 N -4.24 0.16 -3.34 3.56 6.02 -0.48 -4.80 117.38 114.25 2nr2 n GLN 40 Ca -0.03 0.23 -0.40 0.00 -0.01 0.00 0.00 57.00 56.79 2nr2 n GLN 40 Cb 0.20 -1.72 -0.09 0.00 1.02 0.00 0.00 30.24 29.65 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nr2 s GLN 41 N -3.12 3.77 -0.19 -1.09 -0.21 -1.05 -1.57 119.66 116.21 2nr2 s GLN 41 Ca 0.09 -0.14 -0.05 0.00 0.02 0.00 0.00 55.36 55.28 2nr2 s GLN 41 Cb 0.13 -3.74 -0.03 0.00 1.00 0.00 0.00 33.01 30.36 2nr2 s GLN 41 CO 0.49 -0.46 0.01 1.03 -2.12 0.00 0.00 175.29 174.25 2nr2 s ARG 42 N 2.16 3.72 -0.08 2.91 3.00 0.89 -4.99 118.95 126.56 2nr2 s ARG 42 Ca 0.15 -0.47 -0.00 0.00 0.00 0.00 0.00 55.73 55.41 2nr2 s ARG 42 Cb -0.16 -3.09 -0.03 0.00 0.00 0.00 0.00 34.95 31.68 2nr2 s ARG 42 CO 0.11 0.13 -0.05 -0.51 0.00 0.00 0.00 175.30 174.98 2nr2 s LEU 43 N 0.71 3.27 -0.12 2.53 1.43 -1.26 0.11 118.68 125.36 2nr2 s LEU 43 Ca 0.01 0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2nr2 s LEU 43 Cb -0.14 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.36 2nr2 s LEU 43 CO 0.02 0.34 -0.19 -0.63 0.23 0.00 0.00 176.35 176.12 2nr2 s ILE 44 N -0.68 1.81 -0.27 -0.59 -1.09 0.78 -1.61 121.20 119.55 2nr2 s ILE 44 Ca 0.10 -0.84 0.03 0.00 -2.23 0.00 0.00 60.65 57.72 2nr2 s ILE 44 Cb -0.11 -1.61 0.06 0.00 -1.58 0.00 0.00 42.46 39.22 2nr2 s ILE 44 CO 0.02 0.50 -0.09 0.12 -1.23 0.00 0.00 174.94 174.26 2nr2 s PHE 45 N 0.79 3.25 0.00 3.97 5.36 -0.56 -0.77 117.98 130.02 2nr2 s PHE 45 Ca -0.09 -2.36 0.00 0.00 -0.96 0.00 0.00 56.93 53.52 2nr2 s PHE 45 Cb -0.16 -2.01 0.00 0.00 -0.34 0.00 0.00 43.02 40.52 2nr2 s PHE 45 CO 0.00 -0.88 0.00 0.00 -1.46 0.00 0.00 175.22 172.88 2nr2 n ALA 46 N 4.43 0.00 -1.93 11.12 0.00 -1.26 -2.25 120.51 130.62 2nr2 n ALA 46 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2nr2 n ALA 46 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.96 3.56 0.00 0.00 -1.26 -5.09 105.19 103.37 2nr2 n GLY 47 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 0.00 3.83 0.22 1.61 2.47 -0.96 -5.10 119.74 121.81 2nr2 s LYS 48 Ca 0.00 -0.42 -0.30 0.00 -1.56 0.00 0.00 55.97 53.69 2nr2 s LYS 48 Cb 0.00 -3.13 -0.08 0.00 -1.46 0.00 0.00 37.83 33.15 2nr2 s LYS 48 CO 0.00 0.20 0.96 1.14 0.16 0.00 0.00 175.35 177.81 2nr2 s GLN 49 N 0.53 4.81 -0.22 4.03 -2.07 -1.26 -1.50 119.66 123.97 2nr2 s GLN 49 Ca 0.01 1.51 -0.09 0.00 -1.82 0.00 0.00 55.36 54.97 2nr2 s GLN 49 Cb -0.13 -3.29 -0.05 0.00 -1.09 0.00 0.00 33.01 28.45 2nr2 s GLN 49 CO 0.02 0.43 0.12 -0.51 -1.32 0.00 0.00 175.29 174.02 2nr2 s LEU 50 N -0.96 3.97 0.39 2.60 1.43 -0.63 -4.96 118.68 120.51 2nr2 s LEU 50 Ca 0.43 0.08 -0.07 0.00 -1.03 0.00 0.00 54.13 53.54 2nr2 s LEU 50 Cb -0.26 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.86 2nr2 s LEU 50 CO 0.32 0.10 0.70 -1.61 0.23 0.00 0.00 176.35 176.09 2nr2 s GLU 51 N 0.84 3.66 0.07 1.70 2.02 -1.26 -4.65 118.70 121.09 2nr2 s GLU 51 Ca 0.06 0.23 -0.14 0.00 0.02 0.00 0.00 54.97 55.14 2nr2 s GLU 51 Cb -0.13 -2.47 -0.24 0.00 0.10 0.00 0.00 34.13 31.39 2nr2 s GLU 51 CO 0.03 0.00 1.18 -0.44 0.02 0.00 0.00 175.26 176.05 2nr2 h ASP 52 N 1.09 0.90 -0.18 -0.19 3.32 -1.98 -3.32 116.42 116.07 2nr2 h ASP 52 Ca -0.47 -0.75 -0.04 0.00 0.02 0.00 0.00 57.03 55.79 2nr2 h ASP 52 Cb 1.19 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 2nr2 h ASP 52 CO 0.64 1.53 0.05 0.61 -1.72 0.00 0.00 179.24 180.35 2nr2 n GLY 53 N 1.11 2.11 3.80 2.75 0.00 -1.26 -2.52 105.19 111.18 2nr2 n GLY 53 Ca -0.11 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.30 2.62 0.40 1.61 1.81 -1.25 -4.98 118.95 117.86 2nr2 s ARG 54 Ca 0.15 -1.36 0.08 0.00 -1.72 0.00 0.00 55.73 52.88 2nr2 s ARG 54 Cb 0.11 -2.38 0.00 0.00 -0.45 0.00 0.00 34.95 32.24 2nr2 s ARG 54 CO 0.04 0.14 0.51 0.95 -0.68 0.00 0.00 175.30 176.26 2nr2 s THR 55 N -2.33 3.21 0.21 0.02 -4.23 -1.26 -0.71 115.64 110.55 2nr2 s THR 55 Ca 0.39 -1.06 -0.09 0.00 -1.18 0.00 0.00 61.69 59.75 2nr2 s THR 55 Cb -0.05 -3.09 0.16 0.00 1.34 0.00 0.00 72.50 70.86 2nr2 s THR 55 CO 0.25 -0.04 1.85 -0.07 -0.54 0.00 0.00 174.62 176.07 2nr2 h LEU 56 N 0.77 0.76 -1.31 4.79 4.07 -1.49 -2.88 115.31 120.02 2nr2 h LEU 56 Ca -0.42 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.50 2nr2 h LEU 56 Cb 1.27 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.83 2nr2 h LEU 56 CO 0.49 0.52 -0.05 -1.28 -1.08 0.00 0.00 178.44 177.04 2nr2 h SER 57 N 0.90 0.37 -0.38 -0.43 0.87 -1.45 -2.09 113.55 111.35 2nr2 h SER 57 Ca 0.30 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 2nr2 h SER 57 Cb 0.03 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 2nr2 h SER 57 CO -0.12 0.48 0.21 0.44 -0.53 0.00 0.00 176.83 177.31 2nr2 h ASP 58 N 0.38 0.51 -0.40 6.23 3.32 -1.80 -1.95 116.42 122.72 2nr2 h ASP 58 Ca 0.08 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2nr2 h ASP 58 Cb 0.34 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2nr2 h ASP 58 CO 0.01 0.43 0.00 -1.22 -1.72 0.00 0.00 179.24 176.74 2nr2 n TYR 59 N -4.41 0.58 -1.58 4.55 4.01 -0.94 -4.94 117.16 114.43 2nr2 n TYR 59 Ca 0.03 -0.28 -0.16 0.00 -0.16 0.00 0.00 57.90 57.34 2nr2 n TYR 59 Cb 0.11 -0.02 -0.06 0.00 -0.31 0.00 0.00 39.34 39.06 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 0.65 -4.86 -4.58 7.72 3.02 -0.73 -4.96 115.26 111.52 2nr2 n ASN 60 Ca 0.14 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.59 2nr2 n ASN 60 Cb 0.37 -3.77 -0.02 0.00 -0.61 0.00 0.00 39.78 35.74 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 -2.61 3.83 0.00 2.41 1.01 -0.83 -5.00 121.20 120.01 2nr2 s ILE 61 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 60.65 61.41 2nr2 s ILE 61 Cb 0.00 -4.36 0.00 0.00 0.01 0.00 0.00 42.46 38.11 2nr2 s ILE 61 CO 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 174.94 173.91 2nr2 n GLN 62 N 8.46 1.90 -2.38 2.79 6.02 -1.26 -4.43 117.38 128.48 2nr2 n GLN 62 Ca 0.14 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 2nr2 n GLN 62 Cb 0.49 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.71 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2nr2 s LYS 63 N 0.39 4.44 -0.35 -1.09 1.02 -1.26 -3.75 119.74 119.14 2nr2 s LYS 63 Ca 0.00 1.87 0.00 0.00 0.02 0.00 0.00 55.97 57.86 2nr2 s LYS 63 Cb 0.00 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.29 2nr2 s LYS 63 CO 0.00 0.01 0.00 0.39 -0.92 0.00 0.00 175.35 174.83 2nr2 n GLU 64 N 0.81 -0.48 -3.02 1.68 1.02 -0.54 -5.00 120.64 115.10 2nr2 n GLU 64 Ca 0.01 0.45 -0.35 0.00 -0.02 0.00 0.00 57.16 57.24 2nr2 n GLU 64 Cb 0.45 -4.06 -0.06 0.00 -0.02 0.00 0.00 31.44 27.75 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 -2.51 7.06 -0.29 1.62 0.01 -1.25 -4.70 113.70 113.63 2nr2 s SER 65 Ca 0.00 1.50 -0.14 0.00 1.31 0.00 0.00 55.95 58.62 2nr2 s SER 65 Cb 0.00 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2nr2 s SER 65 CO 0.00 -0.06 0.31 -0.89 0.41 0.00 0.00 173.24 173.02 2nr2 s THR 66 N -1.67 5.21 0.01 1.44 2.01 -1.26 -1.55 115.64 119.83 2nr2 s THR 66 Ca 0.48 0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.82 2nr2 s THR 66 Cb -0.15 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2nr2 s THR 66 CO 0.20 0.13 0.02 -0.76 -0.69 0.00 0.00 174.62 173.52 2nr2 s LEU 67 N 1.96 3.61 -0.03 4.42 1.02 -0.26 -4.68 118.68 124.72 2nr2 s LEU 67 Ca 0.12 0.01 0.07 0.00 0.02 0.00 0.00 54.13 54.35 2nr2 s LEU 67 Cb -0.16 -2.11 -0.02 0.00 0.02 0.00 0.00 46.19 43.92 2nr2 s LEU 67 CO 0.11 0.27 -0.25 -1.00 0.02 0.00 0.00 176.35 175.50 2nr2 s HIS 68 N -1.14 2.39 -0.21 0.29 3.76 0.05 -1.45 115.29 118.97 2nr2 s HIS 68 Ca 0.21 -0.45 -0.06 0.00 -0.15 0.00 0.00 55.06 54.61 2nr2 s HIS 68 Cb -0.12 -1.53 -0.03 0.00 1.11 0.00 0.00 32.58 32.02 2nr2 s HIS 68 CO 0.12 -0.04 0.02 -1.17 -0.85 0.00 0.00 174.74 172.82 2nr2 s LEU 69 N -0.55 3.34 -0.10 0.89 0.20 -0.62 -0.16 118.68 121.69 2nr2 s LEU 69 Ca 0.08 -0.17 0.03 0.00 0.69 0.00 0.00 54.13 54.75 2nr2 s LEU 69 Cb -0.11 -1.85 -0.01 0.00 -0.43 0.00 0.00 46.19 43.79 2nr2 s LEU 69 CO -0.00 0.06 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.25 2nr2 s VAL 70 N 1.03 2.62 -0.08 1.68 1.01 0.31 -4.16 120.40 122.80 2nr2 s VAL 70 Ca 0.02 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 2nr2 s VAL 70 Cb -0.14 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 2nr2 s VAL 70 CO 0.02 0.55 0.38 -0.76 0.00 0.00 0.00 175.10 175.29 2nr2 s LEU 71 N 0.08 4.35 -0.27 3.92 1.43 -1.26 -0.08 118.68 126.87 2nr2 s LEU 71 Ca -0.08 0.77 -0.05 0.00 -1.03 0.00 0.00 54.13 53.74 2nr2 s LEU 71 Cb -0.15 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.55 2nr2 s LEU 71 CO 0.05 0.18 0.02 -0.60 0.23 0.00 0.00 176.35 176.24 2nr2 s ARG 72 N -0.20 3.13 -0.72 1.70 6.06 -0.61 -4.96 118.95 123.34 2nr2 s ARG 72 Ca 0.22 -0.81 -0.26 0.00 -2.50 0.00 0.00 55.73 52.38 2nr2 s ARG 72 Cb -0.15 -3.21 0.04 0.00 0.06 0.00 0.00 34.95 31.69 2nr2 s ARG 72 CO 0.09 -0.37 1.20 -0.51 -2.50 0.00 0.00 175.30 173.22 2nr2 s LEU 73 N 1.46 3.45 -0.02 -0.88 1.43 -1.26 -4.68 118.68 118.18 2nr2 s LEU 73 Ca 0.03 -0.57 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 2nr2 s LEU 73 Cb -0.16 -2.53 -0.20 0.00 0.03 0.00 0.00 46.19 43.32 2nr2 s LEU 73 CO -0.00 -1.74 1.20 -0.09 0.23 0.00 0.00 176.35 175.94 2nr2 h ARG 74 N 9.92 0.10 0.00 1.70 2.43 -1.97 -3.46 114.38 123.10 2nr2 h ARG 74 Ca -0.28 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2nr2 h ARG 74 Cb 1.05 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2nr2 h ARG 74 CO 1.26 0.66 0.00 0.41 -1.51 0.00 0.00 179.97 180.79 2nr2 n GLY 75 N 0.48 0.04 0.00 2.80 0.00 -1.26 -5.29 105.19 101.96 2nr2 n GLY 75 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93