#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 4.29 0.09 2.12 -0.21 -1.26 -0.99 119.66 123.70 2nr2 s GLN 2 Ca 0.00 0.55 0.06 0.00 0.02 0.00 0.00 55.36 55.99 2nr2 s GLN 2 Cb 0.00 -3.39 -0.04 0.00 1.00 0.00 0.00 33.01 30.58 2nr2 s GLN 2 CO 0.00 0.26 -0.07 0.96 -2.12 0.00 0.00 175.29 174.32 2nr2 s ILE 3 N 0.24 3.56 -0.28 1.08 -4.36 0.69 -4.49 121.20 117.63 2nr2 s ILE 3 Ca 0.28 -1.14 -0.06 0.00 -0.26 0.00 0.00 60.65 59.47 2nr2 s ILE 3 Cb -0.16 -2.66 0.01 0.00 1.25 0.00 0.00 42.46 40.90 2nr2 s ILE 3 CO 0.13 0.15 0.06 -0.36 0.24 0.00 0.00 174.94 175.16 2nr2 s PHE 4 N -1.21 3.13 -0.28 1.37 0.08 -0.80 -0.50 117.98 119.77 2nr2 s PHE 4 Ca 0.22 -0.98 -0.11 0.00 0.12 0.00 0.00 56.93 56.18 2nr2 s PHE 4 Cb -0.11 -2.23 -0.05 0.00 -0.57 0.00 0.00 43.02 40.06 2nr2 s PHE 4 CO 0.14 -0.57 0.18 0.08 -0.10 0.00 0.00 175.22 174.95 2nr2 s VAL 5 N 1.49 5.25 -0.19 -0.44 1.01 0.25 -0.47 120.40 127.31 2nr2 s VAL 5 Ca 0.03 0.15 -0.09 0.00 0.00 0.00 0.00 61.98 62.07 2nr2 s VAL 5 Cb -0.17 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2nr2 s VAL 5 CO 0.02 0.26 0.10 -0.54 0.00 0.00 0.00 175.10 174.93 2nr2 s LYS 6 N 1.75 4.04 0.77 2.72 1.02 -0.28 0.17 119.74 129.93 2nr2 s LYS 6 Ca 0.07 -0.27 -0.10 0.00 0.02 0.00 0.00 55.97 55.69 2nr2 s LYS 6 Cb -0.16 -3.31 0.08 0.00 -0.52 0.00 0.00 37.83 33.92 2nr2 s LYS 6 CO 0.11 0.32 1.11 0.95 -0.92 0.00 0.00 175.35 176.92 2nr2 s THR 7 N 0.28 2.12 0.02 2.17 -4.23 0.27 -1.68 115.64 114.59 2nr2 s THR 7 Ca 0.06 -0.13 0.10 0.00 -1.18 0.00 0.00 61.69 60.55 2nr2 s THR 7 Cb -0.12 -2.99 -0.09 0.00 1.34 0.00 0.00 72.50 70.64 2nr2 s THR 7 CO -0.01 0.00 1.36 0.25 -0.54 0.00 0.00 174.62 175.68 2nr2 h LEU 8 N -0.89 0.00 0.00 4.79 5.85 -1.87 -3.38 115.31 119.82 2nr2 h LEU 8 Ca -0.45 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 2nr2 h LEU 8 Cb 1.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.35 2nr2 h LEU 8 CO 0.61 0.79 -0.00 0.71 -0.34 0.00 0.00 178.44 180.21 2nr2 h THR 9 N 0.00 1.60 0.00 1.05 1.35 -1.94 -3.48 112.91 111.49 2nr2 h THR 9 Ca -0.01 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 2nr2 h THR 9 Cb 1.59 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 70.84 2nr2 h THR 9 CO 0.10 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 2nr2 n GLY 10 N 1.00 0.00 3.04 5.82 0.00 -1.26 -5.18 105.19 108.62 2nr2 n GLY 10 Ca -0.09 0.00 -0.14 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 0.52 -0.24 1.61 2.20 -1.26 -4.96 119.74 117.61 2nr2 s LYS 11 Ca 0.00 -0.62 -0.13 0.00 -0.36 0.00 0.00 55.97 54.85 2nr2 s LYS 11 Cb 0.00 -0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 35.93 2nr2 s LYS 11 CO 0.00 0.07 0.30 0.99 -0.36 0.00 0.00 175.35 176.35 2nr2 s THR 12 N -1.06 5.25 -0.23 3.43 2.01 -1.26 -0.56 115.64 123.22 2nr2 s THR 12 Ca -0.07 0.45 -0.00 0.00 0.31 0.00 0.00 61.69 62.38 2nr2 s THR 12 Cb -0.08 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.83 2nr2 s THR 12 CO 0.00 0.25 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.44 2nr2 s ILE 13 N 1.54 2.54 -0.52 1.82 1.01 0.12 -4.94 121.20 122.78 2nr2 s ILE 13 Ca 0.13 -1.08 -0.19 0.00 0.00 0.00 0.00 60.65 59.51 2nr2 s ILE 13 Cb -0.15 -2.26 0.07 0.00 0.01 0.00 0.00 42.46 40.13 2nr2 s ILE 13 CO 0.08 0.27 0.62 -0.89 0.00 0.00 0.00 174.94 175.02 2nr2 s THR 14 N 1.28 4.89 -0.06 2.92 2.01 -1.26 -0.59 115.64 124.84 2nr2 s THR 14 Ca 0.00 -0.61 -0.10 0.00 0.31 0.00 0.00 61.69 61.29 2nr2 s THR 14 Cb -0.16 -4.32 -0.05 0.00 0.01 0.00 0.00 72.50 67.99 2nr2 s THR 14 CO -0.07 -0.84 0.25 -0.76 -0.69 0.00 0.00 174.62 172.51 2nr2 s LEU 15 N 2.56 4.42 -0.34 4.42 1.43 0.34 -4.87 118.68 126.65 2nr2 s LEU 15 Ca 0.14 0.66 -0.20 0.00 -1.03 0.00 0.00 54.13 53.70 2nr2 s LEU 15 Cb -0.20 -2.32 -0.00 0.00 0.03 0.00 0.00 46.19 43.70 2nr2 s LEU 15 CO 0.11 0.36 0.61 -1.61 0.23 0.00 0.00 176.35 176.05 2nr2 s GLU 16 N -1.12 3.72 0.08 1.70 2.02 -1.26 -0.22 118.70 123.62 2nr2 s GLU 16 Ca 0.19 0.07 0.04 0.00 0.02 0.00 0.00 54.97 55.29 2nr2 s GLU 16 Cb -0.14 -3.79 -0.03 0.00 0.10 0.00 0.00 34.13 30.27 2nr2 s GLU 16 CO 0.09 -0.67 -0.10 0.14 0.02 0.00 0.00 175.26 174.73 2nr2 s VAL 17 N 2.62 0.87 0.30 2.63 -7.23 -0.16 -4.91 120.40 114.51 2nr2 s VAL 17 Ca 0.23 -1.41 -0.07 0.00 -1.81 0.00 0.00 61.98 58.93 2nr2 s VAL 17 Cb -0.15 -1.09 -0.06 0.00 0.56 0.00 0.00 36.38 35.65 2nr2 s VAL 17 CO 0.14 -0.43 0.60 -1.61 -0.31 0.00 0.00 175.10 173.48 2nr2 s GLU 18 N -2.22 3.70 0.00 4.82 0.41 -1.26 -0.06 118.70 124.09 2nr2 s GLU 18 Ca -0.01 0.16 0.28 0.00 -0.41 0.00 0.00 54.97 54.99 2nr2 s GLU 18 Cb -0.06 -2.59 1.43 0.00 -1.78 0.00 0.00 34.13 31.12 2nr2 s GLU 18 CO 0.01 0.19 1.95 -0.35 -0.49 0.00 0.00 175.26 176.56 2nr2 n PRO 19 N -0.84 1.28 0.07 0.39 -0.04 -1.26 -2.34 135.00 132.26 2nr2 n PRO 19 Ca -0.00 -0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.17 2nr2 n PRO 19 Cb 0.54 -1.46 0.24 0.00 -0.04 0.00 0.00 33.50 32.78 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 -0.48 0.73 -4.86 3.54 3.41 -1.26 -0.40 113.62 114.30 2nr2 n SER 20 Ca 0.20 0.25 -0.31 0.00 -0.26 0.00 0.00 58.87 58.75 2nr2 n SER 20 Cb 0.20 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.01 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 -4.30 6.49 0.87 4.04 1.01 -0.99 -4.73 116.67 119.07 2nr2 s ASP 21 Ca 0.08 1.37 -0.13 0.00 0.71 0.00 0.00 52.55 54.57 2nr2 s ASP 21 Cb 0.13 -2.43 0.12 0.00 1.01 0.00 0.00 42.92 41.75 2nr2 s ASP 21 CO 0.68 -0.59 1.18 0.42 0.21 0.00 0.00 175.17 177.08 2nr2 s THR 22 N -2.67 1.99 0.14 -1.27 -4.23 -1.26 -0.41 115.64 107.93 2nr2 s THR 22 Ca 0.55 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.20 2nr2 s THR 22 Cb -0.10 -2.90 0.02 0.00 1.34 0.00 0.00 72.50 70.85 2nr2 s THR 22 CO 0.37 0.00 1.58 0.40 -0.54 0.00 0.00 174.62 176.42 2nr2 h ILE 23 N -1.31 1.19 -0.91 2.99 1.08 -1.19 -2.46 117.51 116.90 2nr2 h ILE 23 Ca -0.47 -2.13 0.12 0.00 -0.39 0.00 0.00 64.86 61.98 2nr2 h ILE 23 Cb 1.32 2.22 -0.08 0.00 -3.07 0.00 0.00 36.82 37.21 2nr2 h ILE 23 CO 0.61 0.56 0.54 -0.08 -0.69 0.00 0.00 178.15 179.09 2nr2 h GLU 24 N 0.00 0.83 -0.55 2.37 4.81 -1.07 0.50 114.58 121.48 2nr2 h GLU 24 Ca -0.01 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 1.18 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 2nr2 h GLU 24 CO 0.07 0.55 0.34 -0.97 -0.73 0.00 0.00 179.01 178.27 2nr2 h ASN 25 N 0.86 0.65 0.01 1.04 -0.73 -1.73 0.43 115.58 116.12 2nr2 h ASN 25 Ca 0.45 -0.05 -0.00 0.00 1.87 0.00 0.00 56.30 58.57 2nr2 h ASN 25 Cb 0.47 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.90 2nr2 h ASN 25 CO -0.27 0.51 -0.01 0.58 -0.37 0.00 0.00 177.43 177.87 2nr2 h VAL 26 N 0.74 0.99 -0.60 2.57 2.07 -1.13 -0.06 116.25 120.82 2nr2 h VAL 26 Ca 0.20 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.65 2nr2 h VAL 26 Cb -0.03 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2nr2 h VAL 26 CO -0.04 0.00 0.14 0.11 0.02 0.00 0.00 177.57 177.81 2nr2 h LYS 27 N -0.02 0.97 -0.77 1.57 1.57 -0.62 -2.34 116.57 116.93 2nr2 h LYS 27 Ca -0.00 -0.24 0.17 0.00 -1.87 0.00 0.00 60.65 58.71 2nr2 h LYS 27 Cb 0.02 -0.13 -0.11 0.00 0.08 0.00 0.00 32.23 32.09 2nr2 h LYS 27 CO 0.00 0.89 0.22 0.00 -0.57 0.00 0.00 179.45 179.99 2nr2 h ALA 28 N 1.04 1.05 -0.81 3.86 0.00 -0.06 -0.51 119.26 123.83 2nr2 h ALA 28 Ca 0.19 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 2nr2 h ALA 28 Cb 0.36 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2nr2 h ALA 28 CO 0.00 -0.33 0.36 0.87 0.00 0.00 0.00 179.25 180.15 2nr2 h LYS 29 N 0.30 1.18 0.00 0.00 1.57 -0.82 -1.79 116.57 117.01 2nr2 h LYS 29 Ca 0.44 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 2nr2 h LYS 29 Cb 0.77 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 2nr2 h LYS 29 CO -0.52 0.93 -0.10 0.82 -0.57 0.00 0.00 179.45 180.01 2nr2 h ILE 30 N 1.16 0.66 0.06 1.86 2.04 -0.71 0.29 117.51 122.86 2nr2 h ILE 30 Ca 0.27 -0.42 -0.25 0.00 1.00 0.00 0.00 64.86 65.46 2nr2 h ILE 30 Cb 0.16 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2nr2 h ILE 30 CO -0.03 0.10 -1.08 -0.61 0.00 0.00 0.00 178.15 176.53 2nr2 h GLN 31 N 0.00 0.36 -0.58 2.37 4.15 -0.93 0.21 115.11 120.69 2nr2 h GLN 31 Ca -0.00 -0.47 0.00 0.00 0.77 0.00 0.00 58.65 58.96 2nr2 h GLN 31 Cb 0.25 0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 2nr2 h GLN 31 CO 0.01 1.16 0.37 0.22 -1.93 0.00 0.00 178.83 178.66 2nr2 h ASP 32 N 0.16 0.68 0.11 -0.69 3.58 -0.40 -3.03 116.42 116.83 2nr2 h ASP 32 Ca -0.11 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.30 2nr2 h ASP 32 Cb 1.75 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.63 2nr2 h ASP 32 CO 0.18 0.51 -0.06 0.50 -2.88 0.00 0.00 179.24 177.50 2nr2 h LYS 33 N 0.78 -0.15 0.01 0.28 1.63 -0.30 -3.44 116.57 115.39 2nr2 h LYS 33 Ca 0.21 0.01 -0.36 0.00 -0.85 0.00 0.00 60.65 59.66 2nr2 h LYS 33 Cb -0.06 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.55 2nr2 h LYS 33 CO -0.04 -0.10 -1.98 0.39 -3.45 0.00 0.00 179.45 174.27 2nr2 n GLU 34 N -3.03 0.60 0.00 1.90 -0.58 0.68 -5.04 120.64 115.16 2nr2 n GLU 34 Ca -0.02 0.38 0.00 0.00 -0.42 0.00 0.00 57.16 57.10 2nr2 n GLU 34 Cb 0.06 -1.61 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 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 1.45 1.16 3.72 0.62 0.00 -0.80 -5.01 105.19 106.33 2nr2 n GLY 35 Ca -0.43 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.21 3.57 0.60 -0.61 -1.09 -1.26 -4.85 121.20 116.35 2nr2 s ILE 36 Ca 0.00 1.21 -0.18 0.00 -2.23 0.00 0.00 60.65 59.45 2nr2 s ILE 36 Cb 0.00 -3.77 -0.03 0.00 -1.58 0.00 0.00 42.46 37.08 2nr2 s ILE 36 CO 0.00 0.14 1.14 -2.16 -1.23 0.00 0.00 174.94 172.83 2nr2 s PRO 37 N 0.50 3.05 0.54 2.79 0.04 -1.26 -3.99 135.00 136.67 2nr2 s PRO 37 Ca 0.58 1.61 0.27 0.00 0.04 0.00 0.00 61.00 63.50 2nr2 s PRO 37 Cb -0.33 -1.96 1.56 0.00 0.04 0.00 0.00 34.50 33.80 2nr2 s PRO 37 CO 0.33 -1.09 2.14 -1.35 0.04 0.00 0.00 177.00 177.07 2nr2 h PRO 38 N 0.73 0.00 -0.71 0.56 0.11 -1.93 -2.04 132.00 128.71 2nr2 h PRO 38 Ca -0.49 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2nr2 h PRO 38 Cb 1.27 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 2nr2 h PRO 38 CO 0.55 0.08 0.43 0.22 -0.21 0.00 0.00 178.00 179.07 2nr2 h ASP 39 N 0.00 0.86 1.64 -2.05 1.82 -1.98 -2.50 116.42 114.20 2nr2 h ASP 39 Ca -0.00 -0.06 -0.05 0.00 -0.39 0.00 0.00 57.03 56.52 2nr2 h ASP 39 Cb 0.20 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.98 2nr2 h ASP 39 CO 0.01 0.67 -0.26 -0.61 -1.61 0.00 0.00 179.24 177.44 2nr2 h GLN 40 N 0.97 0.00 -6.04 0.28 4.15 -1.70 -3.46 115.11 109.31 2nr2 h GLN 40 Ca 0.26 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 59.11 2nr2 h GLN 40 Cb -0.03 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 27.60 2nr2 h GLN 40 CO -0.05 0.26 0.15 -0.65 -1.93 0.00 0.00 178.83 176.61 2nr2 s GLN 41 N -3.14 4.42 -0.22 1.69 -0.21 -0.94 -0.76 119.66 120.49 2nr2 s GLN 41 Ca 0.05 0.93 -0.01 0.00 0.02 0.00 0.00 55.36 56.35 2nr2 s GLN 41 Cb 0.07 -3.47 0.02 0.00 1.00 0.00 0.00 33.01 30.63 2nr2 s GLN 41 CO 0.70 -0.00 -0.10 1.03 -2.12 0.00 0.00 175.29 174.79 2nr2 s ARG 42 N 1.01 2.96 -0.18 2.91 0.52 0.21 -4.95 118.95 121.43 2nr2 s ARG 42 Ca 0.38 -0.88 -0.14 0.00 -0.52 0.00 0.00 55.73 54.57 2nr2 s ARG 42 Cb -0.18 -2.86 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 2nr2 s ARG 42 CO 0.18 -0.31 0.30 -0.51 0.02 0.00 0.00 175.30 174.98 2nr2 s LEU 43 N 1.33 4.20 -0.06 2.53 1.43 -1.26 -1.26 118.68 125.59 2nr2 s LEU 43 Ca 0.02 0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 2nr2 s LEU 43 Cb -0.15 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 2nr2 s LEU 43 CO -0.07 0.05 0.00 -0.63 0.23 0.00 0.00 176.35 175.93 2nr2 s ILE 44 N 0.77 4.25 -0.18 -0.59 -1.09 0.14 -0.90 121.20 123.60 2nr2 s ILE 44 Ca 0.16 -0.35 -0.05 0.00 -2.23 0.00 0.00 60.65 58.18 2nr2 s ILE 44 Cb -0.13 -2.82 0.07 0.00 -1.58 0.00 0.00 42.46 37.99 2nr2 s ILE 44 CO 0.05 0.54 0.11 0.12 -1.23 0.00 0.00 174.94 174.52 2nr2 s PHE 45 N -0.94 0.14 0.00 3.97 5.36 -0.77 -1.39 117.98 124.35 2nr2 s PHE 45 Ca 0.15 -0.28 0.00 0.00 -0.96 0.00 0.00 56.93 55.84 2nr2 s PHE 45 Cb -0.11 -0.66 0.00 0.00 -0.34 0.00 0.00 43.02 41.90 2nr2 s PHE 45 CO 0.05 -0.54 0.00 0.00 -1.46 0.00 0.00 175.22 173.27 2nr2 n ALA 46 N 5.28 0.00 0.00 11.12 0.00 -1.26 -2.67 120.51 132.99 2nr2 n ALA 46 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2nr2 n ALA 46 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 3.87 0.00 0.00 -1.26 -5.12 105.19 102.68 2nr2 n GLY 47 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.13 3.83 -0.10 1.61 -2.85 -1.09 -5.04 119.74 114.97 2nr2 s LYS 48 Ca 0.00 0.36 -0.25 0.00 -1.00 0.00 0.00 55.97 55.08 2nr2 s LYS 48 Cb 0.00 -2.58 -0.03 0.00 -2.06 0.00 0.00 37.83 33.17 2nr2 s LYS 48 CO 0.00 0.24 0.80 -1.14 0.10 0.00 0.00 175.35 175.35 2nr2 s GLN 49 N -3.00 4.40 0.37 1.78 0.74 -1.26 -1.85 119.66 120.83 2nr2 s GLN 49 Ca 0.49 1.02 -0.20 0.00 0.05 0.00 0.00 55.36 56.71 2nr2 s GLN 49 Cb -0.11 -3.50 -0.10 0.00 1.10 0.00 0.00 33.01 30.40 2nr2 s GLN 49 CO 0.22 -0.12 0.88 -0.51 -0.55 0.00 0.00 175.29 175.21 2nr2 s LEU 50 N 1.39 4.08 0.07 3.68 1.43 -0.08 -5.01 118.68 124.24 2nr2 s LEU 50 Ca 0.40 1.59 -0.03 0.00 -1.03 0.00 0.00 54.13 55.07 2nr2 s LEU 50 Cb -0.18 -4.24 -0.05 0.00 0.03 0.00 0.00 46.19 41.75 2nr2 s LEU 50 CO 0.17 -0.23 0.27 -1.61 0.23 0.00 0.00 176.35 175.18 2nr2 s GLU 51 N -2.81 3.52 0.02 1.70 0.41 -1.26 -4.71 118.70 115.56 2nr2 s GLU 51 Ca 0.56 -0.26 -0.12 0.00 -0.41 0.00 0.00 54.97 54.73 2nr2 s GLU 51 Cb -0.12 -3.00 -0.07 0.00 -1.78 0.00 0.00 34.13 29.17 2nr2 s GLU 51 CO 0.17 0.58 1.15 -0.44 -0.49 0.00 0.00 175.26 176.23 2nr2 h ASP 52 N 3.23 -0.38 0.00 -0.19 5.19 -1.97 -3.22 116.42 119.08 2nr2 h ASP 52 Ca -0.47 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2nr2 h ASP 52 Cb 1.17 0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2nr2 h ASP 52 CO 0.73 -0.26 0.00 0.61 -3.12 0.00 0.00 179.24 177.19 2nr2 n GLY 53 N -1.12 1.04 3.61 2.75 0.00 -1.26 -0.53 105.19 109.69 2nr2 n GLY 53 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 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 0.66 2.11 0.57 1.61 1.81 -1.22 -5.02 118.95 119.48 2nr2 s ARG 54 Ca 0.00 -1.60 -0.11 0.00 -1.72 0.00 0.00 55.73 52.29 2nr2 s ARG 54 Cb 0.00 -2.01 -0.05 0.00 -0.45 0.00 0.00 34.95 32.44 2nr2 s ARG 54 CO 0.00 0.26 0.98 0.95 -0.68 0.00 0.00 175.30 176.81 2nr2 s THR 55 N -2.43 4.70 0.38 0.02 -4.23 -1.26 -2.21 115.64 110.60 2nr2 s THR 55 Ca 0.33 0.85 0.27 0.00 -1.18 0.00 0.00 61.69 61.95 2nr2 s THR 55 Cb -0.04 -3.83 0.28 0.00 1.34 0.00 0.00 72.50 70.25 2nr2 s THR 55 CO 0.19 -0.99 2.03 -0.07 -0.54 0.00 0.00 174.62 175.24 2nr2 h LEU 56 N 0.07 0.00 0.00 4.79 3.38 -0.80 -2.41 115.31 120.34 2nr2 h LEU 56 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2nr2 h LEU 56 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2nr2 h LEU 56 CO 0.62 0.14 -0.20 -1.54 0.09 0.00 0.00 178.44 177.55 2nr2 n SER 57 N -3.62 0.33 0.30 -0.43 3.41 0.46 -2.37 113.62 111.70 2nr2 n SER 57 Ca -0.02 0.28 -0.16 0.00 -0.26 0.00 0.00 58.87 58.71 2nr2 n SER 57 Cb 0.27 -0.28 -0.08 0.00 -0.26 0.00 0.00 64.21 63.85 2nr2 n SER 57 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2nr2 h ASP 58 N 0.00 -0.61 1.14 4.04 1.82 -1.72 -3.23 116.42 117.86 2nr2 h ASP 58 Ca 0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 2nr2 h ASP 58 Cb 0.56 0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.73 2nr2 h ASP 58 CO 0.00 -0.37 0.00 -1.22 -1.61 0.00 0.00 179.24 176.04 2nr2 n TYR 59 N -5.37 0.68 -3.27 0.28 4.01 -1.20 -4.98 117.16 107.31 2nr2 n TYR 59 Ca -0.12 0.22 -0.12 0.00 -0.16 0.00 0.00 57.90 57.72 2nr2 n TYR 59 Cb 0.32 -0.85 0.03 0.00 -0.31 0.00 0.00 39.34 38.53 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 -2.07 -6.81 -4.57 7.72 3.02 -1.00 -4.95 115.26 106.59 2nr2 n ASN 60 Ca 0.05 -0.52 -0.42 0.00 -0.03 0.00 0.00 54.58 53.67 2nr2 n ASN 60 Cb 0.35 -4.76 -0.03 0.00 -0.61 0.00 0.00 39.78 34.73 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 3.87 0.94 2.41 -1.09 -1.09 -5.02 121.20 118.00 2nr2 s ILE 61 Ca 0.25 0.72 -0.12 0.00 -2.23 0.00 0.00 60.65 59.27 2nr2 s ILE 61 Cb -0.05 -4.65 0.16 0.00 -1.58 0.00 0.00 42.46 36.34 2nr2 s ILE 61 CO 0.77 -1.37 1.12 0.00 -1.23 0.00 0.00 174.94 174.23 2nr2 s GLN 62 N 5.33 0.88 0.28 2.79 -2.07 -1.26 -4.94 119.66 120.67 2nr2 s GLN 62 Ca 0.45 0.35 -0.30 0.00 -1.82 0.00 0.00 55.36 54.04 2nr2 s GLN 62 Cb -0.09 -1.80 -0.13 0.00 -1.09 0.00 0.00 33.01 29.90 2nr2 s GLN 62 CO 0.23 -2.39 1.40 1.63 -1.32 0.00 0.00 175.29 174.85 2nr2 n LYS 63 N -3.91 2.15 -2.94 9.60 5.02 -1.26 -3.44 118.16 123.39 2nr2 n LYS 63 Ca 0.06 0.76 -0.11 0.00 -2.02 0.00 0.00 58.31 57.00 2nr2 n LYS 63 Cb 0.59 -2.41 0.03 0.00 -0.02 0.00 0.00 35.03 33.22 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2nr2 n GLU 64 N 1.63 -3.53 -3.37 1.97 1.02 -1.26 -5.02 120.64 112.08 2nr2 n GLU 64 Ca 0.09 0.41 -0.37 0.00 -0.02 0.00 0.00 57.16 57.28 2nr2 n GLU 64 Cb 0.33 -4.19 -0.06 0.00 -0.02 0.00 0.00 31.44 27.50 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 -3.08 6.90 -0.32 1.62 0.01 -1.22 -4.95 113.70 112.64 2nr2 s SER 65 Ca 0.25 1.10 -0.12 0.00 1.31 0.00 0.00 55.95 58.50 2nr2 s SER 65 Cb -0.11 -2.30 -0.03 0.00 0.21 0.00 0.00 66.02 63.79 2nr2 s SER 65 CO 0.31 0.21 0.22 -0.89 0.41 0.00 0.00 173.24 173.51 2nr2 s THR 66 N -1.26 5.25 0.11 1.44 2.01 -1.26 -1.90 115.64 120.03 2nr2 s THR 66 Ca 0.32 -0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.21 2nr2 s THR 66 Cb -0.17 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 2nr2 s THR 66 CO 0.18 0.06 0.23 -0.76 -0.69 0.00 0.00 174.62 173.65 2nr2 s LEU 67 N 1.73 4.29 -0.09 4.42 1.02 0.38 -4.78 118.68 125.64 2nr2 s LEU 67 Ca 0.06 0.18 0.04 0.00 0.02 0.00 0.00 54.13 54.44 2nr2 s LEU 67 Cb -0.17 -2.88 0.00 0.00 0.02 0.00 0.00 46.19 43.16 2nr2 s LEU 67 CO 0.10 0.11 -0.23 -1.00 0.02 0.00 0.00 176.35 175.35 2nr2 s HIS 68 N -1.63 2.43 -0.24 0.29 3.76 -0.48 -1.12 115.29 118.30 2nr2 s HIS 68 Ca 0.34 -0.96 -0.04 0.00 -0.15 0.00 0.00 55.06 54.25 2nr2 s HIS 68 Cb -0.12 -1.63 0.00 0.00 1.11 0.00 0.00 32.58 31.94 2nr2 s HIS 68 CO 0.28 -0.39 -0.03 -1.17 -0.85 0.00 0.00 174.74 172.58 2nr2 s LEU 69 N 0.32 3.09 0.44 0.89 2.96 -0.68 0.26 118.68 125.97 2nr2 s LEU 69 Ca -0.17 -0.54 0.07 0.00 -0.22 0.00 0.00 54.13 53.26 2nr2 s LEU 69 Cb -0.17 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2nr2 s LEU 69 CO 0.08 -0.07 0.23 0.68 -1.32 0.00 0.00 176.35 175.95 2nr2 s VAL 70 N 1.45 2.15 0.09 1.68 -7.23 -0.39 -2.91 120.40 115.23 2nr2 s VAL 70 Ca 0.04 -1.64 0.07 0.00 -1.81 0.00 0.00 61.98 58.64 2nr2 s VAL 70 Cb -0.15 -2.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 2nr2 s VAL 70 CO -0.03 0.00 -0.18 -0.76 -0.31 0.00 0.00 175.10 173.83 2nr2 s LEU 71 N -4.00 2.29 -0.40 1.32 1.43 -1.26 -0.62 118.68 117.45 2nr2 s LEU 71 Ca 0.38 -0.66 -0.16 0.00 -1.03 0.00 0.00 54.13 52.67 2nr2 s LEU 71 Cb 0.02 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.55 2nr2 s LEU 71 CO 0.22 -0.01 0.35 -0.60 0.23 0.00 0.00 176.35 176.54 2nr2 s ARG 72 N -1.86 3.15 0.62 1.70 3.52 0.06 -4.92 118.95 121.21 2nr2 s ARG 72 Ca 0.03 -0.81 -0.12 0.00 -0.13 0.00 0.00 55.73 54.70 2nr2 s ARG 72 Cb -0.10 -3.94 -0.04 0.00 -1.56 0.00 0.00 34.95 29.32 2nr2 s ARG 72 CO 0.03 -0.73 1.03 -0.51 -0.81 0.00 0.00 175.30 174.32 2nr2 s LEU 73 N 1.90 3.25 -0.04 -0.88 1.02 -1.26 -4.87 118.68 117.80 2nr2 s LEU 73 Ca 0.09 1.47 -0.26 0.00 0.02 0.00 0.00 54.13 55.45 2nr2 s LEU 73 Cb -0.18 -4.48 -0.20 0.00 0.02 0.00 0.00 46.19 41.35 2nr2 s LEU 73 CO 0.12 -0.95 1.14 0.03 0.02 0.00 0.00 176.35 176.71 2nr2 h ARG 74 N -0.27 -0.04 -3.36 1.70 3.08 -2.01 -3.36 114.38 110.13 2nr2 h ARG 74 Ca -0.44 0.00 -0.77 0.00 0.07 0.00 0.00 59.98 58.84 2nr2 h ARG 74 Cb 1.19 0.01 -0.19 0.00 0.08 0.00 0.00 29.97 31.06 2nr2 h ARG 74 CO 0.61 0.51 1.67 0.41 -1.07 0.00 0.00 179.97 182.09 2nr2 n GLY 75 N 0.46 4.86 0.00 0.04 0.00 -1.26 -5.32 105.19 103.97 2nr2 n GLY 75 Ca -0.09 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.68 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93