#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 4.03 0.20 2.12 -0.21 -1.26 -0.55 119.66 123.98 2nr2 s GLN 2 Ca 0.00 0.13 0.05 0.00 0.02 0.00 0.00 55.36 55.56 2nr2 s GLN 2 Cb 0.00 -3.33 -0.05 0.00 1.00 0.00 0.00 33.01 30.63 2nr2 s GLN 2 CO 0.00 0.45 -0.07 0.96 -2.12 0.00 0.00 175.29 174.51 2nr2 s ILE 3 N -0.18 1.24 0.01 1.08 -4.36 -0.76 0.10 121.20 118.33 2nr2 s ILE 3 Ca 0.18 -2.08 0.06 0.00 -0.26 0.00 0.00 60.65 58.55 2nr2 s ILE 3 Cb -0.14 -2.12 -0.03 0.00 1.25 0.00 0.00 42.46 41.42 2nr2 s ILE 3 CO 0.06 -0.52 -0.16 -0.36 0.24 0.00 0.00 174.94 174.20 2nr2 s PHE 4 N -3.29 2.64 -0.21 1.37 0.08 -0.27 -1.17 117.98 117.14 2nr2 s PHE 4 Ca 0.23 -0.21 -0.03 0.00 0.12 0.00 0.00 56.93 57.05 2nr2 s PHE 4 Cb 0.03 -1.53 -0.00 0.00 -0.57 0.00 0.00 43.02 40.95 2nr2 s PHE 4 CO 0.06 0.24 -0.08 0.08 -0.10 0.00 0.00 175.22 175.41 2nr2 s VAL 5 N -0.87 3.08 -0.25 -0.44 1.01 -0.51 0.64 120.40 123.07 2nr2 s VAL 5 Ca 0.14 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.46 2nr2 s VAL 5 Cb -0.11 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2nr2 s VAL 5 CO 0.04 0.45 0.04 -0.75 0.00 0.00 0.00 175.10 174.89 2nr2 s LYS 6 N 1.41 3.52 0.61 2.72 2.20 -0.05 -1.06 119.74 129.09 2nr2 s LYS 6 Ca 0.05 -0.56 -0.08 0.00 -0.36 0.00 0.00 55.97 55.03 2nr2 s LYS 6 Cb -0.14 -3.26 -0.00 0.00 -1.51 0.00 0.00 37.83 32.92 2nr2 s LYS 6 CO -0.05 -0.22 0.95 0.95 -0.36 0.00 0.00 175.35 176.62 2nr2 s THR 7 N 1.57 3.89 0.33 3.43 -4.23 0.03 -1.24 115.64 119.43 2nr2 s THR 7 Ca 0.06 0.24 0.12 0.00 -1.18 0.00 0.00 61.69 60.93 2nr2 s THR 7 Cb -0.15 -3.56 0.38 0.00 1.34 0.00 0.00 72.50 70.50 2nr2 s THR 7 CO 0.02 -0.63 1.54 -0.11 -0.54 0.00 0.00 174.62 174.90 2nr2 n LEU 8 N -2.67 0.13 0.13 4.79 7.94 -0.75 0.10 117.00 126.67 2nr2 n LEU 8 Ca 0.05 1.64 0.03 0.00 -1.11 0.00 0.00 56.01 56.61 2nr2 n LEU 8 Cb 0.57 -0.71 0.02 0.00 0.53 0.00 0.00 43.42 43.83 2nr2 n LEU 8 CO 0.55 -1.76 0.40 0.71 -1.11 0.00 0.00 177.39 176.18 2nr2 h THR 9 N 0.00 0.79 0.00 1.96 1.35 -1.94 -3.48 112.91 111.59 2nr2 h THR 9 Ca 0.72 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 2nr2 h THR 9 Cb 1.75 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 70.52 2nr2 h THR 9 CO -0.83 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 175.50 2nr2 n GLY 10 N 1.24 1.88 3.66 5.82 0.00 0.11 -5.10 105.19 112.80 2nr2 n GLY 10 Ca 0.01 0.00 -0.39 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 -0.46 4.18 -0.32 1.61 2.20 -1.23 -4.83 119.74 120.89 2nr2 s LYS 11 Ca 0.00 0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 55.87 2nr2 s LYS 11 Cb 0.00 -3.55 0.03 0.00 -1.51 0.00 0.00 37.83 32.79 2nr2 s LYS 11 CO 0.00 -0.11 0.09 0.99 -0.36 0.00 0.00 175.35 175.96 2nr2 s THR 12 N 1.52 3.79 -0.18 3.43 2.01 -1.26 -0.79 115.64 124.17 2nr2 s THR 12 Ca 0.22 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 61.14 2nr2 s THR 12 Cb -0.15 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 2nr2 s THR 12 CO 0.09 -0.08 0.13 0.27 -0.69 0.00 0.00 174.62 174.34 2nr2 s ILE 13 N 1.43 5.39 -0.22 1.82 -4.36 -0.22 -4.98 121.20 120.06 2nr2 s ILE 13 Ca -0.00 0.18 -0.20 0.00 -0.26 0.00 0.00 60.65 60.37 2nr2 s ILE 13 Cb -0.19 -3.43 -0.03 0.00 1.25 0.00 0.00 42.46 40.07 2nr2 s ILE 13 CO 0.02 0.49 0.58 -0.89 0.24 0.00 0.00 174.94 175.38 2nr2 s THR 14 N 0.00 5.04 -0.04 8.37 2.01 -1.26 -1.42 115.64 128.34 2nr2 s THR 14 Ca 0.10 1.06 -0.01 0.00 0.31 0.00 0.00 61.69 63.15 2nr2 s THR 14 Cb -0.11 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 2nr2 s THR 14 CO -0.00 0.10 0.02 -0.76 -0.69 0.00 0.00 174.62 173.29 2nr2 s LEU 15 N 2.07 3.65 -0.24 4.42 2.01 -0.31 -5.00 118.68 125.28 2nr2 s LEU 15 Ca 0.25 0.11 -0.05 0.00 0.01 0.00 0.00 54.13 54.46 2nr2 s LEU 15 Cb -0.16 -1.98 -0.01 0.00 0.01 0.00 0.00 46.19 44.06 2nr2 s LEU 15 CO 0.09 0.33 -0.00 -0.70 1.01 0.00 0.00 176.35 177.08 2nr2 s GLU 16 N -1.27 3.32 0.13 1.70 -6.30 -1.26 -1.82 118.70 113.20 2nr2 s GLU 16 Ca 0.17 -0.67 0.04 0.00 -2.50 0.00 0.00 54.97 52.00 2nr2 s GLU 16 Cb -0.12 -3.13 -0.04 0.00 0.00 0.00 0.00 34.13 30.84 2nr2 s GLU 16 CO 0.07 -0.26 -0.09 0.14 0.02 0.00 0.00 175.26 175.14 2nr2 s VAL 17 N 1.49 1.02 0.32 3.70 -7.23 0.29 -4.93 120.40 115.07 2nr2 s VAL 17 Ca 0.05 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.16 2nr2 s VAL 17 Cb -0.15 -1.79 -0.05 0.00 0.56 0.00 0.00 36.38 34.95 2nr2 s VAL 17 CO -0.01 -0.78 0.58 -1.61 -0.31 0.00 0.00 175.10 172.97 2nr2 s GLU 18 N -3.76 3.60 0.00 4.82 0.41 -1.26 0.31 118.70 122.82 2nr2 s GLU 18 Ca 0.15 -0.03 0.19 0.00 -0.41 0.00 0.00 54.97 54.87 2nr2 s GLU 18 Cb 0.03 -2.62 0.85 0.00 -1.78 0.00 0.00 34.13 30.62 2nr2 s GLU 18 CO -0.01 0.15 1.61 -2.30 -0.49 0.00 0.00 175.26 174.22 2nr2 n PRO 19 N -1.25 0.06 0.21 0.39 -0.02 -1.26 -1.52 135.00 131.61 2nr2 n PRO 19 Ca -0.02 0.16 0.13 0.00 -2.02 0.00 0.00 63.50 61.74 2nr2 n PRO 19 Cb 0.54 -1.50 0.25 0.00 -0.02 0.00 0.00 33.50 32.78 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2nr2 h SER 20 N 0.00 0.00 -3.62 2.55 0.02 -1.97 -1.96 113.55 108.56 2nr2 h SER 20 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2nr2 h SER 20 Cb 0.30 0.00 0.09 0.00 0.14 0.00 0.00 62.40 62.93 2nr2 h SER 20 CO 0.00 0.00 0.82 -1.81 -1.14 0.00 0.00 176.83 174.70 2nr2 s ASP 21 N -5.89 6.39 0.71 3.07 1.01 -0.58 -4.78 116.67 116.59 2nr2 s ASP 21 Ca 0.07 2.97 -0.06 0.00 0.71 0.00 0.00 52.55 56.24 2nr2 s ASP 21 Cb 0.06 -2.65 0.08 0.00 1.01 0.00 0.00 42.92 41.42 2nr2 s ASP 21 CO 0.64 -0.87 1.01 0.42 0.21 0.00 0.00 175.17 176.58 2nr2 s THR 22 N -0.54 2.28 0.27 -1.27 -4.23 -1.26 -1.83 115.64 109.06 2nr2 s THR 22 Ca 0.58 -0.33 0.04 0.00 -1.18 0.00 0.00 61.69 60.79 2nr2 s THR 22 Cb -0.47 -2.95 0.03 0.00 1.34 0.00 0.00 72.50 70.45 2nr2 s THR 22 CO 0.55 0.00 1.68 0.40 -0.54 0.00 0.00 174.62 176.70 2nr2 h ILE 23 N -0.59 1.30 -0.78 2.99 1.08 -1.13 -1.63 117.51 118.75 2nr2 h ILE 23 Ca -0.43 -1.47 0.12 0.00 -0.39 0.00 0.00 64.86 62.69 2nr2 h ILE 23 Cb 1.30 1.58 -0.08 0.00 -3.07 0.00 0.00 36.82 36.54 2nr2 h ILE 23 CO 0.56 0.45 0.38 -0.08 -0.69 0.00 0.00 178.15 178.77 2nr2 h GLU 24 N 0.32 0.57 -0.63 2.37 4.81 -1.55 0.28 114.58 120.75 2nr2 h GLU 24 Ca 0.03 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2nr2 h GLU 24 Cb 0.80 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 2nr2 h GLU 24 CO 0.06 0.38 0.29 -0.91 -0.73 0.00 0.00 179.01 178.11 2nr2 h ASN 25 N 0.59 0.84 -0.25 1.04 -0.26 -1.67 -1.14 115.58 114.74 2nr2 h ASN 25 Ca 0.41 -0.14 0.03 0.00 -0.56 0.00 0.00 56.30 56.04 2nr2 h ASN 25 Cb 0.52 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.53 2nr2 h ASN 25 CO -0.33 0.74 0.04 0.58 -1.06 0.00 0.00 177.43 177.41 2nr2 h VAL 26 N 0.88 0.88 -0.64 2.81 2.07 -0.75 -2.48 116.25 119.02 2nr2 h VAL 26 Ca 0.22 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.78 2nr2 h VAL 26 Cb 0.14 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2nr2 h VAL 26 CO -0.03 0.02 0.42 0.11 0.02 0.00 0.00 177.57 178.12 2nr2 h LYS 27 N 0.14 0.50 -0.37 1.57 1.57 -0.12 -1.82 116.57 118.04 2nr2 h LYS 27 Ca 0.11 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 2nr2 h LYS 27 Cb 0.12 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2nr2 h LYS 27 CO -0.16 0.33 -0.13 0.00 -0.57 0.00 0.00 179.45 178.93 2nr2 h ALA 28 N 1.67 0.52 -0.46 3.86 0.00 -0.89 -2.63 119.26 121.33 2nr2 h ALA 28 Ca 0.29 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2nr2 h ALA 28 Cb 0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2nr2 h ALA 28 CO -0.09 0.41 0.30 0.87 0.00 0.00 0.00 179.25 180.75 2nr2 h LYS 29 N 0.55 0.60 -0.07 0.00 1.57 -0.99 -2.47 116.57 115.76 2nr2 h LYS 29 Ca 0.09 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.64 2nr2 h LYS 29 Cb 0.66 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 2nr2 h LYS 29 CO 0.04 0.40 -0.78 0.82 -0.57 0.00 0.00 179.45 179.37 2nr2 h ILE 30 N 0.62 1.38 -0.16 1.86 2.04 -1.33 -2.11 117.51 119.81 2nr2 h ILE 30 Ca 0.17 -2.20 -0.04 0.00 1.00 0.00 0.00 64.86 63.79 2nr2 h ILE 30 Cb -0.07 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 2nr2 h ILE 30 CO -0.04 0.66 -0.07 -0.61 0.00 0.00 0.00 178.15 178.10 2nr2 h GLN 31 N 0.28 0.24 0.00 2.37 4.15 -1.06 -0.22 115.11 120.87 2nr2 h GLN 31 Ca -0.04 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 2nr2 h GLN 31 Cb 1.37 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.02 2nr2 h GLN 31 CO 0.14 0.33 -0.03 -0.44 -1.93 0.00 0.00 178.83 176.89 2nr2 h ASP 32 N 0.24 0.00 0.05 -0.69 3.32 -1.46 -2.01 116.42 115.86 2nr2 h ASP 32 Ca 0.05 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.94 2nr2 h ASP 32 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2nr2 h ASP 32 CO 0.01 0.03 -0.81 0.50 -1.72 0.00 0.00 179.24 177.25 2nr2 h LYS 33 N 0.00 0.11 0.00 3.56 1.63 -0.64 -3.45 116.57 117.78 2nr2 h LYS 33 Ca -0.00 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 2nr2 h LYS 33 Cb 0.84 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.54 2nr2 h LYS 33 CO 0.00 1.09 -0.41 -1.91 -3.45 0.00 0.00 179.45 174.78 2nr2 n GLU 34 N -4.31 1.35 -0.41 1.90 4.07 -0.17 -5.08 120.64 118.01 2nr2 n GLU 34 Ca -0.20 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.90 2nr2 n GLU 34 Cb 0.70 -0.70 0.00 0.00 -0.06 0.00 0.00 31.44 31.37 2nr2 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2nr2 n GLY 35 N 1.65 0.87 2.88 8.31 0.00 -0.76 -5.03 105.19 113.12 2nr2 n GLY 35 Ca 0.00 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.27 1.06 0.77 -0.61 1.01 -1.26 -5.04 121.20 114.86 2nr2 s ILE 36 Ca 0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 59.94 2nr2 s ILE 36 Cb 0.00 -1.25 0.05 0.00 0.01 0.00 0.00 42.46 41.27 2nr2 s ILE 36 CO 0.00 0.12 1.09 -2.84 0.00 0.00 0.00 174.94 173.30 2nr2 s PRO 37 N 1.65 2.32 0.39 2.79 0.02 -1.26 -4.28 135.00 136.63 2nr2 s PRO 37 Ca 0.01 1.12 0.07 0.00 0.02 0.00 0.00 61.00 62.22 2nr2 s PRO 37 Cb -0.15 -1.91 0.81 0.00 0.02 0.00 0.00 34.50 33.27 2nr2 s PRO 37 CO -0.08 -1.59 2.01 -1.35 -0.33 0.00 0.00 177.00 175.66 2nr2 h PRO 38 N -1.09 0.64 -0.83 5.54 0.11 -1.93 -2.00 132.00 132.44 2nr2 h PRO 38 Ca -0.44 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 65.74 2nr2 h PRO 38 Cb 1.23 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 2nr2 h PRO 38 CO 0.52 0.42 0.54 -0.44 -0.21 0.00 0.00 178.00 178.84 2nr2 h ASP 39 N 0.65 0.69 0.97 -2.05 3.32 -1.98 -2.19 116.42 115.83 2nr2 h ASP 39 Ca 0.24 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2nr2 h ASP 39 Cb 0.13 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2nr2 h ASP 39 CO -0.07 0.40 -0.27 0.00 -1.72 0.00 0.00 179.24 177.58 2nr2 n GLN 40 N -4.52 0.14 -2.81 3.56 6.02 -0.76 -4.75 117.38 114.26 2nr2 n GLN 40 Ca 0.15 0.07 -0.42 0.00 -0.01 0.00 0.00 57.00 56.79 2nr2 n GLN 40 Cb 0.35 -1.62 -0.04 0.00 1.02 0.00 0.00 30.24 29.95 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 -3.07 3.95 -0.56 -1.09 -0.21 -0.82 -0.79 119.66 117.07 2nr2 s GLN 41 Ca 0.11 0.72 -0.06 0.00 0.02 0.00 0.00 55.36 56.15 2nr2 s GLN 41 Cb 0.16 -3.76 0.14 0.00 1.00 0.00 0.00 33.01 30.55 2nr2 s GLN 41 CO 0.63 -0.83 0.40 0.50 -2.12 0.00 0.00 175.29 173.87 2nr2 s ARG 42 N 3.33 2.55 -0.03 2.91 3.52 -0.74 -4.91 118.95 125.59 2nr2 s ARG 42 Ca 0.38 -2.13 -0.22 0.00 -0.13 0.00 0.00 55.73 53.62 2nr2 s ARG 42 Cb -0.13 -3.85 -0.05 0.00 -1.56 0.00 0.00 34.95 29.36 2nr2 s ARG 42 CO 0.15 -1.18 0.65 -0.51 -0.81 0.00 0.00 175.30 173.61 2nr2 s LEU 43 N 0.67 4.37 -0.08 -0.88 1.43 -1.26 -1.39 118.68 121.53 2nr2 s LEU 43 Ca 0.12 1.19 0.04 0.00 -1.03 0.00 0.00 54.13 54.44 2nr2 s LEU 43 Cb -0.21 -3.01 -0.01 0.00 0.03 0.00 0.00 46.19 42.98 2nr2 s LEU 43 CO -0.03 -0.01 -0.19 -0.63 0.23 0.00 0.00 176.35 175.72 2nr2 s ILE 44 N 0.29 2.53 -0.33 -0.59 -1.09 -0.07 -1.46 121.20 120.47 2nr2 s ILE 44 Ca 0.34 -0.88 -0.04 0.00 -2.23 0.00 0.00 60.65 57.85 2nr2 s ILE 44 Cb -0.18 -1.99 0.06 0.00 -1.58 0.00 0.00 42.46 38.77 2nr2 s ILE 44 CO 0.18 0.56 0.08 0.12 -1.23 0.00 0.00 174.94 174.65 2nr2 s PHE 45 N -0.05 3.31 0.00 3.97 5.36 -0.07 -1.40 117.98 129.11 2nr2 s PHE 45 Ca -0.05 -1.78 0.00 0.00 -0.96 0.00 0.00 56.93 54.13 2nr2 s PHE 45 Cb -0.14 -2.37 0.00 0.00 -0.34 0.00 0.00 43.02 40.16 2nr2 s PHE 45 CO 0.04 -0.81 0.00 0.00 -1.46 0.00 0.00 175.22 173.00 2nr2 n ALA 46 N 4.70 0.00 0.00 11.12 0.00 -1.26 -1.94 120.51 133.12 2nr2 n ALA 46 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2nr2 n ALA 46 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 3.92 0.00 0.00 -1.26 -5.05 105.19 102.80 2nr2 n GLY 47 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.99 3.54 -0.15 1.61 -2.85 -0.82 -5.09 119.74 113.99 2nr2 s LYS 48 Ca 0.00 -0.27 -0.16 0.00 -1.00 0.00 0.00 55.97 54.54 2nr2 s LYS 48 Cb 0.00 -2.78 -0.04 0.00 -2.06 0.00 0.00 37.83 32.95 2nr2 s LYS 48 CO 0.00 0.33 0.39 -1.14 0.10 0.00 0.00 175.35 175.04 2nr2 s GLN 49 N -3.49 4.28 0.24 1.78 0.74 -1.26 -0.89 119.66 121.06 2nr2 s GLN 49 Ca 0.40 0.27 -0.29 0.00 0.05 0.00 0.00 55.36 55.79 2nr2 s GLN 49 Cb -0.11 -3.45 -0.09 0.00 1.10 0.00 0.00 33.01 30.46 2nr2 s GLN 49 CO 0.30 0.15 0.92 -0.51 -0.55 0.00 0.00 175.29 175.60 2nr2 s LEU 50 N 0.71 4.60 0.44 3.68 1.43 -0.54 -4.95 118.68 124.05 2nr2 s LEU 50 Ca 0.21 1.90 -0.05 0.00 -1.03 0.00 0.00 54.13 55.16 2nr2 s LEU 50 Cb -0.14 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 2nr2 s LEU 50 CO 0.07 0.14 0.74 -1.61 0.23 0.00 0.00 176.35 175.92 2nr2 s GLU 51 N -1.29 3.56 -0.08 1.70 2.02 -1.26 -4.84 118.70 118.51 2nr2 s GLU 51 Ca 0.42 0.13 -0.26 0.00 0.02 0.00 0.00 54.97 55.28 2nr2 s GLU 51 Cb -0.25 -2.44 -0.22 0.00 0.10 0.00 0.00 34.13 31.33 2nr2 s GLU 51 CO 0.30 -0.11 0.96 -0.44 0.02 0.00 0.00 175.26 175.98 2nr2 h ASP 52 N 0.47 -0.02 -2.29 -0.19 5.19 -1.97 -3.33 116.42 114.28 2nr2 h ASP 52 Ca -0.47 -0.70 -0.80 0.00 -0.62 0.00 0.00 57.03 54.44 2nr2 h ASP 52 Cb 1.20 0.01 -0.26 0.00 0.18 0.00 0.00 39.33 40.46 2nr2 h ASP 52 CO 0.62 0.71 1.13 0.61 -3.12 0.00 0.00 179.24 179.19 2nr2 n GLY 53 N 0.96 5.79 3.37 2.75 0.00 -1.26 -1.53 105.19 115.26 2nr2 n GLY 53 Ca -0.09 -2.54 -0.25 0.00 0.00 0.00 0.00 46.02 43.14 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 -3.54 1.36 0.66 1.61 1.81 -1.25 -5.02 118.95 114.57 2nr2 s ARG 54 Ca 0.38 -1.41 -0.03 0.00 -1.72 0.00 0.00 55.73 52.95 2nr2 s ARG 54 Cb 0.15 -1.59 0.07 0.00 -0.45 0.00 0.00 34.95 33.13 2nr2 s ARG 54 CO -0.06 0.34 0.93 0.95 -0.68 0.00 0.00 175.30 176.78 2nr2 s THR 55 N -1.69 2.39 0.07 0.02 -4.23 -1.26 -2.37 115.64 108.57 2nr2 s THR 55 Ca 0.16 -0.48 0.09 0.00 -1.18 0.00 0.00 61.69 60.28 2nr2 s THR 55 Cb -0.08 -2.91 -0.18 0.00 1.34 0.00 0.00 72.50 70.68 2nr2 s THR 55 CO 0.07 0.00 1.23 -0.07 -0.54 0.00 0.00 174.62 175.32 2nr2 h LEU 56 N -0.37 0.00 -0.73 4.79 3.38 -1.33 -3.23 115.31 117.82 2nr2 h LEU 56 Ca -0.42 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.43 2nr2 h LEU 56 Cb 1.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2nr2 h LEU 56 CO 0.52 0.93 -0.35 -1.28 0.09 0.00 0.00 178.44 178.35 2nr2 h SER 57 N 0.00 0.59 0.28 -0.43 0.87 -1.64 -2.30 113.55 110.93 2nr2 h SER 57 Ca -0.04 -0.24 -0.04 0.00 -1.23 0.00 0.00 61.79 60.23 2nr2 h SER 57 Cb 1.74 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 63.53 2nr2 h SER 57 CO 0.12 0.90 -0.20 -0.78 -0.53 0.00 0.00 176.83 176.33 2nr2 h ASP 58 N 0.48 0.00 1.21 6.23 3.58 -1.86 -2.30 116.42 123.76 2nr2 h ASP 58 Ca 0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2nr2 h ASP 58 Cb 0.84 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.89 2nr2 h ASP 58 CO 0.07 0.20 -0.10 -1.22 -2.88 0.00 0.00 179.24 175.31 2nr2 n TYR 59 N -4.05 0.56 -1.73 0.28 4.01 -0.91 -4.91 117.16 110.42 2nr2 n TYR 59 Ca -0.02 0.16 -0.02 0.00 -0.16 0.00 0.00 57.90 57.86 2nr2 n TYR 59 Cb 0.28 -0.74 -0.00 0.00 -0.31 0.00 0.00 39.34 38.56 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 -1.98 -2.11 -4.62 7.72 3.02 -0.86 -4.99 115.26 111.44 2nr2 n ASN 60 Ca 0.06 0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 2nr2 n ASN 60 Cb 0.40 -0.99 -0.03 0.00 -0.61 0.00 0.00 39.78 38.56 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 -2.11 3.68 0.55 2.41 1.01 -0.92 -5.01 121.20 120.81 2nr2 s ILE 61 Ca 0.00 0.74 0.03 0.00 0.00 0.00 0.00 60.65 61.42 2nr2 s ILE 61 Cb 0.00 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.76 2nr2 s ILE 61 CO 0.00 -0.38 0.77 -1.10 0.00 0.00 0.00 174.94 174.23 2nr2 s GLN 62 N 4.92 2.44 0.51 2.79 -0.21 -1.26 -4.78 119.66 124.08 2nr2 s GLN 62 Ca 0.72 -1.01 -0.22 0.00 0.02 0.00 0.00 55.36 54.87 2nr2 s GLN 62 Cb -0.23 -2.53 -0.06 0.00 1.00 0.00 0.00 33.01 31.19 2nr2 s GLN 62 CO 0.30 -0.75 1.32 -1.59 -2.12 0.00 0.00 175.29 172.46 2nr2 s LYS 63 N -4.73 3.34 -1.44 2.91 -2.85 -1.26 -3.56 119.74 112.15 2nr2 s LYS 63 Ca 0.59 2.16 -0.09 0.00 -1.00 0.00 0.00 55.97 57.63 2nr2 s LYS 63 Cb -0.09 -2.34 0.02 0.00 -2.06 0.00 0.00 37.83 33.36 2nr2 s LYS 63 CO 0.38 -1.00 0.97 0.39 0.10 0.00 0.00 175.35 176.19 2nr2 n GLU 64 N -0.80 -6.59 -3.83 1.78 1.02 0.12 -4.98 120.64 107.36 2nr2 n GLU 64 Ca 0.09 0.80 -0.36 0.00 -0.02 0.00 0.00 57.16 57.67 2nr2 n GLU 64 Cb 0.45 -5.76 -0.06 0.00 -0.02 0.00 0.00 31.44 26.05 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 -3.13 6.44 -0.26 1.62 0.15 -1.23 -4.87 113.70 112.42 2nr2 s SER 65 Ca 0.52 0.51 -0.14 0.00 0.70 0.00 0.00 55.95 57.54 2nr2 s SER 65 Cb -0.24 -2.08 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 2nr2 s SER 65 CO 0.64 0.35 0.33 -0.89 1.20 0.00 0.00 173.24 174.87 2nr2 s THR 66 N -1.13 5.21 0.22 6.45 2.01 -1.26 -1.11 115.64 126.04 2nr2 s THR 66 Ca 0.20 0.49 0.05 0.00 0.31 0.00 0.00 61.69 62.74 2nr2 s THR 66 Cb -0.13 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2nr2 s THR 66 CO 0.09 0.20 0.29 -0.76 -0.69 0.00 0.00 174.62 173.76 2nr2 s LEU 67 N 1.84 4.16 -0.15 4.42 1.02 0.21 -4.81 118.68 125.37 2nr2 s LEU 67 Ca 0.14 -0.01 -0.00 0.00 0.02 0.00 0.00 54.13 54.27 2nr2 s LEU 67 Cb -0.15 -2.71 -0.01 0.00 0.02 0.00 0.00 46.19 43.34 2nr2 s LEU 67 CO 0.09 -0.03 -0.13 -1.00 0.02 0.00 0.00 176.35 175.30 2nr2 s HIS 68 N -1.97 2.82 -0.21 0.29 3.76 -0.49 -0.87 115.29 118.62 2nr2 s HIS 68 Ca 0.34 -0.77 -0.05 0.00 -0.15 0.00 0.00 55.06 54.42 2nr2 s HIS 68 Cb -0.09 -1.88 -0.02 0.00 1.11 0.00 0.00 32.58 31.69 2nr2 s HIS 68 CO 0.28 -0.31 0.01 -1.17 -0.85 0.00 0.00 174.74 172.69 2nr2 s LEU 69 N 0.58 3.25 -0.05 0.89 0.20 -0.37 -0.89 118.68 122.29 2nr2 s LEU 69 Ca -0.08 -0.21 -0.02 0.00 0.69 0.00 0.00 54.13 54.51 2nr2 s LEU 69 Cb -0.16 -1.83 -0.04 0.00 -0.43 0.00 0.00 46.19 43.74 2nr2 s LEU 69 CO 0.03 0.05 0.07 -0.69 -0.29 0.00 0.00 176.35 175.52 2nr2 s VAL 70 N 1.10 4.74 -0.44 1.68 1.01 -0.48 -1.81 120.40 126.20 2nr2 s VAL 70 Ca 0.03 -0.26 -0.27 0.00 0.00 0.00 0.00 61.98 61.48 2nr2 s VAL 70 Cb -0.14 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.16 2nr2 s VAL 70 CO 0.02 0.47 0.98 -0.22 0.00 0.00 0.00 175.10 176.35 2nr2 s LEU 71 N -1.37 3.91 -0.73 3.92 2.96 -1.26 -1.79 118.68 124.32 2nr2 s LEU 71 Ca 0.19 0.33 -0.26 0.00 -0.22 0.00 0.00 54.13 54.16 2nr2 s LEU 71 Cb -0.12 -3.31 0.01 0.00 0.50 0.00 0.00 46.19 43.28 2nr2 s LEU 71 CO 0.09 -1.06 1.49 -0.60 -1.32 0.00 0.00 176.35 174.95 2nr2 s ARG 72 N 3.87 3.03 -1.12 1.98 3.52 0.03 -4.96 118.95 125.30 2nr2 s ARG 72 Ca 0.40 -0.06 -0.13 0.00 -0.13 0.00 0.00 55.73 55.81 2nr2 s ARG 72 Cb -0.10 -4.37 0.20 0.00 -1.56 0.00 0.00 34.95 29.12 2nr2 s ARG 72 CO 0.26 -2.38 1.26 -1.17 -0.81 0.00 0.00 175.30 172.46 2nr2 s LEU 73 N 6.84 5.53 -0.03 -0.88 2.96 -1.26 -4.54 118.68 127.29 2nr2 s LEU 73 Ca 0.47 -3.01 -0.04 0.00 -0.22 0.00 0.00 54.13 51.33 2nr2 s LEU 73 Cb -0.09 -2.34 -0.02 0.00 0.50 0.00 0.00 46.19 44.24 2nr2 s LEU 73 CO 0.14 -0.65 0.28 -0.09 -1.32 0.00 0.00 176.35 174.71 2nr2 h ARG 74 N 7.30 -0.15 0.00 1.98 2.43 -1.93 -3.51 114.38 120.50 2nr2 h ARG 74 Ca 0.24 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2nr2 h ARG 74 Cb 0.91 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2nr2 h ARG 74 CO 1.13 -0.10 0.00 0.41 -1.51 0.00 0.00 179.97 179.90 2nr2 n GLY 75 N 1.18 4.80 0.00 2.80 0.00 -1.26 -5.26 105.19 107.45 2nr2 n GLY 75 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93