#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 0.13 3.17 -0.21 -1.26 -1.22 119.66 124.41 2nr2 s GLN 2 Ca 0.00 0.28 0.07 0.00 0.02 0.00 0.00 55.36 55.73 2nr2 s GLN 2 Cb 0.00 -3.36 -0.04 0.00 1.00 0.00 0.00 33.01 30.62 2nr2 s GLN 2 CO 0.00 0.38 -0.16 0.96 -2.12 0.00 0.00 175.29 174.34 2nr2 s ILE 3 N -0.02 1.53 -0.23 1.08 -4.36 -0.76 0.35 121.20 118.78 2nr2 s ILE 3 Ca 0.21 -1.72 -0.03 0.00 -0.26 0.00 0.00 60.65 58.84 2nr2 s ILE 3 Cb -0.15 -1.60 -0.00 0.00 1.25 0.00 0.00 42.46 41.96 2nr2 s ILE 3 CO 0.09 -0.32 -0.05 -0.36 0.24 0.00 0.00 174.94 174.54 2nr2 s PHE 4 N -1.90 2.97 -0.25 1.37 0.08 -0.85 -0.44 117.98 118.96 2nr2 s PHE 4 Ca 0.10 -1.07 -0.08 0.00 0.12 0.00 0.00 56.93 56.00 2nr2 s PHE 4 Cb -0.06 -2.09 -0.03 0.00 -0.57 0.00 0.00 43.02 40.26 2nr2 s PHE 4 CO 0.04 -0.59 0.08 0.08 -0.10 0.00 0.00 175.22 174.73 2nr2 s VAL 5 N 1.45 4.41 -0.31 -0.44 1.01 0.81 -0.68 120.40 126.65 2nr2 s VAL 5 Ca 0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 61.67 2nr2 s VAL 5 Cb -0.15 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 2nr2 s VAL 5 CO -0.04 0.33 0.72 -0.54 0.00 0.00 0.00 175.10 175.57 2nr2 s LYS 6 N 1.63 3.91 0.91 2.72 1.02 -0.14 0.46 119.74 130.26 2nr2 s LYS 6 Ca 0.06 0.43 -0.12 0.00 0.02 0.00 0.00 55.97 56.36 2nr2 s LYS 6 Cb -0.15 -3.74 0.14 0.00 -0.52 0.00 0.00 37.83 33.56 2nr2 s LYS 6 CO 0.04 -0.65 1.11 0.95 -0.92 0.00 0.00 175.35 175.89 2nr2 s THR 7 N 2.81 2.31 0.09 2.17 -4.23 -0.48 -0.85 115.64 117.46 2nr2 s THR 7 Ca 0.29 0.10 -0.18 0.00 -1.18 0.00 0.00 61.69 60.72 2nr2 s THR 7 Cb -0.14 -2.74 -0.07 0.00 1.34 0.00 0.00 72.50 70.88 2nr2 s THR 7 CO 0.13 -0.13 1.53 -0.07 -0.54 0.00 0.00 174.62 175.53 2nr2 h LEU 8 N -1.54 0.47 0.21 4.79 3.38 -1.89 -3.37 115.31 117.35 2nr2 h LEU 8 Ca -0.51 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.15 2nr2 h LEU 8 Cb 1.31 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2nr2 h LEU 8 CO 0.59 0.66 -0.10 0.71 0.09 0.00 0.00 178.44 180.39 2nr2 h THR 9 N 0.26 0.00 0.00 0.22 1.35 -1.96 -3.47 112.91 109.31 2nr2 h THR 9 Ca 0.08 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 2nr2 h THR 9 Cb 0.42 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.84 2nr2 h THR 9 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 2nr2 n GLY 10 N -0.38 0.00 3.57 5.82 0.00 -1.26 -5.14 105.19 107.80 2nr2 n GLY 10 Ca -0.03 0.00 -0.34 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 0.00 3.79 -0.44 1.61 2.20 -1.26 -4.98 119.74 120.65 2nr2 s LYS 11 Ca 0.00 -0.43 -0.16 0.00 -0.36 0.00 0.00 55.97 55.03 2nr2 s LYS 11 Cb 0.00 -3.05 0.04 0.00 -1.51 0.00 0.00 37.83 33.31 2nr2 s LYS 11 CO 0.00 0.28 0.37 0.99 -0.36 0.00 0.00 175.35 176.64 2nr2 s THR 12 N 0.29 5.21 -0.23 3.43 2.01 -1.26 -1.38 115.64 123.72 2nr2 s THR 12 Ca 0.00 -0.79 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 2nr2 s THR 12 Cb -0.13 -4.05 0.00 0.00 0.01 0.00 0.00 72.50 68.34 2nr2 s THR 12 CO 0.02 -0.46 1.12 -0.63 -0.69 0.00 0.00 174.62 173.97 2nr2 s ILE 13 N 1.76 4.53 -0.28 1.82 1.01 0.17 -4.81 121.20 125.41 2nr2 s ILE 13 Ca 0.06 1.83 -0.26 0.00 0.00 0.00 0.00 60.65 62.28 2nr2 s ILE 13 Cb -0.21 -4.24 0.01 0.00 0.01 0.00 0.00 42.46 38.03 2nr2 s ILE 13 CO 0.09 -0.22 0.93 -0.89 0.00 0.00 0.00 174.94 174.84 2nr2 s THR 14 N 3.40 4.69 0.33 2.92 2.01 -1.26 -0.13 115.64 127.59 2nr2 s THR 14 Ca 0.48 1.58 0.08 0.00 0.31 0.00 0.00 61.69 64.14 2nr2 s THR 14 Cb -0.16 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.05 2nr2 s THR 14 CO 0.10 -0.27 0.12 -0.76 -0.69 0.00 0.00 174.62 173.12 2nr2 s LEU 15 N 3.19 3.26 -0.14 4.42 1.43 0.42 -4.99 118.68 126.27 2nr2 s LEU 15 Ca 0.39 -0.74 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2nr2 s LEU 15 Cb -0.14 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 2nr2 s LEU 15 CO 0.11 -0.24 -0.10 -0.70 0.23 0.00 0.00 176.35 175.65 2nr2 s GLU 16 N -3.81 3.46 0.07 1.70 2.12 -1.26 -1.83 118.70 119.14 2nr2 s GLU 16 Ca 0.36 -0.64 -0.01 0.00 0.36 0.00 0.00 54.97 55.04 2nr2 s GLU 16 Cb -0.03 -2.72 -0.04 0.00 0.26 0.00 0.00 34.13 31.60 2nr2 s GLU 16 CO 0.22 0.20 -0.00 0.14 -0.54 0.00 0.00 175.26 175.28 2nr2 s VAL 17 N 0.40 0.19 -0.11 3.70 -7.23 -0.36 -4.95 120.40 112.04 2nr2 s VAL 17 Ca -0.09 -1.83 -0.03 0.00 -1.81 0.00 0.00 61.98 58.23 2nr2 s VAL 17 Cb -0.15 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 2nr2 s VAL 17 CO 0.05 -0.84 0.01 -1.61 -0.31 0.00 0.00 175.10 172.39 2nr2 s GLU 18 N -3.96 3.20 0.00 4.82 0.41 -1.26 0.47 118.70 122.39 2nr2 s GLU 18 Ca 0.12 -0.41 0.12 0.00 -0.41 0.00 0.00 54.97 54.39 2nr2 s GLU 18 Cb 0.08 -2.87 0.54 0.00 -1.78 0.00 0.00 34.13 30.10 2nr2 s GLU 18 CO -0.07 0.59 1.34 -0.35 -0.49 0.00 0.00 175.26 176.29 2nr2 n PRO 19 N 2.49 0.06 -0.38 0.39 -0.04 -1.26 -1.53 135.00 134.73 2nr2 n PRO 19 Ca -0.18 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.64 2nr2 n PRO 19 Cb 0.53 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.81 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 -1.42 3.96 -4.94 3.54 3.41 -1.26 -1.45 113.62 115.46 2nr2 n SER 20 Ca 0.04 -2.06 -0.24 0.00 -0.26 0.00 0.00 58.87 56.36 2nr2 n SER 20 Cb 0.12 -0.48 0.02 0.00 -0.26 0.00 0.00 64.21 63.61 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 -1.00 5.71 0.44 4.04 2.15 -0.58 -4.94 116.67 122.50 2nr2 s ASP 21 Ca 0.47 0.37 -0.03 0.00 0.43 0.00 0.00 52.55 53.80 2nr2 s ASP 21 Cb 0.25 -1.52 -0.03 0.00 -0.30 0.00 0.00 42.92 41.33 2nr2 s ASP 21 CO 0.31 -0.84 0.70 0.42 -0.17 0.00 0.00 175.17 175.59 2nr2 s THR 22 N -2.69 4.70 0.21 1.71 -4.23 -1.26 -3.45 115.64 110.62 2nr2 s THR 22 Ca 0.51 -0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2nr2 s THR 22 Cb -0.10 -3.76 -0.06 0.00 1.34 0.00 0.00 72.50 69.91 2nr2 s THR 22 CO 0.40 -0.64 1.51 0.40 -0.54 0.00 0.00 174.62 175.75 2nr2 h ILE 23 N 0.38 1.37 -0.68 2.99 2.04 -0.84 -1.59 117.51 121.17 2nr2 h ILE 23 Ca -0.48 -1.98 0.12 0.00 1.00 0.00 0.00 64.86 63.52 2nr2 h ILE 23 Cb 1.22 1.98 -0.08 0.00 -0.74 0.00 0.00 36.82 39.19 2nr2 h ILE 23 CO 0.61 0.60 0.25 -0.08 0.00 0.00 0.00 178.15 179.53 2nr2 h GLU 24 N 0.27 0.40 -0.90 2.37 4.81 -1.23 -0.38 114.58 119.92 2nr2 h GLU 24 Ca -0.01 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.24 2nr2 h GLU 24 Cb 1.16 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.40 2nr2 h GLU 24 CO 0.11 0.27 0.59 -0.91 -0.73 0.00 0.00 179.01 178.33 2nr2 h ASN 25 N 0.41 0.95 -0.06 1.04 2.35 -1.70 -0.80 115.58 117.77 2nr2 h ASN 25 Ca 0.36 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.10 2nr2 h ASN 25 Cb 0.50 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 2nr2 h ASN 25 CO -0.36 0.64 0.02 0.58 -1.65 0.00 0.00 177.43 176.65 2nr2 h VAL 26 N 1.09 1.16 -0.98 2.81 2.07 -0.98 -2.79 116.25 118.63 2nr2 h VAL 26 Ca 0.37 -0.48 0.10 0.00 0.82 0.00 0.00 66.70 67.51 2nr2 h VAL 26 Cb 0.08 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.14 2nr2 h VAL 26 CO -0.12 0.13 0.63 0.11 0.02 0.00 0.00 177.57 178.34 2nr2 h LYS 27 N -0.08 1.01 -0.49 1.57 1.57 -0.53 0.17 116.57 119.79 2nr2 h LYS 27 Ca 0.02 -0.06 0.12 0.00 -1.87 0.00 0.00 60.65 58.86 2nr2 h LYS 27 Cb 0.19 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2nr2 h LYS 27 CO -0.00 0.67 0.34 0.00 -0.57 0.00 0.00 179.45 179.89 2nr2 h ALA 28 N 1.51 2.28 -0.41 3.86 0.00 -1.12 -1.87 119.26 123.52 2nr2 h ALA 28 Ca 0.46 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.28 2nr2 h ALA 28 Cb 0.36 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2nr2 h ALA 28 CO -0.22 -0.41 -0.07 0.87 0.00 0.00 0.00 179.25 179.42 2nr2 h LYS 29 N 0.13 0.69 -0.26 0.00 1.79 -0.38 -2.90 116.57 115.64 2nr2 h LYS 29 Ca 0.23 -0.20 -0.08 0.00 -2.18 0.00 0.00 60.65 58.41 2nr2 h LYS 29 Cb 0.74 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.30 2nr2 h LYS 29 CO -0.03 0.76 -0.19 0.82 -1.08 0.00 0.00 179.45 179.72 2nr2 h ILE 30 N 0.64 1.25 -0.90 1.86 2.04 -1.09 -3.00 117.51 118.30 2nr2 h ILE 30 Ca 0.12 -1.15 0.01 0.00 1.00 0.00 0.00 64.86 64.84 2nr2 h ILE 30 Cb 0.51 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 2nr2 h ILE 30 CO 0.03 0.37 0.60 -0.61 0.00 0.00 0.00 178.15 178.53 2nr2 h GLN 31 N 0.43 1.18 -0.66 2.37 4.15 -1.28 0.57 115.11 121.88 2nr2 h GLN 31 Ca 0.07 -0.07 0.13 0.00 0.77 0.00 0.00 58.65 59.55 2nr2 h GLN 31 Cb 0.58 -0.27 -0.10 0.00 0.21 0.00 0.00 27.48 27.91 2nr2 h GLN 31 CO 0.04 0.78 0.12 0.22 -1.93 0.00 0.00 178.83 178.07 2nr2 h ASP 32 N 1.22 -0.04 0.11 -0.69 3.58 -1.41 -0.11 116.42 119.08 2nr2 h ASP 32 Ca 0.33 0.13 -0.16 0.00 0.42 0.00 0.00 57.03 57.76 2nr2 h ASP 32 Cb -0.13 0.19 0.02 0.00 1.72 0.00 0.00 39.33 41.13 2nr2 h ASP 32 CO -0.08 -0.03 -0.70 0.11 -2.88 0.00 0.00 179.24 175.67 2nr2 h LYS 33 N 0.24 0.23 0.00 0.28 1.79 -1.17 -3.41 116.57 114.54 2nr2 h LYS 33 Ca 0.35 -0.40 -0.41 0.00 -2.18 0.00 0.00 60.65 58.02 2nr2 h LYS 33 Cb 0.57 0.15 -0.07 0.00 -1.58 0.00 0.00 32.23 31.30 2nr2 h LYS 33 CO -0.47 1.19 -2.45 0.39 -1.08 0.00 0.00 179.45 177.04 2nr2 n GLU 34 N -4.21 0.60 -0.38 3.15 -0.58 0.18 -5.01 120.64 114.38 2nr2 n GLU 34 Ca -0.14 0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 2nr2 n GLU 34 Cb 0.76 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 30.15 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 1.89 0.78 3.69 0.62 0.00 -0.05 -5.00 105.19 107.11 2nr2 n GLY 35 Ca -0.48 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 44.89 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 5.34 0.61 -0.61 1.01 -1.26 -5.04 121.20 119.24 2nr2 s ILE 36 Ca 0.00 0.35 -0.18 0.00 0.00 0.00 0.00 60.65 60.82 2nr2 s ILE 36 Cb 0.00 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 2nr2 s ILE 36 CO 0.00 0.36 1.17 -2.16 0.00 0.00 0.00 174.94 174.31 2nr2 s PRO 37 N 0.79 2.92 0.47 2.79 0.04 -1.26 -4.32 135.00 136.43 2nr2 s PRO 37 Ca 0.11 1.68 0.29 0.00 0.04 0.00 0.00 61.00 63.12 2nr2 s PRO 37 Cb -0.13 -1.94 0.95 0.00 0.04 0.00 0.00 34.50 33.42 2nr2 s PRO 37 CO 0.03 -1.21 1.82 -1.00 0.04 0.00 0.00 177.00 176.68 2nr2 h PRO 38 N 0.64 0.00 -0.24 0.56 0.13 -1.94 -2.02 132.00 129.13 2nr2 h PRO 38 Ca -0.49 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.70 2nr2 h PRO 38 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2nr2 h PRO 38 CO 0.55 0.00 0.17 0.22 -0.23 0.00 0.00 178.00 178.71 2nr2 h ASP 39 N 0.00 0.03 0.60 1.44 3.58 -1.97 -2.72 116.42 117.38 2nr2 h ASP 39 Ca 0.00 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.23 2nr2 h ASP 39 Cb 0.68 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 2nr2 h ASP 39 CO 0.00 0.02 -0.97 -0.61 -2.88 0.00 0.00 179.24 174.80 2nr2 h GLN 40 N 0.03 0.22 -6.97 0.28 4.15 -1.72 -3.47 115.11 107.64 2nr2 h GLN 40 Ca 0.11 -0.28 -0.45 0.00 0.77 0.00 0.00 58.65 58.80 2nr2 h GLN 40 Cb 0.40 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.16 2nr2 h GLN 40 CO -0.01 1.03 0.32 -0.65 -1.93 0.00 0.00 178.83 177.59 2nr2 s GLN 41 N -3.06 4.32 -0.09 1.69 -0.21 -1.03 -0.45 119.66 120.83 2nr2 s GLN 41 Ca -0.03 1.14 -0.08 0.00 0.02 0.00 0.00 55.36 56.41 2nr2 s GLN 41 Cb 0.09 -2.40 0.02 0.00 1.00 0.00 0.00 33.01 31.73 2nr2 s GLN 41 CO 0.84 0.09 0.24 0.50 -2.12 0.00 0.00 175.29 174.84 2nr2 s ARG 42 N -2.80 0.27 -0.01 2.91 3.52 -0.64 -4.91 118.95 117.30 2nr2 s ARG 42 Ca 0.57 0.34 -0.00 0.00 -0.13 0.00 0.00 55.73 56.52 2nr2 s ARG 42 Cb -0.12 0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.35 2nr2 s ARG 42 CO 0.17 -0.04 0.06 -0.51 -0.81 0.00 0.00 175.30 174.17 2nr2 s LEU 43 N 0.19 3.82 -0.01 -0.88 1.43 -1.26 -1.05 118.68 120.93 2nr2 s LEU 43 Ca -0.01 0.12 0.08 0.00 -1.03 0.00 0.00 54.13 53.29 2nr2 s LEU 43 Cb -0.02 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 2nr2 s LEU 43 CO -0.00 0.28 -0.26 -0.63 0.23 0.00 0.00 176.35 175.97 2nr2 s ILE 44 N -1.17 2.11 -0.11 -0.59 -1.09 0.22 -1.43 121.20 119.14 2nr2 s ILE 44 Ca 0.22 -1.14 -0.08 0.00 -2.23 0.00 0.00 60.65 57.42 2nr2 s ILE 44 Cb -0.12 -1.74 0.04 0.00 -1.58 0.00 0.00 42.46 39.06 2nr2 s ILE 44 CO 0.13 0.55 0.28 0.12 -1.23 0.00 0.00 174.94 174.78 2nr2 s PHE 45 N -0.65 -0.34 0.00 3.97 5.36 -0.49 -1.35 117.98 124.49 2nr2 s PHE 45 Ca 0.10 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 2nr2 s PHE 45 Cb -0.10 0.10 0.00 0.00 -0.34 0.00 0.00 43.02 42.68 2nr2 s PHE 45 CO -0.00 -0.20 0.00 0.00 -1.46 0.00 0.00 175.22 173.56 2nr2 n ALA 46 N 3.58 0.00 0.00 11.12 0.00 -1.26 -1.71 120.51 132.24 2nr2 n ALA 46 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2nr2 n ALA 46 Cb 0.56 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.02 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 0.42 1.54 3.79 0.00 0.00 -1.26 -5.11 105.19 104.58 2nr2 n GLY 47 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.08 4.42 -0.20 1.61 1.02 -0.69 -5.03 119.74 120.79 2nr2 s LYS 48 Ca 0.00 1.27 -0.20 0.00 0.02 0.00 0.00 55.97 57.05 2nr2 s LYS 48 Cb 0.00 -2.56 -0.03 0.00 -0.52 0.00 0.00 37.83 34.73 2nr2 s LYS 48 CO 0.00 0.13 0.62 -0.65 -0.92 0.00 0.00 175.35 174.53 2nr2 s GLN 49 N -2.49 4.21 0.24 1.68 -0.21 -1.26 -1.39 119.66 120.44 2nr2 s GLN 49 Ca 0.55 0.59 -0.19 0.00 0.02 0.00 0.00 55.36 56.33 2nr2 s GLN 49 Cb -0.15 -3.58 -0.08 0.00 1.00 0.00 0.00 33.01 30.19 2nr2 s GLN 49 CO 0.20 -0.23 0.74 -0.51 -2.12 0.00 0.00 175.29 173.37 2nr2 s LEU 50 N 1.89 4.29 0.53 2.90 1.43 -0.52 -4.99 118.68 124.22 2nr2 s LEU 50 Ca 0.28 1.42 -0.16 0.00 -1.03 0.00 0.00 54.13 54.64 2nr2 s LEU 50 Cb -0.16 -3.69 -0.07 0.00 0.03 0.00 0.00 46.19 42.30 2nr2 s LEU 50 CO 0.10 -0.01 0.99 -1.61 0.23 0.00 0.00 176.35 176.05 2nr2 s GLU 51 N -2.15 3.87 -0.12 1.70 0.41 -1.26 -4.55 118.70 116.60 2nr2 s GLU 51 Ca 0.45 0.96 -0.23 0.00 -0.41 0.00 0.00 54.97 55.74 2nr2 s GLU 51 Cb -0.16 -2.12 -0.27 0.00 -1.78 0.00 0.00 34.13 29.80 2nr2 s GLU 51 CO 0.20 -0.33 0.67 -0.44 -0.49 0.00 0.00 175.26 174.87 2nr2 h ASP 52 N 0.79 0.20 -1.66 -0.19 3.32 -1.97 -3.36 116.42 113.55 2nr2 h ASP 52 Ca -0.47 -0.88 -0.74 0.00 0.02 0.00 0.00 57.03 54.97 2nr2 h ASP 52 Cb 1.19 -0.06 -0.20 0.00 0.22 0.00 0.00 39.33 40.47 2nr2 h ASP 52 CO 0.61 1.30 1.45 0.61 -1.72 0.00 0.00 179.24 181.49 2nr2 n GLY 53 N 1.62 5.49 3.18 2.75 0.00 -1.26 -0.78 105.19 116.19 2nr2 n GLY 53 Ca -0.17 -2.28 -0.11 0.00 0.00 0.00 0.00 46.02 43.45 2nr2 n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nr2 s ARG 54 N -2.80 0.96 0.13 1.61 3.52 -1.26 -4.99 118.95 116.12 2nr2 s ARG 54 Ca 0.49 -1.45 0.03 0.00 -0.13 0.00 0.00 55.73 54.67 2nr2 s ARG 54 Cb 0.25 0.05 -0.04 0.00 -1.56 0.00 0.00 34.95 33.65 2nr2 s ARG 54 CO -0.17 -0.19 0.22 0.95 -0.81 0.00 0.00 175.30 175.30 2nr2 s THR 55 N -3.89 5.08 0.19 4.11 -4.23 -1.26 -0.86 115.64 114.78 2nr2 s THR 55 Ca 0.22 -0.74 -0.12 0.00 -1.18 0.00 0.00 61.69 59.87 2nr2 s THR 55 Cb 0.07 -3.58 0.12 0.00 1.34 0.00 0.00 72.50 70.46 2nr2 s THR 55 CO 0.01 -0.05 1.71 -0.07 -0.54 0.00 0.00 174.62 175.69 2nr2 h LEU 56 N 2.43 -0.01 -2.43 4.79 3.38 -1.68 -2.77 115.31 119.02 2nr2 h LEU 56 Ca -0.48 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 2nr2 h LEU 56 Cb 1.19 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 2nr2 h LEU 56 CO 0.68 0.02 -0.02 0.77 0.09 0.00 0.00 178.44 179.98 2nr2 h SER 57 N 0.24 0.00 0.30 -0.43 4.64 -1.54 -2.10 113.55 114.66 2nr2 h SER 57 Ca 0.27 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.52 2nr2 h SER 57 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2nr2 h SER 57 CO -0.35 0.02 -0.31 -0.78 -0.87 0.00 0.00 176.83 174.54 2nr2 h ASP 58 N 0.00 0.02 0.84 4.97 3.58 -1.80 -2.40 116.42 121.63 2nr2 h ASP 58 Ca -0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2nr2 h ASP 58 Cb 0.06 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2nr2 h ASP 58 CO 0.00 0.33 -0.44 -1.22 -2.88 0.00 0.00 179.24 175.03 2nr2 n TYR 59 N -4.17 0.36 -3.10 0.28 4.01 -0.91 -4.99 117.16 108.64 2nr2 n TYR 59 Ca -0.02 0.10 -0.14 0.00 -0.16 0.00 0.00 57.90 57.69 2nr2 n TYR 59 Cb 0.36 -0.55 0.06 0.00 -0.31 0.00 0.00 39.34 38.90 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 -1.87 -3.50 -4.43 7.72 3.02 -0.84 -4.98 115.26 110.39 2nr2 n ASN 60 Ca 0.05 -0.39 -0.44 0.00 -0.03 0.00 0.00 54.58 53.77 2nr2 n ASN 60 Cb 0.39 -3.60 -0.08 0.00 -0.61 0.00 0.00 39.78 35.88 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 -3.23 5.14 0.66 2.41 1.01 -1.11 -5.03 121.20 121.05 2nr2 s ILE 61 Ca 0.20 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 60.04 2nr2 s ILE 61 Cb -0.09 -4.12 0.07 0.00 0.01 0.00 0.00 42.46 38.33 2nr2 s ILE 61 CO 0.49 -0.56 0.93 -1.10 0.00 0.00 0.00 174.94 174.70 2nr2 s GLN 62 N 1.93 2.16 0.27 2.79 -0.21 -1.26 -4.73 119.66 120.61 2nr2 s GLN 62 Ca 0.08 -0.63 -0.30 0.00 0.02 0.00 0.00 55.36 54.53 2nr2 s GLN 62 Cb -0.21 -2.31 -0.14 0.00 1.00 0.00 0.00 33.01 31.35 2nr2 s GLN 62 CO 0.09 -1.13 1.21 1.17 -2.12 0.00 0.00 175.29 174.52 2nr2 n LYS 63 N -2.72 1.71 -3.74 2.91 4.81 -1.26 -3.31 118.16 116.56 2nr2 n LYS 63 Ca 0.10 0.60 -0.26 0.00 -0.87 0.00 0.00 58.31 57.88 2nr2 n LYS 63 Cb 0.60 -2.13 0.05 0.00 0.02 0.00 0.00 35.03 33.58 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2nr2 n GLU 64 N 1.20 -6.52 -3.83 1.64 1.02 0.15 -5.00 120.64 109.29 2nr2 n GLU 64 Ca 0.10 0.71 -0.25 0.00 -0.02 0.00 0.00 57.16 57.69 2nr2 n GLU 64 Cb 0.32 -5.64 -0.03 0.00 -0.02 0.00 0.00 31.44 26.07 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 -3.47 6.34 -0.40 1.62 0.01 -1.21 -4.91 113.70 111.69 2nr2 s SER 65 Ca 0.54 0.24 -0.09 0.00 1.31 0.00 0.00 55.95 57.94 2nr2 s SER 65 Cb -0.25 -1.94 0.06 0.00 0.21 0.00 0.00 66.02 64.10 2nr2 s SER 65 CO 0.78 -0.03 0.22 -0.89 0.41 0.00 0.00 173.24 173.73 2nr2 s THR 66 N -1.88 4.19 0.42 1.44 2.01 -1.26 -2.01 115.64 118.54 2nr2 s THR 66 Ca 0.36 -1.28 0.02 0.00 0.31 0.00 0.00 61.69 61.10 2nr2 s THR 66 Cb -0.10 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 68.90 2nr2 s THR 66 CO 0.29 -0.41 0.62 -0.76 -0.69 0.00 0.00 174.62 173.67 2nr2 s LEU 67 N 1.44 3.74 -0.05 4.42 1.02 0.14 -4.73 118.68 124.66 2nr2 s LEU 67 Ca 0.02 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.35 2nr2 s LEU 67 Cb -0.22 -3.08 0.03 0.00 0.02 0.00 0.00 46.19 42.94 2nr2 s LEU 67 CO 0.03 -0.62 0.02 -1.00 0.02 0.00 0.00 176.35 174.80 2nr2 s HIS 68 N -2.46 0.39 -0.01 0.29 3.76 -0.45 -0.96 115.29 115.84 2nr2 s HIS 68 Ca 0.47 0.01 -0.22 0.00 -0.15 0.00 0.00 55.06 55.18 2nr2 s HIS 68 Cb -0.10 -0.61 -0.05 0.00 1.11 0.00 0.00 32.58 32.93 2nr2 s HIS 68 CO 0.36 -0.24 0.64 -1.17 -0.85 0.00 0.00 174.74 173.48 2nr2 s LEU 69 N 1.84 4.40 0.35 0.89 2.96 -0.03 0.73 118.68 129.81 2nr2 s LEU 69 Ca 0.02 1.20 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 2nr2 s LEU 69 Cb -0.12 -2.99 -0.05 0.00 0.50 0.00 0.00 46.19 43.53 2nr2 s LEU 69 CO -0.04 0.05 0.09 0.68 -1.32 0.00 0.00 176.35 175.81 2nr2 s VAL 70 N 0.04 0.84 0.08 1.68 -7.23 -0.21 -4.17 120.40 111.42 2nr2 s VAL 70 Ca 0.33 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 2nr2 s VAL 70 Cb -0.18 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 2nr2 s VAL 70 CO 0.18 0.00 -0.09 -0.76 -0.31 0.00 0.00 175.10 174.12 2nr2 s LEU 71 N -3.50 2.36 -0.15 1.32 1.43 -1.26 -1.62 118.68 117.25 2nr2 s LEU 71 Ca 0.32 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.39 2nr2 s LEU 71 Cb 0.06 -0.25 -0.06 0.00 0.03 0.00 0.00 46.19 45.97 2nr2 s LEU 71 CO 0.15 -0.25 2.04 -0.60 0.23 0.00 0.00 176.35 177.92 2nr2 s ARG 72 N -2.46 3.51 0.49 1.70 3.52 0.41 -4.95 118.95 121.17 2nr2 s ARG 72 Ca 0.01 2.11 -0.01 0.00 -0.13 0.00 0.00 55.73 57.70 2nr2 s ARG 72 Cb -0.05 -4.26 0.00 0.00 -1.56 0.00 0.00 34.95 29.09 2nr2 s ARG 72 CO -0.00 -1.66 0.74 -0.51 -0.81 0.00 0.00 175.30 173.06 2nr2 s LEU 73 N 6.73 3.52 0.54 -0.88 1.43 -1.26 -5.07 118.68 123.68 2nr2 s LEU 73 Ca 0.92 0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 54.42 2nr2 s LEU 73 Cb -0.34 -3.27 0.02 0.00 0.03 0.00 0.00 46.19 42.63 2nr2 s LEU 73 CO 0.36 -0.82 0.79 -0.13 0.23 0.00 0.00 176.35 176.78 2nr2 s ARG 74 N -4.69 2.72 0.00 1.70 0.52 -1.26 -4.58 118.95 113.36 2nr2 s ARG 74 Ca 0.50 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 55.19 2nr2 s ARG 74 Cb -0.10 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 32.92 2nr2 s ARG 74 CO 0.40 -0.63 0.00 0.41 0.02 0.00 0.00 175.30 175.50 2nr2 n GLY 75 N -2.36 1.74 0.00 -3.53 0.00 -1.26 -5.30 105.19 94.49 2nr2 n GLY 75 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93